35111 lines
2.4 MiB
35111 lines
2.4 MiB
Entering Gaussian System, Link 0=g09
|
|
Input=NH3.inp
|
|
Output=NH3.out
|
|
Initial command:
|
|
/share/apps/gaussian/g09d01/nehalem/g09/l1.exe "/mnt/beegfs/tmpdir/42440/Gau-143026.inp" -scrdir="/mnt/beegfs/tmpdir/42440/"
|
|
Entering Link 1 = /share/apps/gaussian/g09d01/nehalem/g09/l1.exe PID= 143027.
|
|
|
|
Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2013,
|
|
Gaussian, Inc. All Rights Reserved.
|
|
|
|
This is part of the Gaussian(R) 09 program. It is based on
|
|
the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.),
|
|
the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.),
|
|
the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.),
|
|
the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.),
|
|
the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.),
|
|
the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.),
|
|
the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon
|
|
University), and the Gaussian 82(TM) system (copyright 1983,
|
|
Carnegie Mellon University). Gaussian is a federally registered
|
|
trademark of Gaussian, Inc.
|
|
|
|
This software contains proprietary and confidential information,
|
|
including trade secrets, belonging to Gaussian, Inc.
|
|
|
|
This software is provided under written license and may be
|
|
used, copied, transmitted, or stored only in accord with that
|
|
written license.
|
|
|
|
The following legend is applicable only to US Government
|
|
contracts under FAR:
|
|
|
|
RESTRICTED RIGHTS LEGEND
|
|
|
|
Use, reproduction and disclosure by the US Government is
|
|
subject to restrictions as set forth in subparagraphs (a)
|
|
and (c) of the Commercial Computer Software - Restricted
|
|
Rights clause in FAR 52.227-19.
|
|
|
|
Gaussian, Inc.
|
|
340 Quinnipiac St., Bldg. 40, Wallingford CT 06492
|
|
|
|
|
|
---------------------------------------------------------------
|
|
Warning -- This program may not be used in any manner that
|
|
competes with the business of Gaussian, Inc. or will provide
|
|
assistance to any competitor of Gaussian, Inc. The licensee
|
|
of this program is prohibited from giving any competitor of
|
|
Gaussian, Inc. access to this program. By using this program,
|
|
the user acknowledges that Gaussian, Inc. is engaged in the
|
|
business of creating and licensing software in the field of
|
|
computational chemistry and represents and warrants to the
|
|
licensee that it is not a competitor of Gaussian, Inc. and that
|
|
it will not use this program in any manner prohibited above.
|
|
---------------------------------------------------------------
|
|
|
|
|
|
Cite this work as:
|
|
Gaussian 09, Revision D.01,
|
|
M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria,
|
|
M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, B. Mennucci,
|
|
G. A. Petersson, H. Nakatsuji, M. Caricato, X. Li, H. P. Hratchian,
|
|
A. F. Izmaylov, J. Bloino, G. Zheng, J. L. Sonnenberg, M. Hada,
|
|
M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima,
|
|
Y. Honda, O. Kitao, H. Nakai, T. Vreven, J. A. Montgomery, Jr.,
|
|
J. E. Peralta, F. Ogliaro, M. Bearpark, J. J. Heyd, E. Brothers,
|
|
K. N. Kudin, V. N. Staroverov, T. Keith, R. Kobayashi, J. Normand,
|
|
K. Raghavachari, A. Rendell, J. C. Burant, S. S. Iyengar, J. Tomasi,
|
|
M. Cossi, N. Rega, J. M. Millam, M. Klene, J. E. Knox, J. B. Cross,
|
|
V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R. E. Stratmann,
|
|
O. Yazyev, A. J. Austin, R. Cammi, C. Pomelli, J. W. Ochterski,
|
|
R. L. Martin, K. Morokuma, V. G. Zakrzewski, G. A. Voth,
|
|
P. Salvador, J. J. Dannenberg, S. Dapprich, A. D. Daniels,
|
|
O. Farkas, J. B. Foresman, J. V. Ortiz, J. Cioslowski,
|
|
and D. J. Fox, Gaussian, Inc., Wallingford CT, 2013.
|
|
|
|
******************************************
|
|
Gaussian 09: ES64L-G09RevD.01 24-Apr-2013
|
|
4-Apr-2019
|
|
******************************************
|
|
%nproc=24
|
|
Will use up to 24 processors via shared memory.
|
|
%mem=100GB
|
|
-------------------------------------
|
|
#p ROCCSD(T) cc-pV5Z pop=full gfprint
|
|
-------------------------------------
|
|
1/38=1/1;
|
|
2/12=2,17=6,18=5,40=1/2;
|
|
3/5=16,6=3,11=2,16=1,24=100,25=1,30=1,116=101/1,2,3;
|
|
4//1;
|
|
5/5=2,38=5/2;
|
|
8/5=-1,6=4,9=120000,10=1/1,4;
|
|
9/5=7,14=2/13;
|
|
6/7=3/1;
|
|
99/5=1,9=1/99;
|
|
Leave Link 1 at Thu Apr 4 10:14:23 2019, MaxMem= 13421772800 cpu: 2.1
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l101.exe)
|
|
--
|
|
G2
|
|
--
|
|
Symbolic Z-matrix:
|
|
Charge = 0 Multiplicity = 1
|
|
N
|
|
X 1 1.
|
|
H 1 RNH 2 XNH
|
|
H 1 RNH 2 XNH 3 120. 0
|
|
H 1 RNH 2 XNH 3 240. 0
|
|
Variables:
|
|
RNH 1.01719
|
|
XNH 113.26167
|
|
|
|
NAtoms= 4 NQM= 4 NQMF= 0 NMMI= 0 NMMIF= 0
|
|
NMic= 0 NMicF= 0.
|
|
Isotopes and Nuclear Properties:
|
|
(Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
|
|
in nuclear magnetons)
|
|
|
|
Atom 1 2 3 4
|
|
IAtWgt= 14 1 1 1
|
|
AtmWgt= 14.0030740 1.0078250 1.0078250 1.0078250
|
|
NucSpn= 2 1 1 1
|
|
AtZEff= 0.0000000 0.0000000 0.0000000 0.0000000
|
|
NQMom= 2.0440000 0.0000000 0.0000000 0.0000000
|
|
NMagM= 0.4037610 2.7928460 2.7928460 2.7928460
|
|
AtZNuc= 7.0000000 1.0000000 1.0000000 1.0000000
|
|
Leave Link 101 at Thu Apr 4 10:14:23 2019, MaxMem= 13421772800 cpu: 1.2
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l202.exe)
|
|
Input orientation:
|
|
---------------------------------------------------------------------
|
|
Center Atomic Atomic Coordinates (Angstroms)
|
|
Number Number Type X Y Z
|
|
---------------------------------------------------------------------
|
|
1 7 0 0.000000 0.000000 0.000000
|
|
2 1 0 0.934507 0.000000 -0.401722
|
|
3 1 0 -0.467254 -0.809307 -0.401722
|
|
4 1 0 -0.467254 0.809307 -0.401722
|
|
---------------------------------------------------------------------
|
|
Distance matrix (angstroms):
|
|
1 2 3 4
|
|
1 N 0.000000
|
|
2 H 1.017194 0.000000
|
|
3 H 1.017194 1.618614 0.000000
|
|
4 H 1.017194 1.618614 1.618614 0.000000
|
|
Stoichiometry H3N
|
|
Framework group C3V[C3(N),3SGV(H)]
|
|
Deg. of freedom 2
|
|
Full point group C3V NOp 6
|
|
Largest Abelian subgroup CS NOp 2
|
|
Largest concise Abelian subgroup CS NOp 2
|
|
Standard orientation:
|
|
---------------------------------------------------------------------
|
|
Center Atomic Atomic Coordinates (Angstroms)
|
|
Number Number Type X Y Z
|
|
---------------------------------------------------------------------
|
|
1 7 0 0.000000 0.000000 0.120516
|
|
2 1 0 0.000000 0.934507 -0.281205
|
|
3 1 0 0.809307 -0.467254 -0.281205
|
|
4 1 0 -0.809307 -0.467254 -0.281205
|
|
---------------------------------------------------------------------
|
|
Rotational constants (GHZ): 293.5703380 293.5703380 191.4014844
|
|
Leave Link 202 at Thu Apr 4 10:14:23 2019, MaxMem= 13421772800 cpu: 0.3
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l301.exe)
|
|
Standard basis: CC-pV5Z (5D, 7F)
|
|
Ernie: Thresh= 0.10000D-02 Tol= 0.10000D-05 Strict=F.
|
|
Ernie: 4 primitive shells out of 96 were deleted.
|
|
AO basis set (Overlap normalization):
|
|
Atom N1 Shell 1 S 9 bf 1 - 1 0.000000000000 0.000000000000 0.227743117972
|
|
0.1292000000D+06 0.4103363873D-04
|
|
0.1935000000D+05 0.3492031998D-03
|
|
0.4404000000D+04 0.1818809275D-02
|
|
0.1248000000D+04 0.7582148970D-02
|
|
0.4080000000D+03 0.2690654792D-01
|
|
0.1482000000D+03 0.8043560546D-01
|
|
0.5850000000D+02 0.2004677438D+00
|
|
0.2459000000D+02 0.3727408886D+00
|
|
0.1081000000D+02 0.4288095098D+00
|
|
Atom N1 Shell 2 S 7 bf 2 - 2 0.000000000000 0.000000000000 0.227743117972
|
|
0.1248000000D+04 -0.5373615827D-04
|
|
0.4080000000D+03 -0.2659240897D-03
|
|
0.1482000000D+03 -0.2885829276D-02
|
|
0.5850000000D+02 -0.1497518415D-01
|
|
0.2459000000D+02 -0.8040412273D-01
|
|
0.1081000000D+02 -0.2775818217D+00
|
|
0.4882000000D+01 -0.6753965755D+00
|
|
Atom N1 Shell 3 S 1 bf 3 - 3 0.000000000000 0.000000000000 0.227743117972
|
|
0.2195000000D+01 0.1000000000D+01
|
|
Atom N1 Shell 4 S 1 bf 4 - 4 0.000000000000 0.000000000000 0.227743117972
|
|
0.8715000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 5 S 1 bf 5 - 5 0.000000000000 0.000000000000 0.227743117972
|
|
0.3504000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 6 S 1 bf 6 - 6 0.000000000000 0.000000000000 0.227743117972
|
|
0.1397000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 7 P 4 bf 7 - 9 0.000000000000 0.000000000000 0.227743117972
|
|
0.1470000000D+03 0.6498223793D-02
|
|
0.3476000000D+02 0.5159240011D-01
|
|
0.1100000000D+02 0.2390646995D+00
|
|
0.3995000000D+01 0.7883030251D+00
|
|
Atom N1 Shell 8 P 1 bf 10 - 12 0.000000000000 0.000000000000 0.227743117972
|
|
0.1587000000D+01 0.1000000000D+01
|
|
Atom N1 Shell 9 P 1 bf 13 - 15 0.000000000000 0.000000000000 0.227743117972
|
|
0.6533000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 10 P 1 bf 16 - 18 0.000000000000 0.000000000000 0.227743117972
|
|
0.2686000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 11 P 1 bf 19 - 21 0.000000000000 0.000000000000 0.227743117972
|
|
0.1067000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 12 D 1 bf 22 - 26 0.000000000000 0.000000000000 0.227743117972
|
|
0.4647000000D+01 0.1000000000D+01
|
|
Atom N1 Shell 13 D 1 bf 27 - 31 0.000000000000 0.000000000000 0.227743117972
|
|
0.1813000000D+01 0.1000000000D+01
|
|
Atom N1 Shell 14 D 1 bf 32 - 36 0.000000000000 0.000000000000 0.227743117972
|
|
0.7070000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 15 D 1 bf 37 - 41 0.000000000000 0.000000000000 0.227743117972
|
|
0.2760000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 16 F 1 bf 42 - 48 0.000000000000 0.000000000000 0.227743117972
|
|
0.2942000000D+01 0.1000000000D+01
|
|
Atom N1 Shell 17 F 1 bf 49 - 55 0.000000000000 0.000000000000 0.227743117972
|
|
0.1204000000D+01 0.1000000000D+01
|
|
Atom N1 Shell 18 F 1 bf 56 - 62 0.000000000000 0.000000000000 0.227743117972
|
|
0.4930000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 19 G 1 bf 63 - 71 0.000000000000 0.000000000000 0.227743117972
|
|
0.2511000000D+01 0.1000000000D+01
|
|
Atom N1 Shell 20 G 1 bf 72 - 80 0.000000000000 0.000000000000 0.227743117972
|
|
0.9420000000D+00 0.1000000000D+01
|
|
Atom N1 Shell 21 H 1 bf 81 - 91 0.000000000000 0.000000000000 0.227743117972
|
|
0.1768000000D+01 0.1000000000D+01
|
|
Atom H2 Shell 22 S 4 bf 92 - 92 0.000000000000 1.765963069361 -0.531400608601
|
|
0.4020000000D+03 0.5088104278D-02
|
|
0.6024000000D+02 0.3948295972D-01
|
|
0.1373000000D+02 0.2042718854D+00
|
|
0.3905000000D+01 0.8184370745D+00
|
|
Atom H2 Shell 23 S 1 bf 93 - 93 0.000000000000 1.765963069361 -0.531400608601
|
|
0.1283000000D+01 0.1000000000D+01
|
|
Atom H2 Shell 24 S 1 bf 94 - 94 0.000000000000 1.765963069361 -0.531400608601
|
|
0.4655000000D+00 0.1000000000D+01
|
|
Atom H2 Shell 25 S 1 bf 95 - 95 0.000000000000 1.765963069361 -0.531400608601
|
|
0.1811000000D+00 0.1000000000D+01
|
|
Atom H2 Shell 26 S 1 bf 96 - 96 0.000000000000 1.765963069361 -0.531400608601
|
|
0.7279000000D-01 0.1000000000D+01
|
|
Atom H2 Shell 27 P 1 bf 97 - 99 0.000000000000 1.765963069361 -0.531400608601
|
|
0.4516000000D+01 0.1000000000D+01
|
|
Atom H2 Shell 28 P 1 bf 100 - 102 0.000000000000 1.765963069361 -0.531400608601
|
|
0.1712000000D+01 0.1000000000D+01
|
|
Atom H2 Shell 29 P 1 bf 103 - 105 0.000000000000 1.765963069361 -0.531400608601
|
|
0.6490000000D+00 0.1000000000D+01
|
|
Atom H2 Shell 30 P 1 bf 106 - 108 0.000000000000 1.765963069361 -0.531400608601
|
|
0.2460000000D+00 0.1000000000D+01
|
|
Atom H2 Shell 31 D 1 bf 109 - 113 0.000000000000 1.765963069361 -0.531400608601
|
|
0.2950000000D+01 0.1000000000D+01
|
|
Atom H2 Shell 32 D 1 bf 114 - 118 0.000000000000 1.765963069361 -0.531400608601
|
|
0.1206000000D+01 0.1000000000D+01
|
|
Atom H2 Shell 33 D 1 bf 119 - 123 0.000000000000 1.765963069361 -0.531400608601
|
|
0.4930000000D+00 0.1000000000D+01
|
|
Atom H2 Shell 34 F 1 bf 124 - 130 0.000000000000 1.765963069361 -0.531400608601
|
|
0.2506000000D+01 0.1000000000D+01
|
|
Atom H2 Shell 35 F 1 bf 131 - 137 0.000000000000 1.765963069361 -0.531400608601
|
|
0.8750000000D+00 0.1000000000D+01
|
|
Atom H2 Shell 36 G 1 bf 138 - 146 0.000000000000 1.765963069361 -0.531400608601
|
|
0.2358000000D+01 0.1000000000D+01
|
|
Atom H3 Shell 37 S 4 bf 147 - 147 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.4020000000D+03 0.5088104278D-02
|
|
0.6024000000D+02 0.3948295972D-01
|
|
0.1373000000D+02 0.2042718854D+00
|
|
0.3905000000D+01 0.8184370745D+00
|
|
Atom H3 Shell 38 S 1 bf 148 - 148 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.1283000000D+01 0.1000000000D+01
|
|
Atom H3 Shell 39 S 1 bf 149 - 149 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.4655000000D+00 0.1000000000D+01
|
|
Atom H3 Shell 40 S 1 bf 150 - 150 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.1811000000D+00 0.1000000000D+01
|
|
Atom H3 Shell 41 S 1 bf 151 - 151 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.7279000000D-01 0.1000000000D+01
|
|
Atom H3 Shell 42 P 1 bf 152 - 154 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.4516000000D+01 0.1000000000D+01
|
|
Atom H3 Shell 43 P 1 bf 155 - 157 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.1712000000D+01 0.1000000000D+01
|
|
Atom H3 Shell 44 P 1 bf 158 - 160 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.6490000000D+00 0.1000000000D+01
|
|
Atom H3 Shell 45 P 1 bf 161 - 163 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.2460000000D+00 0.1000000000D+01
|
|
Atom H3 Shell 46 D 1 bf 164 - 168 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.2950000000D+01 0.1000000000D+01
|
|
Atom H3 Shell 47 D 1 bf 169 - 173 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.1206000000D+01 0.1000000000D+01
|
|
Atom H3 Shell 48 D 1 bf 174 - 178 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.4930000000D+00 0.1000000000D+01
|
|
Atom H3 Shell 49 F 1 bf 179 - 185 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.2506000000D+01 0.1000000000D+01
|
|
Atom H3 Shell 50 F 1 bf 186 - 192 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.8750000000D+00 0.1000000000D+01
|
|
Atom H3 Shell 51 G 1 bf 193 - 201 1.529368880212 -0.882981534680 -0.531400608601
|
|
0.2358000000D+01 0.1000000000D+01
|
|
Atom H4 Shell 52 S 4 bf 202 - 202 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.4020000000D+03 0.5088104278D-02
|
|
0.6024000000D+02 0.3948295972D-01
|
|
0.1373000000D+02 0.2042718854D+00
|
|
0.3905000000D+01 0.8184370745D+00
|
|
Atom H4 Shell 53 S 1 bf 203 - 203 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.1283000000D+01 0.1000000000D+01
|
|
Atom H4 Shell 54 S 1 bf 204 - 204 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.4655000000D+00 0.1000000000D+01
|
|
Atom H4 Shell 55 S 1 bf 205 - 205 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.1811000000D+00 0.1000000000D+01
|
|
Atom H4 Shell 56 S 1 bf 206 - 206 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.7279000000D-01 0.1000000000D+01
|
|
Atom H4 Shell 57 P 1 bf 207 - 209 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.4516000000D+01 0.1000000000D+01
|
|
Atom H4 Shell 58 P 1 bf 210 - 212 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.1712000000D+01 0.1000000000D+01
|
|
Atom H4 Shell 59 P 1 bf 213 - 215 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.6490000000D+00 0.1000000000D+01
|
|
Atom H4 Shell 60 P 1 bf 216 - 218 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.2460000000D+00 0.1000000000D+01
|
|
Atom H4 Shell 61 D 1 bf 219 - 223 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.2950000000D+01 0.1000000000D+01
|
|
Atom H4 Shell 62 D 1 bf 224 - 228 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.1206000000D+01 0.1000000000D+01
|
|
Atom H4 Shell 63 D 1 bf 229 - 233 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.4930000000D+00 0.1000000000D+01
|
|
Atom H4 Shell 64 F 1 bf 234 - 240 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.2506000000D+01 0.1000000000D+01
|
|
Atom H4 Shell 65 F 1 bf 241 - 247 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.8750000000D+00 0.1000000000D+01
|
|
Atom H4 Shell 66 G 1 bf 248 - 256 -1.529368880212 -0.882981534680 -0.531400608601
|
|
0.2358000000D+01 0.1000000000D+01
|
|
There are 196 symmetry adapted cartesian basis functions of A' symmetry.
|
|
There are 140 symmetry adapted cartesian basis functions of A" symmetry.
|
|
There are 146 symmetry adapted basis functions of A' symmetry.
|
|
There are 110 symmetry adapted basis functions of A" symmetry.
|
|
256 basis functions, 368 primitive gaussians, 336 cartesian basis functions
|
|
5 alpha electrons 5 beta electrons
|
|
nuclear repulsion energy 11.9056721986 Hartrees.
|
|
IExCor= 0 DFT=F Ex=HF Corr=None ExCW=0 ScaHFX= 1.000000
|
|
ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000
|
|
IRadAn= 0 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi= 4
|
|
NAtoms= 4 NActive= 4 NUniq= 2 SFac= 4.00D+00 NAtFMM= 60 NAOKFM=F Big=F
|
|
Integral buffers will be 131072 words long.
|
|
Raffenetti 2 integral format.
|
|
Two-electron integral symmetry is turned on.
|
|
Leave Link 301 at Thu Apr 4 10:14:23 2019, MaxMem= 13421772800 cpu: 1.2
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l302.exe)
|
|
NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1
|
|
NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0.
|
|
One-electron integrals computed using PRISM.
|
|
One-electron integral symmetry used in STVInt
|
|
NBasis= 256 RedAO= T EigKep= 3.68D-05 NBF= 146 110
|
|
NBsUse= 256 1.00D-06 EigRej= -1.00D+00 NBFU= 146 110
|
|
Leave Link 302 at Thu Apr 4 10:14:24 2019, MaxMem= 13421772800 cpu: 9.9
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l303.exe)
|
|
DipDrv: MaxL=1.
|
|
Leave Link 303 at Thu Apr 4 10:14:24 2019, MaxMem= 13421772800 cpu: 1.0
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l401.exe)
|
|
ExpMin= 7.28D-02 ExpMax= 1.29D+05 ExpMxC= 4.08D+02 IAcc=2 IRadAn= 4 AccDes= 0.00D+00
|
|
Harris functional with IExCor= 205 and IRadAn= 4 diagonalized for initial guess.
|
|
HarFok: IExCor= 205 AccDes= 0.00D+00 IRadAn= 4 IDoV= 1 UseB2=F ITyADJ=14
|
|
ICtDFT= 3500011 ScaDFX= 1.000000 1.000000 1.000000 1.000000
|
|
FoFCou: FMM=F IPFlag= 0 FMFlag= 100000 FMFlg1= 0
|
|
NFxFlg= 0 DoJE=T BraDBF=F KetDBF=T FulRan=T
|
|
wScrn= 0.000000 ICntrl= 500 IOpCl= 0 I1Cent= 200000004 NGrid= 0
|
|
NMat0= 1 NMatS0= 1 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0
|
|
Petite list used in FoFCou.
|
|
Harris En= -56.3594108321406
|
|
JPrj=0 DoOrth=F DoCkMO=F.
|
|
Initial guess orbital symmetries:
|
|
Occupied (A1) (A1) (E) (E) (A1)
|
|
Virtual (A1) (E) (E) (A1) (E) (E) (A1) (E) (E) (E) (E)
|
|
(A1) (A1) (E) (E) (A2) (E) (E) (A1) (E) (E) (A1)
|
|
(E) (E) (A1) (E) (E) (A1) (E) (E) (A1) (A2) (E)
|
|
(E) (E) (E) (A2) (E) (E) (A1) (E) (E) (A1) (E)
|
|
(E) (E) (E) (A1) (A1) (E) (E) (E) (E) (A2) (A1)
|
|
(E) (E) (A1) (E) (E) (A1) (A2) (A1) (E) (E) (E)
|
|
(E) (A1) (E) (E) (E) (E) (E) (E) (A1) (A2) (E)
|
|
(E) (A1) (E) (E) (A2) (E) (E) (E) (E) (A1) (A1)
|
|
(E) (E) (A1) (A2) (E) (E) (E) (E) (A1) (A2) (E)
|
|
(E) (E) (E) (A1) (A2) (E) (E) (A1) (E) (E) (A1)
|
|
(A2) (E) (E) (A1) (A1) (E) (E) (A1) (E) (E) (E)
|
|
(E) (E) (E) (A1) (E) (E) (A2) (E) (E) (A1) (E)
|
|
(E) (E) (E) (A2) (A1) (E) (E) (E) (E) (A1) (E)
|
|
(E) (A2) (A1) (A1) (E) (E) (E) (E) (A1) (E) (E)
|
|
(E) (E) (A2) (E) (E) (A1) (E) (E) (A1) (A2) (E)
|
|
(E) (A1) (E) (E) (A2) (A1) (A2) (E) (E) (E) (E)
|
|
(E) (E) (A1) (A2) (E) (E) (A1) (E) (E) (A2) (E)
|
|
(E) (A1) (E) (E) (E) (E) (A1) (A1) (E) (E) (E)
|
|
(E) (A2) (E) (E) (A2) (E) (E) (A1) (A1) (E) (E)
|
|
(A1) (E) (E) (A1) (E) (E) (A1) (A2) (E) (E) (E)
|
|
(E) (E) (E) (A1) (A1) (E) (E) (E) (E) (A2) (E)
|
|
(E) (A1) (E) (E) (A2) (E) (E) (E) (E) (A2) (A1)
|
|
(E) (E) (A1) (E) (E) (A1) (E) (E) (A1)
|
|
The electronic state of the initial guess is 1-A1.
|
|
Leave Link 401 at Thu Apr 4 10:14:24 2019, MaxMem= 13421772800 cpu: 14.7
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l502.exe)
|
|
Restricted open shell SCF:
|
|
Using DIIS extrapolation, IDIIS= 1040.
|
|
Integral symmetry usage will be decided dynamically.
|
|
Keep R1 and R2 ints in memory in symmetry-blocked form, NReq=812548042.
|
|
IVT= 368238 IEndB= 368238 NGot= 13421772800 MDV= 12879928711
|
|
LenX= 12879928711 LenY= 12879815374
|
|
Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.
|
|
Requested convergence on MAX density matrix=1.00D-06.
|
|
Requested convergence on energy=1.00D-06.
|
|
No special actions if energy rises.
|
|
FoFCou: FMM=F IPFlag= 0 FMFlag= 0 FMFlg1= 0
|
|
NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T
|
|
wScrn= 0.000000 ICntrl= 600 IOpCl= 0 I1Cent= 0 NGrid= 0
|
|
NMat0= 1 NMatS0= 32896 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0
|
|
Petite list used in FoFCou.
|
|
|
|
Cycle 1 Pass 1 IDiag 1:
|
|
E= -56.1105706993835
|
|
DIIS: error= 4.18D-02 at cycle 1 NSaved= 1.
|
|
NSaved= 1 IEnMin= 1 EnMin= -56.1105706993835 IErMin= 1 ErrMin= 4.18D-02
|
|
ErrMax= 4.18D-02 0.00D+00 EMaxC= 1.00D-01 BMatC= 2.18D-01 BMatP= 2.18D-01
|
|
IDIUse=3 WtCom= 5.82D-01 WtEn= 4.18D-01
|
|
Coeff-Com: 0.100D+01
|
|
Coeff-En: 0.100D+01
|
|
Coeff: 0.100D+01
|
|
Gap= 0.419 Goal= None Shift= 0.000
|
|
GapD= 0.419 DampG=2.000 DampE=0.500 DampFc=1.0000 IDamp=-1.
|
|
RMSDP=1.50D-03 MaxDP=7.50D-02 OVMax= 1.50D-01
|
|
|
|
Cycle 2 Pass 1 IDiag 1:
|
|
E= -56.1879410611394 Delta-E= -0.077370361756 Rises=F Damp=F
|
|
DIIS: error= 2.26D-02 at cycle 2 NSaved= 2.
|
|
NSaved= 2 IEnMin= 2 EnMin= -56.1879410611394 IErMin= 2 ErrMin= 2.26D-02
|
|
ErrMax= 2.26D-02 0.00D+00 EMaxC= 1.00D-01 BMatC= 4.76D-02 BMatP= 2.18D-01
|
|
IDIUse=3 WtCom= 7.74D-01 WtEn= 2.26D-01
|
|
Coeff-Com: 0.283D+00 0.717D+00
|
|
Coeff-En: 0.866D-01 0.913D+00
|
|
Coeff: 0.239D+00 0.761D+00
|
|
Gap= 0.550 Goal= None Shift= 0.000
|
|
RMSDP=9.61D-04 MaxDP=5.21D-02 DE=-7.74D-02 OVMax= 7.31D-02
|
|
|
|
Cycle 3 Pass 1 IDiag 1:
|
|
E= -56.2223868226571 Delta-E= -0.034445761518 Rises=F Damp=F
|
|
DIIS: error= 5.36D-03 at cycle 3 NSaved= 3.
|
|
NSaved= 3 IEnMin= 3 EnMin= -56.2223868226571 IErMin= 3 ErrMin= 5.36D-03
|
|
ErrMax= 5.36D-03 0.00D+00 EMaxC= 1.00D-01 BMatC= 2.22D-03 BMatP= 4.76D-02
|
|
IDIUse=3 WtCom= 9.46D-01 WtEn= 5.36D-02
|
|
Coeff-Com: -0.325D-01 0.138D+00 0.895D+00
|
|
Coeff-En: 0.000D+00 0.000D+00 0.100D+01
|
|
Coeff: -0.308D-01 0.130D+00 0.900D+00
|
|
Gap= 0.524 Goal= None Shift= 0.000
|
|
RMSDP=6.22D-05 MaxDP=3.14D-03 DE=-3.44D-02 OVMax= 1.21D-02
|
|
|
|
Cycle 4 Pass 1 IDiag 1:
|
|
E= -56.2241031934214 Delta-E= -0.001716370764 Rises=F Damp=F
|
|
DIIS: error= 3.89D-04 at cycle 4 NSaved= 4.
|
|
NSaved= 4 IEnMin= 4 EnMin= -56.2241031934214 IErMin= 4 ErrMin= 3.89D-04
|
|
ErrMax= 3.89D-04 0.00D+00 EMaxC= 1.00D-01 BMatC= 1.00D-05 BMatP= 2.22D-03
|
|
IDIUse=3 WtCom= 9.96D-01 WtEn= 3.89D-03
|
|
Coeff-Com: 0.772D-02-0.492D-01-0.255D+00 0.130D+01
|
|
Coeff-En: 0.000D+00 0.000D+00 0.000D+00 0.100D+01
|
|
Coeff: 0.769D-02-0.490D-01-0.254D+00 0.130D+01
|
|
Gap= 0.525 Goal= None Shift= 0.000
|
|
RMSDP=6.52D-05 MaxDP=4.09D-03 DE=-1.72D-03 OVMax= 3.00D-03
|
|
|
|
Cycle 5 Pass 1 IDiag 1:
|
|
E= -56.2241262472090 Delta-E= -0.000023053788 Rises=F Damp=F
|
|
DIIS: error= 6.45D-05 at cycle 5 NSaved= 5.
|
|
NSaved= 5 IEnMin= 5 EnMin= -56.2241262472090 IErMin= 5 ErrMin= 6.45D-05
|
|
ErrMax= 6.45D-05 0.00D+00 EMaxC= 1.00D-01 BMatC= 5.17D-07 BMatP= 1.00D-05
|
|
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
|
|
Coeff-Com: -0.482D-03 0.514D-02 0.269D-01-0.362D+00 0.133D+01
|
|
Coeff: -0.482D-03 0.514D-02 0.269D-01-0.362D+00 0.133D+01
|
|
Gap= 0.525 Goal= None Shift= 0.000
|
|
RMSDP=2.01D-05 MaxDP=1.32D-03 DE=-2.31D-05 OVMax= 1.06D-03
|
|
|
|
Cycle 6 Pass 1 IDiag 1:
|
|
E= -56.2241277864601 Delta-E= -0.000001539251 Rises=F Damp=F
|
|
DIIS: error= 9.65D-06 at cycle 6 NSaved= 6.
|
|
NSaved= 6 IEnMin= 6 EnMin= -56.2241277864601 IErMin= 6 ErrMin= 9.65D-06
|
|
ErrMax= 9.65D-06 0.00D+00 EMaxC= 1.00D-01 BMatC= 8.76D-09 BMatP= 5.17D-07
|
|
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
|
|
Coeff-Com: -0.510D-05-0.470D-03-0.352D-02 0.805D-01-0.401D+00 0.132D+01
|
|
Coeff: -0.510D-05-0.470D-03-0.352D-02 0.805D-01-0.401D+00 0.132D+01
|
|
Gap= 0.525 Goal= None Shift= 0.000
|
|
RMSDP=2.54D-06 MaxDP=1.83D-04 DE=-1.54D-06 OVMax= 1.72D-04
|
|
|
|
Cycle 7 Pass 1 IDiag 1:
|
|
E= -56.2241278179944 Delta-E= -0.000000031534 Rises=F Damp=F
|
|
DIIS: error= 2.46D-06 at cycle 7 NSaved= 7.
|
|
NSaved= 7 IEnMin= 7 EnMin= -56.2241278179944 IErMin= 7 ErrMin= 2.46D-06
|
|
ErrMax= 2.46D-06 0.00D+00 EMaxC= 1.00D-01 BMatC= 2.27D-10 BMatP= 8.76D-09
|
|
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
|
|
Coeff-Com: 0.161D-04-0.154D-04 0.218D-03-0.125D-01 0.758D-01-0.356D+00
|
|
Coeff-Com: 0.129D+01
|
|
Coeff: 0.161D-04-0.154D-04 0.218D-03-0.125D-01 0.758D-01-0.356D+00
|
|
Coeff: 0.129D+01
|
|
Gap= 0.525 Goal= None Shift= 0.000
|
|
RMSDP=3.24D-07 MaxDP=2.28D-05 DE=-3.15D-08 OVMax= 2.75D-05
|
|
|
|
Cycle 8 Pass 1 IDiag 1:
|
|
E= -56.2241278189325 Delta-E= -0.000000000938 Rises=F Damp=F
|
|
DIIS: error= 4.83D-07 at cycle 8 NSaved= 8.
|
|
NSaved= 8 IEnMin= 8 EnMin= -56.2241278189325 IErMin= 8 ErrMin= 4.83D-07
|
|
ErrMax= 4.83D-07 0.00D+00 EMaxC= 1.00D-01 BMatC= 1.57D-11 BMatP= 2.27D-10
|
|
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
|
|
Coeff-Com: -0.406D-05 0.282D-04 0.114D-03-0.992D-03 0.327D-03 0.264D-01
|
|
Coeff-Com: -0.343D+00 0.132D+01
|
|
Coeff: -0.406D-05 0.282D-04 0.114D-03-0.992D-03 0.327D-03 0.264D-01
|
|
Coeff: -0.343D+00 0.132D+01
|
|
Gap= 0.525 Goal= None Shift= 0.000
|
|
RMSDP=3.55D-08 MaxDP=1.72D-06 DE=-9.38D-10 OVMax= 7.12D-06
|
|
|
|
Cycle 9 Pass 1 IDiag 1:
|
|
E= -56.2241278189859 Delta-E= -0.000000000053 Rises=F Damp=F
|
|
DIIS: error= 1.08D-07 at cycle 9 NSaved= 9.
|
|
NSaved= 9 IEnMin= 9 EnMin= -56.2241278189859 IErMin= 9 ErrMin= 1.08D-07
|
|
ErrMax= 1.08D-07 0.00D+00 EMaxC= 1.00D-01 BMatC= 8.80D-13 BMatP= 1.57D-11
|
|
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
|
|
Coeff-Com: -0.961D-07-0.463D-05-0.317D-04 0.829D-03-0.372D-02 0.167D-01
|
|
Coeff-Com: -0.119D-01-0.220D+00 0.122D+01
|
|
Coeff: -0.961D-07-0.463D-05-0.317D-04 0.829D-03-0.372D-02 0.167D-01
|
|
Coeff: -0.119D-01-0.220D+00 0.122D+01
|
|
Gap= 0.525 Goal= None Shift= 0.000
|
|
RMSDP=2.31D-08 MaxDP=1.69D-06 DE=-5.33D-11 OVMax= 1.23D-06
|
|
|
|
Cycle 10 Pass 1 IDiag 1:
|
|
E= -56.2241278189896 Delta-E= -0.000000000004 Rises=F Damp=F
|
|
DIIS: error= 3.15D-08 at cycle 10 NSaved= 10.
|
|
NSaved=10 IEnMin=10 EnMin= -56.2241278189896 IErMin=10 ErrMin= 3.15D-08
|
|
ErrMax= 3.15D-08 0.00D+00 EMaxC= 1.00D-01 BMatC= 6.50D-14 BMatP= 8.80D-13
|
|
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
|
|
Coeff-Com: 0.323D-06-0.851D-06 0.157D-05-0.181D-03 0.960D-03-0.611D-02
|
|
Coeff-Com: 0.220D-01-0.222D-01-0.355D+00 0.136D+01
|
|
Coeff: 0.323D-06-0.851D-06 0.157D-05-0.181D-03 0.960D-03-0.611D-02
|
|
Coeff: 0.220D-01-0.222D-01-0.355D+00 0.136D+01
|
|
Gap= 0.525 Goal= None Shift= 0.000
|
|
RMSDP=2.28D-09 MaxDP=1.45D-07 DE=-3.71D-12 OVMax= 4.49D-07
|
|
|
|
SCF Done: E(ROHF) = -56.2241278190 A.U. after 10 cycles
|
|
NFock= 10 Conv=0.23D-08 -V/T= 2.0015
|
|
<Sx>= 0.0000 <Sy>= 0.0000 <Sz>= 0.0000 <S**2>= 0.0000 S= 0.0000
|
|
<L.S>= 0.000000000000E+00
|
|
KE= 5.613969708360D+01 PE=-1.556690267251D+02 EE= 3.139952962391D+01
|
|
Annihilation of the first spin contaminant:
|
|
S**2 before annihilation 0.0000, after 0.0000
|
|
Leave Link 502 at Thu Apr 4 10:14:42 2019, MaxMem= 13421772800 cpu: 420.2
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l801.exe)
|
|
Windowed orbitals will be sorted by symmetry type.
|
|
GenMOA: NOpAll= 6 NOp2=2 NOpUse= 6 JSym2X=1
|
|
FoFJK: IHMeth= 1 ICntrl= 0 DoSepK=F KAlg= 0 I1Cent= 0 FoldK=F
|
|
IRaf= 0 NMat= 1 IRICut= 1 DoRegI=T DoRafI=F ISym2E= 1.
|
|
FoFCou: FMM=F IPFlag= 0 FMFlag= 100000 FMFlg1= 0
|
|
NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T
|
|
wScrn= 0.000000 ICntrl= 0 IOpCl= 1 I1Cent= 0 NGrid= 0
|
|
NMat0= 1 NMatS0= 1 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0
|
|
Petite list used in FoFCou.
|
|
<Sx>= 0.0000 <Sy>= 0.0000 <Sz>= 0.0000 <S**2>= 0.0000 S= 0.0000
|
|
ExpMin= 7.28D-02 ExpMax= 1.29D+05 ExpMxC= 4.08D+02 IAcc=3 IRadAn= 5 AccDes= 0.00D+00
|
|
HarFok: IExCor= 205 AccDes= 0.00D+00 IRadAn= 5 IDoV=-2 UseB2=F ITyADJ=14
|
|
ICtDFT= 12500011 ScaDFX= 1.000000 1.000000 1.000000 1.000000
|
|
Largest valence mixing into a core orbital is 1.85D-04
|
|
Largest core mixing into a valence orbital is 2.80D-05
|
|
Largest valence mixing into a core orbital is 1.85D-04
|
|
Largest core mixing into a valence orbital is 2.80D-05
|
|
Range of M.O.s used for correlation: 2 256
|
|
NBasis= 256 NAE= 5 NBE= 5 NFC= 1 NFV= 0
|
|
NROrb= 255 NOA= 4 NOB= 4 NVA= 251 NVB= 251
|
|
|
|
**** Warning!!: The largest alpha MO coefficient is 0.39504291D+02
|
|
|
|
|
|
**** Warning!!: The largest beta MO coefficient is 0.39504291D+02
|
|
|
|
Singles contribution to E2= -0.7507004145D-15
|
|
Leave Link 801 at Thu Apr 4 10:14:49 2019, MaxMem= 13421772800 cpu: 159.4
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l804.exe)
|
|
Open-shell transformation, MDV= 13421772800 ITran=4 ISComp=2.
|
|
Semi-Direct transformation.
|
|
ModeAB= 4 MOrb= 4 LenV= 13419679997
|
|
LASXX= 16367412 LTotXX= 16367412 LenRXX= 32941792
|
|
LTotAB= 16574380 MaxLAS= 40169640 LenRXY= 0
|
|
NonZer= 49309204 LenScr= 74448896 LnRSAI= 40169640
|
|
LnScr1= 60751872 LExtra= 0 Total= 208312200
|
|
MaxDsk= -1 SrtSym= T ITran= 4
|
|
DoSDTr: NPSUse= 24
|
|
JobTyp=1 Pass 1: I= 1 to 4.
|
|
(rs|ai) integrals will be sorted in core.
|
|
Complete sort for first half transformation.
|
|
First half transformation complete.
|
|
Complete sort for second half transformation.
|
|
Second half transformation complete.
|
|
ModeAB= 4 MOrb= 4 LenV= 13419679997
|
|
LASXX= 16367412 LTotXX= 16367412 LenRXX= 32425244
|
|
LTotAB= 16057832 MaxLAS= 40169640 LenRXY= 0
|
|
NonZer= 48792656 LenScr= 73728000 LnRSAI= 40169640
|
|
LnScr1= 60751872 LExtra= 0 Total= 207074756
|
|
MaxDsk= -1 SrtSym= T ITran= 4
|
|
DoSDTr: NPSUse= 24
|
|
JobTyp=2 Pass 1: I= 1 to 4.
|
|
(rs|ai) integrals will be sorted in core.
|
|
Complete sort for first half transformation.
|
|
First half transformation complete.
|
|
Complete sort for second half transformation.
|
|
Second half transformation complete.
|
|
Spin components of T(2) and E(2):
|
|
alpha-alpha T2 = 0.7990038897D-02 E2= -0.2746478311D-01
|
|
alpha-beta T2 = 0.5238331607D-01 E2= -0.2034272074D+00
|
|
beta-beta T2 = 0.7990038897D-02 E2= -0.2746478311D-01
|
|
ANorm= 0.1033616657D+01
|
|
E2 = -0.2583567736D+00 EUMP2 = -0.56482484592629D+02
|
|
(S**2,0)= 0.00000D+00 (S**2,1)= 0.00000D+00
|
|
E(PUHF)= -0.56224127819D+02 E(PMP2)= -0.56482484593D+02
|
|
Leave Link 804 at Thu Apr 4 10:15:11 2019, MaxMem= 13421772800 cpu: 528.8
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l913.exe)
|
|
CIDS: MDV= 13421772800.
|
|
Frozen-core window: NFC= 1 NFV= 0.
|
|
IFCWin=0 IBDFC=1 NFBD= 0 0 NFCmp= 0 0 NFFFC= 0 0
|
|
Using original routines for 1st iteration, S=T.
|
|
Using DD4UQ or CC4UQ for 2nd and later iterations.
|
|
Keep R2 and R3 ints in memory in symmetry-blocked form, NReq=812181890.
|
|
FoFCou: FMM=F IPFlag= 0 FMFlag= 0 FMFlg1= 0
|
|
NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T
|
|
wScrn= 0.000000 ICntrl= 600 IOpCl= 0 I1Cent= 0 NGrid= 0
|
|
NMat0= 1 NMatS0= 32896 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0
|
|
Petite list used in FoFCou.
|
|
CCSD(T)
|
|
=======
|
|
Iterations= 50 Convergence= 0.100D-06
|
|
Iteration Nr. 1
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
MP4(R+Q)= 0.12042666D-01
|
|
Maximum subspace dimension= 5
|
|
Norm of the A-vectors is 3.7213630D-02 conv= 1.00D-05.
|
|
RLE energy= -0.2532411592
|
|
E3= -0.68237133D-02 EROMP3= -0.56489308306D+02
|
|
E4(SDQ)= -0.10633529D-02 ROMP4(SDQ)= -0.56490371659D+02
|
|
VARIATIONAL ENERGIES WITH THE FIRST-ORDER WAVEFUNCTION:
|
|
DE(Corr)= -0.25313782 E(Corr)= -56.477265640
|
|
NORM(A)= 0.10319745D+01
|
|
Iteration Nr. 2
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 1.7542893D-01 conv= 1.00D-05.
|
|
RLE energy= -0.2544760441
|
|
DE(Corr)= -0.25975227 E(CORR)= -56.483880088 Delta=-6.61D-03
|
|
NORM(A)= 0.10324155D+01
|
|
Iteration Nr. 3
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 1.4914659D-01 conv= 1.00D-05.
|
|
RLE energy= -0.2618466528
|
|
DE(Corr)= -0.26073754 E(CORR)= -56.484865358 Delta=-9.85D-04
|
|
NORM(A)= 0.10354354D+01
|
|
Iteration Nr. 4
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 6.2088160D-02 conv= 1.00D-05.
|
|
RLE energy= -0.2661612683
|
|
DE(Corr)= -0.26385579 E(CORR)= -56.487983610 Delta=-3.12D-03
|
|
NORM(A)= 0.10379495D+01
|
|
Iteration Nr. 5
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 4.1301151D-03 conv= 1.00D-05.
|
|
RLE energy= -0.2661480042
|
|
DE(Corr)= -0.26612292 E(CORR)= -56.490250736 Delta=-2.27D-03
|
|
NORM(A)= 0.10379903D+01
|
|
Iteration Nr. 6
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 1.2476252D-03 conv= 1.00D-05.
|
|
RLE energy= -0.2660777460
|
|
DE(Corr)= -0.26610729 E(CORR)= -56.490235113 Delta= 1.56D-05
|
|
NORM(A)= 0.10379596D+01
|
|
Iteration Nr. 7
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 3.1745290D-04 conv= 1.00D-05.
|
|
RLE energy= -0.2660752810
|
|
DE(Corr)= -0.26607600 E(CORR)= -56.490203822 Delta= 3.13D-05
|
|
NORM(A)= 0.10379609D+01
|
|
Iteration Nr. 8
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 9.0215813D-05 conv= 1.00D-05.
|
|
RLE energy= -0.2660760889
|
|
DE(Corr)= -0.26607658 E(CORR)= -56.490204404 Delta=-5.82D-07
|
|
NORM(A)= 0.10379610D+01
|
|
Iteration Nr. 9
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 4.6070276D-05 conv= 1.00D-05.
|
|
RLE energy= -0.2660761773
|
|
DE(Corr)= -0.26607576 E(CORR)= -56.490203579 Delta= 8.25D-07
|
|
NORM(A)= 0.10379616D+01
|
|
Iteration Nr. 10
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 1.4775132D-05 conv= 1.00D-05.
|
|
RLE energy= -0.2660759929
|
|
DE(Corr)= -0.26607600 E(CORR)= -56.490203820 Delta=-2.41D-07
|
|
NORM(A)= 0.10379615D+01
|
|
Iteration Nr. 11
|
|
**********************
|
|
DD1Dir will call FoFMem 1 times, MxPair= 44
|
|
NAB= 16 NAA= 6 NBB= 6.
|
|
Norm of the A-vectors is 4.2844302D-06 conv= 1.00D-05.
|
|
RLE energy= -0.2660759770
|
|
DE(Corr)= -0.26607596 E(CORR)= -56.490203783 Delta= 3.78D-08
|
|
NORM(A)= 0.10379615D+01
|
|
CI/CC converged in 11 iterations to DelEn= 3.78D-08 Conv= 1.00D-07 ErrA1= 4.28D-06 Conv= 1.00D-05
|
|
Largest amplitude= 2.95D-02
|
|
Time for triples= 51829.48 seconds.
|
|
T4(CCSD)= -0.93964710D-02
|
|
T5(CCSD)= 0.24439797D-03
|
|
CCSD(T)= -0.56499355856D+02
|
|
Discarding MO integrals.
|
|
Leave Link 913 at Thu Apr 4 10:56:36 2019, MaxMem= 13421772800 cpu: 57584.6
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l601.exe)
|
|
Copying SCF densities to generalized density rwf, IOpCl= 0 IROHF=1.
|
|
|
|
**********************************************************************
|
|
|
|
Population analysis using the SCF density.
|
|
|
|
**********************************************************************
|
|
|
|
Orbital symmetries:
|
|
Occupied (A1) (A1) (E) (E) (A1)
|
|
Virtual (A1) (E) (E) (A1) (E) (E) (A1) (E) (E) (A1) (E)
|
|
(E) (A1) (E) (E) (A2) (E) (E) (E) (E) (A1) (A1)
|
|
(E) (E) (A1) (E) (E) (A1) (E) (E) (A1) (A2) (E)
|
|
(E) (E) (E) (A2) (E) (E) (A1) (E) (E) (E) (E)
|
|
(A1) (E) (E) (A1) (A1) (E) (E) (A2) (E) (E) (A1)
|
|
(E) (E) (A1) (E) (E) (A1) (A2) (A1) (E) (E) (E)
|
|
(E) (A1) (E) (E) (E) (E) (E) (E) (A1) (A2) (E)
|
|
(E) (A1) (E) (E) (A2) (E) (E) (E) (E) (A1) (A1)
|
|
(A1) (E) (E) (A2) (E) (E) (E) (E) (A2) (E) (E)
|
|
(A1) (E) (E) (A2) (A1) (E) (E) (A1) (E) (E) (A1)
|
|
(A2) (E) (E) (A1) (A1) (E) (E) (A1) (E) (E) (E)
|
|
(E) (E) (E) (A1) (A2) (E) (E) (E) (E) (A1) (E)
|
|
(E) (E) (E) (A2) (A1) (E) (E) (E) (E) (E) (E)
|
|
(A1) (A2) (A1) (E) (E) (A1) (E) (E) (A1) (E) (E)
|
|
(A2) (E) (E) (E) (E) (A1) (E) (E) (A1) (A2) (E)
|
|
(E) (E) (E) (A2) (A1) (A2) (A1) (E) (E) (E) (E)
|
|
(A1) (A2) (E) (E) (E) (E) (A1) (E) (E) (A2) (E)
|
|
(E) (A1) (E) (E) (E) (E) (A1) (A1) (E) (E) (A2)
|
|
(E) (E) (E) (E) (A2) (A1) (E) (E) (A1) (E) (E)
|
|
(A1) (E) (E) (A1) (E) (E) (A1) (A2) (E) (E) (E)
|
|
(E) (E) (E) (A1) (E) (E) (A1) (E) (E) (A2) (E)
|
|
(E) (A1) (E) (E) (A2) (E) (E) (E) (E) (A2) (A1)
|
|
(E) (E) (A1) (E) (E) (A1) (E) (E) (A1)
|
|
The electronic state is 1-A1.
|
|
Alpha occ. eigenvalues -- -15.54182 -1.14134 -0.62443 -0.62443 -0.43312
|
|
Alpha virt. eigenvalues -- 0.09191 0.14317 0.14317 0.26168 0.28298
|
|
Alpha virt. eigenvalues -- 0.28298 0.42695 0.45960 0.45960 0.46797
|
|
Alpha virt. eigenvalues -- 0.48911 0.48911 0.68875 0.71225 0.71225
|
|
Alpha virt. eigenvalues -- 0.71652 0.80415 0.80415 0.88352 0.88352
|
|
Alpha virt. eigenvalues -- 0.88637 0.98372 1.02659 1.02659 1.15767
|
|
Alpha virt. eigenvalues -- 1.24257 1.24257 1.32326 1.51949 1.51949
|
|
Alpha virt. eigenvalues -- 1.64032 1.70717 1.77735 1.77735 1.78785
|
|
Alpha virt. eigenvalues -- 1.78785 1.83536 1.88302 1.88302 1.91049
|
|
Alpha virt. eigenvalues -- 1.95886 1.95886 2.02285 2.02285 2.05310
|
|
Alpha virt. eigenvalues -- 2.15382 2.15382 2.19497 2.28077 2.40417
|
|
Alpha virt. eigenvalues -- 2.40417 2.57606 2.60340 2.60340 2.69301
|
|
Alpha virt. eigenvalues -- 2.71546 2.71546 2.77194 2.86596 2.86596
|
|
Alpha virt. eigenvalues -- 2.90054 2.94825 3.33362 3.43457 3.43457
|
|
Alpha virt. eigenvalues -- 3.56972 3.56972 3.64796 3.73081 3.73081
|
|
Alpha virt. eigenvalues -- 3.93093 3.93093 4.08230 4.08230 4.24663
|
|
Alpha virt. eigenvalues -- 4.29768 4.37414 4.37414 4.43331 4.52388
|
|
Alpha virt. eigenvalues -- 4.52388 4.55113 4.64205 4.64205 4.74389
|
|
Alpha virt. eigenvalues -- 4.74389 4.80641 4.94321 4.95522 4.98375
|
|
Alpha virt. eigenvalues -- 4.98375 4.99356 5.05134 5.05134 5.17672
|
|
Alpha virt. eigenvalues -- 5.17672 5.24800 5.27143 5.27143 5.30127
|
|
Alpha virt. eigenvalues -- 5.47865 5.47865 5.51966 5.58451 5.80710
|
|
Alpha virt. eigenvalues -- 5.80710 5.92118 5.98603 5.98603 6.14591
|
|
Alpha virt. eigenvalues -- 6.18665 6.20051 6.20051 6.28187 6.56452
|
|
Alpha virt. eigenvalues -- 6.59572 6.59572 6.61698 6.93797 6.93797
|
|
Alpha virt. eigenvalues -- 6.95993 6.95993 7.14656 7.14656 7.38448
|
|
Alpha virt. eigenvalues -- 7.44360 7.46950 7.46950 8.02817 8.02817
|
|
Alpha virt. eigenvalues -- 8.15764 8.50319 8.50319 8.56901 8.56901
|
|
Alpha virt. eigenvalues -- 8.69211 8.94717 9.05314 9.05314 10.98775
|
|
Alpha virt. eigenvalues -- 10.98775 11.11638 11.11638 11.11682 11.45050
|
|
Alpha virt. eigenvalues -- 11.54136 11.91831 11.91831 11.93247 12.10863
|
|
Alpha virt. eigenvalues -- 12.10863 12.50084 12.55434 12.55434 12.62665
|
|
Alpha virt. eigenvalues -- 12.64239 12.64239 12.67431 12.67431 12.71009
|
|
Alpha virt. eigenvalues -- 12.76369 12.76369 12.77835 12.79805 12.95010
|
|
Alpha virt. eigenvalues -- 12.95010 13.18240 13.18240 13.26171 13.31804
|
|
Alpha virt. eigenvalues -- 13.35418 13.36779 13.42382 13.42382 13.57610
|
|
Alpha virt. eigenvalues -- 13.57610 13.63855 13.64793 13.68829 13.68829
|
|
Alpha virt. eigenvalues -- 13.78055 13.78055 13.82978 13.84989 13.84989
|
|
Alpha virt. eigenvalues -- 13.87981 13.98999 13.98999 14.07417 14.11583
|
|
Alpha virt. eigenvalues -- 14.11583 14.24801 14.24801 14.42993 14.52891
|
|
Alpha virt. eigenvalues -- 14.67409 14.67409 14.74432 14.75686 14.75686
|
|
Alpha virt. eigenvalues -- 14.95047 14.95047 14.97234 14.97247 15.02829
|
|
Alpha virt. eigenvalues -- 15.02829 15.38029 15.59184 15.59184 15.88742
|
|
Alpha virt. eigenvalues -- 16.03855 16.03855 16.23470 16.38063 16.38063
|
|
Alpha virt. eigenvalues -- 16.49597 16.73807 16.74272 16.74272 16.94602
|
|
Alpha virt. eigenvalues -- 16.94602 16.98611 16.98611 17.10201 17.19573
|
|
Alpha virt. eigenvalues -- 17.19573 17.21685 17.37612 17.37612 17.48753
|
|
Alpha virt. eigenvalues -- 17.74559 17.74559 17.99884 18.01837 18.01837
|
|
Alpha virt. eigenvalues -- 18.40468 18.63961 18.63961 20.68229 20.68229
|
|
Alpha virt. eigenvalues -- 20.68915 20.80697 21.20264 21.20264 21.24951
|
|
Alpha virt. eigenvalues -- 21.98598 21.98598 22.51399 23.59589 23.59589
|
|
Alpha virt. eigenvalues -- 54.07320
|
|
Molecular Orbital Coefficients:
|
|
1 2 3 4 5
|
|
(A1)--O (A1)--O (E)--O (E)--O (A1)--O
|
|
Eigenvalues -- -15.54182 -1.14134 -0.62443 -0.62443 -0.43312
|
|
1 1 N 1S 0.56730 -0.10743 0.00000 0.00000 -0.03489
|
|
2 2S -0.42463 0.18292 0.00000 0.00000 0.06282
|
|
3 3S 0.07117 -0.00857 0.00000 0.00000 0.00146
|
|
4 4S 0.00057 0.28837 0.00000 0.00000 0.10182
|
|
5 5S 0.00385 0.39023 0.00000 0.00000 0.11104
|
|
6 6S 0.00125 0.12017 0.00000 0.00000 -0.03583
|
|
7 7PX 0.00000 0.00000 0.00000 0.09540 0.00000
|
|
8 7PY 0.00000 0.00000 0.09540 0.00000 0.00000
|
|
9 7PZ -0.00165 -0.01587 0.00000 0.00000 0.11236
|
|
10 8PX 0.00000 0.00000 0.00000 0.16378 0.00000
|
|
11 8PY 0.00000 0.00000 0.16378 0.00000 0.00000
|
|
12 8PZ 0.00051 -0.02751 0.00000 0.00000 0.19620
|
|
13 9PX 0.00000 0.00000 0.00000 0.25333 0.00000
|
|
14 9PY 0.00000 0.00000 0.25333 0.00000 0.00000
|
|
15 9PZ -0.00088 -0.04542 0.00000 0.00000 0.30145
|
|
16 10PX 0.00000 0.00000 0.00000 0.19917 0.00000
|
|
17 10PY 0.00000 0.00000 0.19917 0.00000 0.00000
|
|
18 10PZ -0.00095 -0.02459 0.00000 0.00000 0.31376
|
|
19 11PX 0.00000 0.00000 0.00000 0.05235 0.00000
|
|
20 11PY 0.00000 0.00000 0.05235 0.00000 0.00000
|
|
21 11PZ -0.00008 -0.00166 0.00000 0.00000 0.22535
|
|
22 12D 0 -0.00013 -0.00009 0.00000 0.00000 -0.00041
|
|
23 12D+1 0.00000 0.00000 0.00000 -0.00138 0.00000
|
|
24 12D-1 0.00000 0.00000 -0.00138 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 -0.00116 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 -0.00116 0.00000
|
|
27 13D 0 0.00017 -0.00153 0.00000 0.00000 -0.00232
|
|
28 13D+1 0.00000 0.00000 0.00000 -0.00677 0.00000
|
|
29 13D-1 0.00000 0.00000 -0.00677 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 -0.00517 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 -0.00517 0.00000
|
|
32 14D 0 0.00007 -0.00400 0.00000 0.00000 -0.00761
|
|
33 14D+1 0.00000 0.00000 0.00000 -0.02223 0.00000
|
|
34 14D-1 0.00000 0.00000 -0.02223 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 -0.01784 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 -0.01784 0.00000
|
|
37 15D 0 -0.00010 -0.00037 0.00000 0.00000 -0.01086
|
|
38 15D+1 0.00000 0.00000 0.00000 -0.01410 0.00000
|
|
39 15D-1 0.00000 0.00000 -0.01410 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 -0.01340 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 -0.01340 0.00000
|
|
42 16F 0 0.00001 0.00024 0.00000 0.00000 -0.00044
|
|
43 16F+1 0.00000 0.00000 0.00000 -0.00020 0.00000
|
|
44 16F-1 0.00000 0.00000 -0.00020 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00027 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00027 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 -0.00003 -0.00035 0.00000 0.00000 0.00017
|
|
49 17F 0 0.00012 0.00258 0.00000 0.00000 -0.00247
|
|
50 17F+1 0.00000 0.00000 0.00000 -0.00146 0.00000
|
|
51 17F-1 0.00000 0.00000 -0.00146 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00226 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00226 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 -0.00011 -0.00287 0.00000 0.00000 0.00082
|
|
56 18F 0 0.00027 0.00286 0.00000 0.00000 -0.00165
|
|
57 18F+1 0.00000 0.00000 0.00000 -0.00180 0.00000
|
|
58 18F-1 0.00000 0.00000 -0.00180 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00382 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00382 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 -0.00024 -0.00345 0.00000 0.00000 0.00071
|
|
63 19G 0 0.00000 -0.00005 0.00000 0.00000 0.00022
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00023 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00023 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00005 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00005 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00002 0.00027 0.00000 0.00000 -0.00021
|
|
70 19G+4 0.00000 0.00000 0.00025 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 -0.00025 0.00000
|
|
72 20G 0 -0.00010 -0.00068 0.00000 0.00000 0.00081
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00153 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00153 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00008 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00008 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00015 0.00166 0.00000 0.00000 -0.00060
|
|
79 20G+4 0.00000 0.00000 0.00182 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 -0.00182 0.00000
|
|
81 21H 0 0.00000 -0.00008 0.00000 0.00000 -0.00011
|
|
82 21H+1 0.00000 0.00000 0.00000 -0.00011 0.00000
|
|
83 21H-1 0.00000 0.00000 -0.00011 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 -0.00019 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 -0.00019 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 -0.00003 -0.00018 0.00000 0.00000 0.00026
|
|
88 21H+4 0.00000 0.00000 -0.00047 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00047 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 -0.00009 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00009 0.00000 0.00000
|
|
92 2 H 1S 0.00006 0.02136 0.03955 0.00000 -0.01021
|
|
93 2S -0.00004 0.04799 0.09372 0.00000 -0.02682
|
|
94 3S -0.00065 0.08495 0.17352 0.00000 -0.04502
|
|
95 4S -0.00047 0.03362 0.15829 0.00000 0.04956
|
|
96 5S -0.00001 0.00121 0.03111 0.00000 -0.00534
|
|
97 6PX 0.00000 0.00000 0.00000 0.00072 0.00000
|
|
98 6PY -0.00001 -0.00126 -0.00141 0.00000 0.00051
|
|
99 6PZ 0.00000 0.00044 0.00088 0.00000 0.00080
|
|
100 7PX 0.00000 0.00000 0.00000 0.00270 0.00000
|
|
101 7PY 0.00003 -0.00438 -0.00407 0.00000 0.00309
|
|
102 7PZ -0.00002 0.00143 0.00265 0.00000 0.00264
|
|
103 8PX 0.00000 0.00000 0.00000 0.00958 0.00000
|
|
104 8PY 0.00019 -0.01409 -0.01182 0.00000 0.00197
|
|
105 8PZ 0.00010 0.00520 0.00835 0.00000 0.01330
|
|
106 9PX 0.00000 0.00000 0.00000 0.01236 0.00000
|
|
107 9PY 0.00019 -0.00594 -0.01118 0.00000 -0.02583
|
|
108 9PZ -0.00003 0.00074 0.00411 0.00000 0.02506
|
|
109 10D 0 0.00000 -0.00014 -0.00011 0.00000 0.00040
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00016 0.00000
|
|
111 10D-1 0.00002 -0.00017 -0.00052 0.00000 -0.00020
|
|
112 10D+2 0.00001 -0.00032 -0.00043 0.00000 0.00028
|
|
113 10D-2 0.00000 0.00000 0.00000 -0.00042 0.00000
|
|
114 11D 0 0.00004 -0.00059 -0.00020 0.00000 0.00092
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00012 0.00000
|
|
116 11D-1 -0.00009 -0.00132 -0.00148 0.00000 -0.00106
|
|
117 11D+2 -0.00001 -0.00133 -0.00122 0.00000 0.00097
|
|
118 11D-2 0.00000 0.00000 0.00000 -0.00105 0.00000
|
|
119 12D 0 0.00005 -0.00085 -0.00118 0.00000 0.00094
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00070 0.00000
|
|
121 12D-1 -0.00010 -0.00151 -0.00210 0.00000 -0.00584
|
|
122 12D+2 -0.00002 -0.00206 -0.00165 0.00000 -0.00548
|
|
123 12D-2 0.00000 0.00000 0.00000 -0.00328 0.00000
|
|
124 13F 0 0.00000 -0.00007 -0.00017 0.00000 0.00002
|
|
125 13F+1 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
126 13F-1 -0.00001 0.00003 -0.00002 0.00000 -0.00023
|
|
127 13F+2 -0.00001 -0.00010 -0.00025 0.00000 -0.00005
|
|
128 13F-2 0.00000 0.00000 0.00000 -0.00008 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 -0.00016 0.00000
|
|
130 13F-3 0.00000 0.00010 0.00019 0.00000 -0.00022
|
|
131 14F 0 -0.00004 -0.00034 -0.00055 0.00000 -0.00046
|
|
132 14F+1 0.00000 0.00000 0.00000 -0.00018 0.00000
|
|
133 14F-1 -0.00004 0.00000 0.00021 0.00000 -0.00024
|
|
134 14F+2 -0.00006 -0.00047 -0.00068 0.00000 -0.00064
|
|
135 14F-2 0.00000 0.00000 0.00000 -0.00005 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 -0.00026 0.00000
|
|
137 14F-3 0.00003 0.00031 0.00056 0.00000 0.00100
|
|
138 15G 0 0.00000 -0.00001 -0.00003 0.00000 -0.00005
|
|
139 15G+1 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
140 15G-1 0.00001 0.00006 0.00011 0.00000 0.00003
|
|
141 15G+2 0.00000 -0.00001 0.00000 0.00000 -0.00005
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
144 15G-3 0.00001 0.00006 0.00010 0.00000 0.00007
|
|
145 15G+4 0.00001 0.00005 0.00008 0.00000 0.00005
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00004 0.00000
|
|
147 3 H 1S 0.00006 0.02136 -0.01977 0.03425 -0.01021
|
|
148 2S -0.00004 0.04799 -0.04686 0.08117 -0.02682
|
|
149 3S -0.00065 0.08495 -0.08676 0.15027 -0.04502
|
|
150 4S -0.00047 0.03362 -0.07915 0.13708 0.04956
|
|
151 5S -0.00001 0.00121 -0.01555 0.02694 -0.00534
|
|
152 6PX -0.00001 -0.00109 0.00093 -0.00088 0.00044
|
|
153 6PY 0.00001 0.00063 0.00019 0.00093 -0.00025
|
|
154 6PZ 0.00000 0.00044 -0.00044 0.00076 0.00080
|
|
155 7PX 0.00003 -0.00379 0.00293 -0.00238 0.00267
|
|
156 7PY -0.00002 0.00219 0.00100 0.00293 -0.00154
|
|
157 7PZ -0.00002 0.00143 -0.00133 0.00230 0.00264
|
|
158 8PX 0.00017 -0.01220 0.00927 -0.00647 0.00170
|
|
159 8PY -0.00010 0.00705 0.00423 0.00927 -0.00098
|
|
160 8PZ 0.00010 0.00520 -0.00417 0.00723 0.01330
|
|
161 9PX 0.00017 -0.00514 0.01019 -0.00529 -0.02237
|
|
162 9PY -0.00010 0.00297 0.00648 0.01019 0.01292
|
|
163 9PZ -0.00003 0.00074 -0.00206 0.00356 0.02506
|
|
164 10D 0 0.00000 -0.00014 0.00006 -0.00010 0.00040
|
|
165 10D+1 0.00001 -0.00015 0.00030 -0.00035 -0.00017
|
|
166 10D-1 -0.00001 0.00009 -0.00001 0.00030 0.00010
|
|
167 10D+2 0.00000 0.00016 -0.00042 0.00001 -0.00014
|
|
168 10D-2 0.00001 -0.00028 0.00001 -0.00043 0.00025
|
|
169 11D 0 0.00004 -0.00059 0.00010 -0.00018 0.00092
|
|
170 11D+1 -0.00008 -0.00114 0.00069 -0.00108 -0.00092
|
|
171 11D-1 0.00004 0.00066 -0.00028 0.00069 0.00053
|
|
172 11D+2 0.00001 0.00066 -0.00109 0.00007 -0.00048
|
|
173 11D-2 -0.00001 -0.00115 0.00007 -0.00118 0.00084
|
|
174 12D 0 0.00005 -0.00085 0.00059 -0.00102 0.00094
|
|
175 12D+1 -0.00008 -0.00131 0.00121 -0.00140 -0.00506
|
|
176 12D-1 0.00005 0.00075 0.00000 0.00121 0.00292
|
|
177 12D+2 0.00001 0.00103 -0.00287 -0.00071 0.00274
|
|
178 12D-2 -0.00002 -0.00179 -0.00071 -0.00206 -0.00475
|
|
179 13F 0 0.00000 -0.00007 0.00009 -0.00015 0.00002
|
|
180 13F+1 -0.00001 0.00003 0.00000 -0.00002 -0.00020
|
|
181 13F-1 0.00000 -0.00002 -0.00002 0.00000 0.00012
|
|
182 13F+2 0.00000 0.00005 -0.00012 0.00007 0.00003
|
|
183 13F-2 -0.00001 -0.00009 0.00007 -0.00021 -0.00005
|
|
184 13F+3 0.00000 0.00000 0.00014 0.00008 0.00000
|
|
185 13F-3 0.00000 0.00010 -0.00010 0.00017 -0.00022
|
|
186 14F 0 -0.00004 -0.00034 0.00027 -0.00047 -0.00046
|
|
187 14F+1 -0.00003 0.00000 -0.00017 0.00011 -0.00021
|
|
188 14F-1 0.00002 0.00000 -0.00008 -0.00017 0.00012
|
|
189 14F+2 0.00003 0.00024 -0.00021 0.00027 0.00032
|
|
190 14F-2 -0.00006 -0.00041 0.00027 -0.00052 -0.00056
|
|
191 14F+3 0.00000 0.00000 0.00023 0.00013 0.00000
|
|
192 14F-3 0.00003 0.00031 -0.00028 0.00048 0.00100
|
|
193 15G 0 0.00000 -0.00001 0.00002 -0.00003 -0.00005
|
|
194 15G+1 0.00001 0.00005 -0.00005 0.00008 0.00003
|
|
195 15G-1 -0.00001 -0.00003 0.00001 -0.00005 -0.00002
|
|
196 15G+2 0.00000 0.00001 0.00001 0.00000 0.00003
|
|
197 15G-2 0.00000 -0.00001 0.00000 0.00000 -0.00005
|
|
198 15G+3 0.00000 0.00000 0.00002 0.00001 0.00000
|
|
199 15G-3 0.00001 0.00006 -0.00005 0.00008 0.00007
|
|
200 15G+4 0.00000 -0.00002 -0.00001 -0.00005 -0.00002
|
|
201 15G-4 -0.00001 -0.00004 0.00005 -0.00005 -0.00004
|
|
202 4 H 1S 0.00006 0.02136 -0.01977 -0.03425 -0.01021
|
|
203 2S -0.00004 0.04799 -0.04686 -0.08117 -0.02682
|
|
204 3S -0.00065 0.08495 -0.08676 -0.15027 -0.04502
|
|
205 4S -0.00047 0.03362 -0.07915 -0.13708 0.04956
|
|
206 5S -0.00001 0.00121 -0.01555 -0.02694 -0.00534
|
|
207 6PX 0.00001 0.00109 -0.00093 -0.00088 -0.00044
|
|
208 6PY 0.00001 0.00063 0.00019 -0.00093 -0.00025
|
|
209 6PZ 0.00000 0.00044 -0.00044 -0.00076 0.00080
|
|
210 7PX -0.00003 0.00379 -0.00293 -0.00238 -0.00267
|
|
211 7PY -0.00002 0.00219 0.00100 -0.00293 -0.00154
|
|
212 7PZ -0.00002 0.00143 -0.00133 -0.00230 0.00264
|
|
213 8PX -0.00017 0.01220 -0.00927 -0.00647 -0.00170
|
|
214 8PY -0.00010 0.00705 0.00423 -0.00927 -0.00098
|
|
215 8PZ 0.00010 0.00520 -0.00417 -0.00723 0.01330
|
|
216 9PX -0.00017 0.00514 -0.01019 -0.00529 0.02237
|
|
217 9PY -0.00010 0.00297 0.00648 -0.01019 0.01292
|
|
218 9PZ -0.00003 0.00074 -0.00206 -0.00356 0.02506
|
|
219 10D 0 0.00000 -0.00014 0.00006 0.00010 0.00040
|
|
220 10D+1 -0.00001 0.00015 -0.00030 -0.00035 0.00017
|
|
221 10D-1 -0.00001 0.00009 -0.00001 -0.00030 0.00010
|
|
222 10D+2 0.00000 0.00016 -0.00042 -0.00001 -0.00014
|
|
223 10D-2 -0.00001 0.00028 -0.00001 -0.00043 -0.00025
|
|
224 11D 0 0.00004 -0.00059 0.00010 0.00018 0.00092
|
|
225 11D+1 0.00008 0.00114 -0.00069 -0.00108 0.00092
|
|
226 11D-1 0.00004 0.00066 -0.00028 -0.00069 0.00053
|
|
227 11D+2 0.00001 0.00066 -0.00109 -0.00007 -0.00048
|
|
228 11D-2 0.00001 0.00115 -0.00007 -0.00118 -0.00084
|
|
229 12D 0 0.00005 -0.00085 0.00059 0.00102 0.00094
|
|
230 12D+1 0.00008 0.00131 -0.00121 -0.00140 0.00506
|
|
231 12D-1 0.00005 0.00075 0.00000 -0.00121 0.00292
|
|
232 12D+2 0.00001 0.00103 -0.00287 0.00071 0.00274
|
|
233 12D-2 0.00002 0.00179 0.00071 -0.00206 0.00475
|
|
234 13F 0 0.00000 -0.00007 0.00009 0.00015 0.00002
|
|
235 13F+1 0.00001 -0.00003 0.00000 -0.00002 0.00020
|
|
236 13F-1 0.00000 -0.00002 -0.00002 0.00000 0.00012
|
|
237 13F+2 0.00000 0.00005 -0.00012 -0.00007 0.00003
|
|
238 13F-2 0.00001 0.00009 -0.00007 -0.00021 0.00005
|
|
239 13F+3 0.00000 0.00000 -0.00014 0.00008 0.00000
|
|
240 13F-3 0.00000 0.00010 -0.00010 -0.00017 -0.00022
|
|
241 14F 0 -0.00004 -0.00034 0.00027 0.00047 -0.00046
|
|
242 14F+1 0.00003 0.00000 0.00017 0.00011 0.00021
|
|
243 14F-1 0.00002 0.00000 -0.00008 0.00017 0.00012
|
|
244 14F+2 0.00003 0.00024 -0.00021 -0.00027 0.00032
|
|
245 14F-2 0.00006 0.00041 -0.00027 -0.00052 0.00056
|
|
246 14F+3 0.00000 0.00000 -0.00023 0.00013 0.00000
|
|
247 14F-3 0.00003 0.00031 -0.00028 -0.00048 0.00100
|
|
248 15G 0 0.00000 -0.00001 0.00002 0.00003 -0.00005
|
|
249 15G+1 -0.00001 -0.00005 0.00005 0.00008 -0.00003
|
|
250 15G-1 -0.00001 -0.00003 0.00001 0.00005 -0.00002
|
|
251 15G+2 0.00000 0.00001 0.00001 0.00000 0.00003
|
|
252 15G-2 0.00000 0.00001 0.00000 0.00000 0.00005
|
|
253 15G+3 0.00000 0.00000 -0.00002 0.00001 0.00000
|
|
254 15G-3 0.00001 0.00006 -0.00005 -0.00008 0.00007
|
|
255 15G+4 0.00000 -0.00002 -0.00001 0.00005 -0.00002
|
|
256 15G-4 0.00001 0.00004 -0.00005 -0.00005 0.00004
|
|
6 7 8 9 10
|
|
(A1)--V (E)--V (E)--V (A1)--V (E)--V
|
|
Eigenvalues -- 0.09191 0.14317 0.14317 0.26168 0.28298
|
|
1 1 N 1S -0.03131 0.00000 0.00000 -0.01384 0.00000
|
|
2 2S 0.04930 0.00000 0.00000 0.00814 0.00000
|
|
3 3S -0.01511 0.00000 0.00000 -0.09054 0.00000
|
|
4 4S -0.22333 0.00000 0.00000 -0.02814 0.00000
|
|
5 5S 2.12315 0.00000 0.00000 5.00682 0.00000
|
|
6 6S 4.85326 0.00000 0.00000 14.56955 0.00000
|
|
7 7PX 0.00000 -0.03201 0.00000 0.00000 0.00000
|
|
8 7PY 0.00000 0.00000 -0.03201 0.00000 -0.01362
|
|
9 7PZ -0.01890 0.00000 0.00000 0.04757 0.00000
|
|
10 8PX 0.00000 -0.08599 0.00000 0.00000 0.00000
|
|
11 8PY 0.00000 0.00000 -0.08599 0.00000 0.11112
|
|
12 8PZ 0.00642 0.00000 0.00000 0.11288 0.00000
|
|
13 9PX 0.00000 0.08914 0.00000 0.00000 0.00000
|
|
14 9PY 0.00000 0.00000 0.08914 0.00000 -1.02873
|
|
15 9PZ -0.25469 0.00000 0.00000 -0.40044 0.00000
|
|
16 10PX 0.00000 1.28548 0.00000 0.00000 0.00000
|
|
17 10PY 0.00000 0.00000 1.28548 0.00000 -5.14958
|
|
18 10PZ -1.04400 0.00000 0.00000 -2.13799 0.00000
|
|
19 11PX 0.00000 -0.74394 0.00000 0.00000 0.00000
|
|
20 11PY 0.00000 0.00000 -0.74394 0.00000 -4.06643
|
|
21 11PZ -0.54160 0.00000 0.00000 -3.78717 0.00000
|
|
22 12D 0 -0.00099 0.00000 0.00000 0.00272 0.00000
|
|
23 12D+1 0.00000 -0.00151 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 -0.00151 0.00000 -0.00054
|
|
25 12D+2 0.00000 0.00000 -0.00110 0.00000 -0.00077
|
|
26 12D-2 0.00000 -0.00110 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00975 0.00000 0.00000 -0.01189 0.00000
|
|
28 13D+1 0.00000 0.01255 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.01255 0.00000 -0.02395
|
|
30 13D+2 0.00000 0.00000 0.00829 0.00000 -0.02504
|
|
31 13D-2 0.00000 0.00829 0.00000 0.00000 0.00000
|
|
32 14D 0 -0.11019 0.00000 0.00000 -0.08858 0.00000
|
|
33 14D+1 0.00000 -0.11238 0.00000 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 -0.11238 0.00000 0.51285
|
|
35 14D+2 0.00000 0.00000 -0.09592 0.00000 0.53710
|
|
36 14D-2 0.00000 -0.09592 0.00000 0.00000 0.00000
|
|
37 15D 0 -0.22029 0.00000 0.00000 -0.07474 0.00000
|
|
38 15D+1 0.00000 -0.24359 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 -0.24359 0.00000 1.68945
|
|
40 15D+2 0.00000 0.00000 -0.26962 0.00000 1.43026
|
|
41 15D-2 0.00000 -0.26962 0.00000 0.00000 0.00000
|
|
42 16F 0 -0.00158 0.00000 0.00000 -0.00064 0.00000
|
|
43 16F+1 0.00000 0.00115 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00115 0.00000 0.00074
|
|
45 16F+2 0.00000 0.00000 -0.00023 0.00000 0.00601
|
|
46 16F-2 0.00000 -0.00023 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00263 0.00000 0.00000 0.00167 0.00000
|
|
49 17F 0 0.02018 0.00000 0.00000 0.03023 0.00000
|
|
50 17F+1 0.00000 -0.00649 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 -0.00649 0.00000 0.00290
|
|
52 17F+2 0.00000 0.00000 0.00442 0.00000 -0.06910
|
|
53 17F-2 0.00000 0.00442 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 -0.02953 0.00000 0.00000 -0.04399 0.00000
|
|
56 18F 0 0.12162 0.00000 0.00000 0.00791 0.00000
|
|
57 18F+1 0.00000 -0.02953 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 -0.02953 0.00000 -0.10171
|
|
59 18F+2 0.00000 0.00000 0.03858 0.00000 -0.36111
|
|
60 18F-2 0.00000 0.03858 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 -0.15948 0.00000 0.00000 -0.07153 0.00000
|
|
63 19G 0 0.00010 0.00000 0.00000 -0.00190 0.00000
|
|
64 19G+1 0.00000 -0.00055 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 -0.00055 0.00000 -0.00230
|
|
66 19G+2 0.00000 0.00000 -0.00056 0.00000 -0.00122
|
|
67 19G-2 0.00000 -0.00056 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00038 0.00000 0.00000 0.00249 0.00000
|
|
70 19G+4 0.00000 0.00000 -0.00088 0.00000 -0.00344
|
|
71 19G-4 0.00000 0.00088 0.00000 0.00000 0.00000
|
|
72 20G 0 -0.00571 0.00000 0.00000 0.00689 0.00000
|
|
73 20G+1 0.00000 0.01264 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.01264 0.00000 -0.02784
|
|
75 20G+2 0.00000 0.00000 0.00566 0.00000 0.02428
|
|
76 20G-2 0.00000 0.00566 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.02934 0.00000 0.00000 0.00756 0.00000
|
|
79 20G+4 0.00000 0.00000 0.02014 0.00000 -0.01268
|
|
80 20G-4 0.00000 -0.02014 0.00000 0.00000 0.00000
|
|
81 21H 0 -0.00156 0.00000 0.00000 0.00074 0.00000
|
|
82 21H+1 0.00000 -0.00013 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 -0.00013 0.00000 0.00524
|
|
84 21H+2 0.00000 0.00000 -0.00031 0.00000 0.00218
|
|
85 21H-2 0.00000 -0.00031 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 -0.00059 0.00000 0.00000 0.00128 0.00000
|
|
88 21H+4 0.00000 0.00000 -0.00236 0.00000 0.00260
|
|
89 21H-4 0.00000 0.00236 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00042 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 -0.00042 0.00000 -0.00383
|
|
92 2 H 1S -0.00180 0.00000 0.00045 -0.00586 0.01350
|
|
93 2S 0.04083 0.00000 -0.00704 0.08481 -0.14186
|
|
94 3S -0.81539 0.00000 -0.54506 -0.68757 3.27799
|
|
95 4S -1.16396 0.00000 -1.71643 -6.49353 7.78495
|
|
96 5S -0.88225 0.00000 3.08104 -0.12948 1.05890
|
|
97 6PX 0.00000 -0.00158 0.00000 0.00000 0.00000
|
|
98 6PY -0.00337 0.00000 0.00314 0.00238 0.00054
|
|
99 6PZ 0.00118 0.00000 -0.00181 -0.00392 -0.00455
|
|
100 7PX 0.00000 0.00811 0.00000 0.00000 0.00000
|
|
101 7PY 0.00657 0.00000 -0.00877 -0.03113 0.02602
|
|
102 7PZ -0.00242 0.00000 0.00600 0.02654 0.01347
|
|
103 8PX 0.00000 -0.06085 0.00000 0.00000 0.00000
|
|
104 8PY 0.22064 0.00000 0.25136 0.38024 -1.14791
|
|
105 8PZ -0.10277 0.00000 -0.13599 -0.21281 0.26260
|
|
106 9PX 0.00000 -0.00734 0.00000 0.00000 0.00000
|
|
107 9PY 0.49905 0.00000 0.39108 1.97809 -2.38132
|
|
108 9PZ -0.18395 0.00000 -0.19735 -0.34865 0.93010
|
|
109 10D 0 -0.00048 0.00000 -0.00011 -0.00143 0.00457
|
|
110 10D+1 0.00000 0.00061 0.00000 0.00000 0.00000
|
|
111 10D-1 -0.00142 0.00000 0.00019 -0.00386 0.00378
|
|
112 10D+2 -0.00138 0.00000 0.00032 -0.00030 0.00805
|
|
113 10D-2 0.00000 -0.00092 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00834 0.00000 0.00455 0.01068 -0.05678
|
|
115 11D+1 0.00000 -0.00582 0.00000 0.00000 0.00000
|
|
116 11D-1 0.02148 0.00000 0.01625 0.02934 -0.07220
|
|
117 11D+2 0.02399 0.00000 0.01469 0.01265 -0.11485
|
|
118 11D-2 0.00000 0.01012 0.00000 0.00000 0.00000
|
|
119 12D 0 0.02182 0.00000 0.00097 0.10142 -0.15466
|
|
120 12D+1 0.00000 -0.00782 0.00000 0.00000 0.00000
|
|
121 12D-1 0.04056 0.00000 0.06308 0.16543 -0.15526
|
|
122 12D+2 0.04899 0.00000 0.04347 0.33300 -0.31977
|
|
123 12D-2 0.00000 0.03680 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00147 0.00000 0.00101 -0.00032 -0.00377
|
|
125 13F+1 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
126 13F-1 -0.00027 0.00000 -0.00021 0.00082 0.00387
|
|
127 13F+2 0.00168 0.00000 0.00179 0.00179 -0.00582
|
|
128 13F-2 0.00000 0.00040 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00095 0.00000 0.00000 0.00000
|
|
130 13F-3 -0.00190 0.00000 -0.00155 0.00235 0.00521
|
|
131 14F 0 0.00163 0.00000 0.00214 0.02464 -0.02400
|
|
132 14F+1 0.00000 0.00121 0.00000 0.00000 0.00000
|
|
133 14F-1 -0.00186 0.00000 0.00493 -0.01290 0.01756
|
|
134 14F+2 0.00568 0.00000 0.00412 0.02667 -0.02463
|
|
135 14F-2 0.00000 0.00570 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00827 0.00000 0.00000 0.00000
|
|
137 14F-3 -0.00292 0.00000 -0.00003 -0.05302 0.04780
|
|
138 15G 0 0.00008 0.00000 0.00013 0.00020 0.00013
|
|
139 15G+1 0.00000 0.00013 0.00000 0.00000 0.00000
|
|
140 15G-1 -0.00050 0.00000 0.00016 -0.00217 0.00221
|
|
141 15G+2 0.00007 0.00000 0.00042 -0.00016 0.00117
|
|
142 15G-2 0.00000 -0.00012 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00054 0.00000 0.00000 0.00000
|
|
144 15G-3 -0.00055 0.00000 -0.00023 -0.00247 0.00123
|
|
145 15G+4 -0.00031 0.00000 0.00012 -0.00323 0.00266
|
|
146 15G-4 0.00000 -0.00086 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00180 0.00039 -0.00023 -0.00586 -0.00675
|
|
148 2S 0.04083 -0.00610 0.00352 0.08481 0.07093
|
|
149 3S -0.81539 -0.47203 0.27253 -0.68757 -1.63899
|
|
150 4S -1.16396 -1.48647 0.85822 -6.49353 -3.89247
|
|
151 5S -0.88225 2.66826 -1.54052 -0.12948 -0.52945
|
|
152 6PX -0.00292 0.00196 -0.00204 0.00206 -0.00041
|
|
153 6PY 0.00169 -0.00204 -0.00040 -0.00119 -0.00017
|
|
154 6PZ 0.00118 -0.00156 0.00090 -0.00392 0.00227
|
|
155 7PX 0.00569 -0.00455 0.00731 -0.02696 -0.01223
|
|
156 7PY -0.00328 0.00731 0.00389 0.01556 0.00483
|
|
157 7PZ -0.00242 0.00520 -0.00300 0.02654 -0.00673
|
|
158 8PX 0.19108 0.17331 -0.13519 0.32930 0.46768
|
|
159 8PY -0.11032 -0.13519 0.01720 -0.19012 -0.33787
|
|
160 8PZ -0.10277 -0.11777 0.06800 -0.21281 -0.13130
|
|
161 9PX 0.43219 0.29147 -0.17252 1.71307 1.14010
|
|
162 9PY -0.24952 -0.17252 0.09226 -0.98904 -0.40661
|
|
163 9PZ -0.18395 -0.17091 0.09867 -0.34865 -0.46505
|
|
164 10D 0 -0.00048 -0.00010 0.00006 -0.00143 -0.00229
|
|
165 10D+1 -0.00123 0.00029 0.00018 -0.00335 -0.00210
|
|
166 10D-1 0.00071 0.00018 0.00051 0.00193 0.00014
|
|
167 10D+2 0.00069 -0.00054 -0.00061 0.00015 0.00037
|
|
168 10D-2 -0.00119 0.00001 -0.00054 -0.00026 -0.00443
|
|
169 11D 0 0.00834 0.00394 -0.00228 0.01068 0.02839
|
|
170 11D+1 0.01860 0.01073 -0.00956 0.02541 0.03309
|
|
171 11D-1 -0.01074 -0.00956 -0.00031 -0.01467 -0.01489
|
|
172 11D+2 -0.01199 -0.00198 0.01126 -0.00632 -0.01503
|
|
173 11D-2 0.02077 0.01355 -0.00198 0.01095 0.05763
|
|
174 12D 0 0.02182 0.00084 -0.00048 0.10142 0.07733
|
|
175 12D+1 0.03513 0.04536 -0.03070 0.14327 0.03624
|
|
176 12D-1 -0.02028 -0.03070 0.00991 -0.08272 -0.09248
|
|
177 12D+2 -0.02449 -0.00289 0.03846 -0.16650 -0.11447
|
|
178 12D-2 0.04243 0.04180 -0.00289 0.28838 0.11853
|
|
179 13F 0 0.00147 0.00087 -0.00050 -0.00032 0.00188
|
|
180 13F+1 -0.00024 -0.00015 0.00009 0.00071 -0.00152
|
|
181 13F-1 0.00014 0.00009 -0.00005 -0.00041 0.00124
|
|
182 13F+2 -0.00084 -0.00060 0.00075 -0.00090 -0.00268
|
|
183 13F-2 0.00146 0.00145 -0.00060 0.00155 0.00182
|
|
184 13F+3 0.00000 -0.00047 -0.00082 0.00000 -0.00216
|
|
185 13F-3 -0.00190 -0.00135 0.00078 0.00235 -0.00261
|
|
186 14F 0 0.00163 0.00185 -0.00107 0.02464 0.01200
|
|
187 14F+1 -0.00161 0.00400 -0.00161 -0.01117 -0.00891
|
|
188 14F-1 0.00093 -0.00161 0.00214 0.00645 0.00212
|
|
189 14F+2 -0.00284 0.00068 0.00530 -0.01333 0.00765
|
|
190 14F-2 0.00492 0.00452 0.00068 0.02309 0.01863
|
|
191 14F+3 0.00000 -0.00414 -0.00716 0.00000 0.00690
|
|
192 14F-3 -0.00292 -0.00002 0.00001 -0.05302 -0.02390
|
|
193 15G 0 0.00008 0.00011 -0.00007 0.00020 -0.00006
|
|
194 15G+1 -0.00044 0.00015 -0.00001 -0.00188 -0.00086
|
|
195 15G-1 0.00025 -0.00001 0.00014 0.00109 0.00071
|
|
196 15G+2 -0.00003 -0.00023 0.00001 0.00008 0.00063
|
|
197 15G-2 0.00006 0.00028 -0.00023 -0.00013 -0.00031
|
|
198 15G+3 0.00000 -0.00027 -0.00047 0.00000 -0.00112
|
|
199 15G-3 -0.00055 -0.00020 0.00012 -0.00247 -0.00062
|
|
200 15G+4 0.00016 0.00032 0.00068 0.00161 0.00061
|
|
201 15G-4 0.00027 -0.00031 -0.00032 0.00280 0.00118
|
|
202 4 H 1S -0.00180 -0.00039 -0.00023 -0.00586 -0.00675
|
|
203 2S 0.04083 0.00610 0.00352 0.08481 0.07093
|
|
204 3S -0.81539 0.47203 0.27253 -0.68757 -1.63899
|
|
205 4S -1.16396 1.48647 0.85822 -6.49353 -3.89247
|
|
206 5S -0.88225 -2.66826 -1.54052 -0.12948 -0.52945
|
|
207 6PX 0.00292 0.00196 0.00204 -0.00206 0.00041
|
|
208 6PY 0.00169 0.00204 -0.00040 -0.00119 -0.00017
|
|
209 6PZ 0.00118 0.00156 0.00090 -0.00392 0.00227
|
|
210 7PX -0.00569 -0.00455 -0.00731 0.02696 0.01223
|
|
211 7PY -0.00328 -0.00731 0.00389 0.01556 0.00483
|
|
212 7PZ -0.00242 -0.00520 -0.00300 0.02654 -0.00673
|
|
213 8PX -0.19108 0.17331 0.13519 -0.32930 -0.46768
|
|
214 8PY -0.11032 0.13519 0.01720 -0.19012 -0.33787
|
|
215 8PZ -0.10277 0.11777 0.06800 -0.21281 -0.13130
|
|
216 9PX -0.43219 0.29147 0.17252 -1.71307 -1.14010
|
|
217 9PY -0.24952 0.17252 0.09226 -0.98904 -0.40661
|
|
218 9PZ -0.18395 0.17091 0.09867 -0.34865 -0.46505
|
|
219 10D 0 -0.00048 0.00010 0.00006 -0.00143 -0.00229
|
|
220 10D+1 0.00123 0.00029 -0.00018 0.00335 0.00210
|
|
221 10D-1 0.00071 -0.00018 0.00051 0.00193 0.00014
|
|
222 10D+2 0.00069 0.00054 -0.00061 0.00015 0.00037
|
|
223 10D-2 0.00119 0.00001 0.00054 0.00026 0.00443
|
|
224 11D 0 0.00834 -0.00394 -0.00228 0.01068 0.02839
|
|
225 11D+1 -0.01860 0.01073 0.00956 -0.02541 -0.03309
|
|
226 11D-1 -0.01074 0.00956 -0.00031 -0.01467 -0.01489
|
|
227 11D+2 -0.01199 0.00198 0.01126 -0.00632 -0.01503
|
|
228 11D-2 -0.02077 0.01355 0.00198 -0.01095 -0.05763
|
|
229 12D 0 0.02182 -0.00084 -0.00048 0.10142 0.07733
|
|
230 12D+1 -0.03513 0.04536 0.03070 -0.14327 -0.03624
|
|
231 12D-1 -0.02028 0.03070 0.00991 -0.08272 -0.09248
|
|
232 12D+2 -0.02449 0.00289 0.03846 -0.16650 -0.11447
|
|
233 12D-2 -0.04243 0.04180 0.00289 -0.28838 -0.11853
|
|
234 13F 0 0.00147 -0.00087 -0.00050 -0.00032 0.00188
|
|
235 13F+1 0.00024 -0.00015 -0.00009 -0.00071 0.00152
|
|
236 13F-1 0.00014 -0.00009 -0.00005 -0.00041 0.00124
|
|
237 13F+2 -0.00084 0.00060 0.00075 -0.00090 -0.00268
|
|
238 13F-2 -0.00146 0.00145 0.00060 -0.00155 -0.00182
|
|
239 13F+3 0.00000 -0.00047 0.00082 0.00000 0.00216
|
|
240 13F-3 -0.00190 0.00135 0.00078 0.00235 -0.00261
|
|
241 14F 0 0.00163 -0.00185 -0.00107 0.02464 0.01200
|
|
242 14F+1 0.00161 0.00400 0.00161 0.01117 0.00891
|
|
243 14F-1 0.00093 0.00161 0.00214 0.00645 0.00212
|
|
244 14F+2 -0.00284 -0.00068 0.00530 -0.01333 0.00765
|
|
245 14F-2 -0.00492 0.00452 -0.00068 -0.02309 -0.01863
|
|
246 14F+3 0.00000 -0.00414 0.00716 0.00000 -0.00690
|
|
247 14F-3 -0.00292 0.00002 0.00001 -0.05302 -0.02390
|
|
248 15G 0 0.00008 -0.00011 -0.00007 0.00020 -0.00006
|
|
249 15G+1 0.00044 0.00015 0.00001 0.00188 0.00086
|
|
250 15G-1 0.00025 0.00001 0.00014 0.00109 0.00071
|
|
251 15G+2 -0.00003 0.00023 0.00001 0.00008 0.00063
|
|
252 15G-2 -0.00006 0.00028 0.00023 0.00013 0.00031
|
|
253 15G+3 0.00000 -0.00027 0.00047 0.00000 0.00112
|
|
254 15G-3 -0.00055 0.00020 0.00012 -0.00247 -0.00062
|
|
255 15G+4 0.00016 -0.00032 0.00068 0.00161 0.00061
|
|
256 15G-4 -0.00027 -0.00031 0.00032 -0.00280 -0.00118
|
|
11 12 13 14 15
|
|
(E)--V (A1)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 0.28298 0.42695 0.45960 0.45960 0.46797
|
|
1 1 N 1S 0.00000 -0.03473 0.00000 0.00000 0.04603
|
|
2 2S 0.00000 0.07040 0.00000 0.00000 -0.10761
|
|
3 3S 0.00000 0.01684 0.00000 0.00000 -0.05575
|
|
4 4S 0.00000 -0.09705 0.00000 0.00000 -1.70150
|
|
5 5S 0.00000 2.42441 0.00000 0.00000 11.32272
|
|
6 6S 0.00000 4.87676 0.00000 0.00000 21.35478
|
|
7 7PX -0.01362 0.00000 -0.02387 0.00000 0.00000
|
|
8 7PY 0.00000 0.00000 0.00000 -0.02387 0.00000
|
|
9 7PZ 0.00000 -0.03484 0.00000 0.00000 -0.00106
|
|
10 8PX 0.11112 0.00000 -0.09515 0.00000 0.00000
|
|
11 8PY 0.00000 0.00000 0.00000 -0.09515 0.00000
|
|
12 8PZ 0.00000 -0.08166 0.00000 0.00000 0.14614
|
|
13 9PX -1.02873 0.00000 0.08329 0.00000 0.00000
|
|
14 9PY 0.00000 0.00000 0.00000 0.08329 0.00000
|
|
15 9PZ 0.00000 -0.14798 0.00000 0.00000 -1.00929
|
|
16 10PX -5.14958 0.00000 2.32122 0.00000 0.00000
|
|
17 10PY 0.00000 0.00000 0.00000 2.32122 0.00000
|
|
18 10PZ 0.00000 -0.71066 0.00000 0.00000 -4.60503
|
|
19 11PX -4.06643 0.00000 2.10578 0.00000 0.00000
|
|
20 11PY 0.00000 0.00000 0.00000 2.10578 0.00000
|
|
21 11PZ 0.00000 -0.24339 0.00000 0.00000 -1.65154
|
|
22 12D 0 0.00000 0.00106 0.00000 0.00000 -0.00401
|
|
23 12D+1 -0.00054 0.00000 -0.00343 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 -0.00343 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00373 0.00000
|
|
26 12D-2 -0.00077 0.00000 0.00373 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00932 0.00000 0.00000 0.04380
|
|
28 13D+1 -0.02395 0.00000 0.04229 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.04229 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 -0.03927 0.00000
|
|
31 13D-2 -0.02504 0.00000 -0.03927 0.00000 0.00000
|
|
32 14D 0 0.00000 -0.05811 0.00000 0.00000 -0.60189
|
|
33 14D+1 0.51285 0.00000 -0.36452 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 -0.36452 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.25495 0.00000
|
|
36 14D-2 0.53710 0.00000 0.25495 0.00000 0.00000
|
|
37 15D 0 0.00000 -0.46345 0.00000 0.00000 -1.55173
|
|
38 15D+1 1.68945 0.00000 -1.60155 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 -1.60155 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.81209 0.00000
|
|
41 15D-2 1.43026 0.00000 0.81209 0.00000 0.00000
|
|
42 16F 0 0.00000 -0.00066 0.00000 0.00000 -0.00839
|
|
43 16F+1 0.00074 0.00000 -0.00001 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 -0.00252 0.00000
|
|
46 16F-2 0.00601 0.00000 -0.00252 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 -0.00024 0.00000 0.00000 0.01198
|
|
49 17F 0 0.00000 0.00476 0.00000 0.00000 0.09942
|
|
50 17F+1 0.00290 0.00000 0.00849 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00849 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.01679 0.00000
|
|
53 17F-2 -0.06910 0.00000 0.01679 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 -0.00300 0.00000 0.00000 -0.14564
|
|
56 18F 0 0.00000 0.03799 0.00000 0.00000 0.52758
|
|
57 18F+1 -0.10171 0.00000 0.32578 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.32578 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.08786 0.00000
|
|
60 18F-2 -0.36111 0.00000 -0.08786 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 -0.04465 0.00000 0.00000 -0.72084
|
|
63 19G 0 0.00000 0.00059 0.00000 0.00000 0.00041
|
|
64 19G+1 -0.00230 0.00000 0.00136 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00136 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 -0.00042 0.00000
|
|
67 19G-2 -0.00122 0.00000 -0.00042 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 -0.00067 0.00000 0.00000 0.00281
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00209 0.00000
|
|
71 19G-4 0.00344 0.00000 -0.00209 0.00000 0.00000
|
|
72 20G 0 0.00000 -0.00184 0.00000 0.00000 -0.01536
|
|
73 20G+1 -0.02784 0.00000 0.00787 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00787 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 -0.03042 0.00000
|
|
76 20G-2 0.02428 0.00000 -0.03042 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 -0.00516 0.00000 0.00000 0.10798
|
|
79 20G+4 0.00000 0.00000 0.00000 0.02535 0.00000
|
|
80 20G-4 0.01268 0.00000 -0.02535 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00145 0.00000 0.00000 -0.00522
|
|
82 21H+1 0.00524 0.00000 -0.00776 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 -0.00776 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00400 0.00000
|
|
85 21H-2 0.00218 0.00000 0.00400 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 -0.00059 0.00000 0.00000 -0.00111
|
|
88 21H+4 0.00000 0.00000 0.00000 -0.00821 0.00000
|
|
89 21H-4 -0.00260 0.00000 0.00821 0.00000 0.00000
|
|
90 21H+5 0.00383 0.00000 0.00463 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 -0.00463 0.00000
|
|
92 2 H 1S 0.00000 -0.00815 0.00000 0.00519 0.00192
|
|
93 2S 0.00000 -0.04851 0.00000 0.10937 0.20263
|
|
94 3S 0.00000 -0.13203 0.00000 -0.95952 -3.62190
|
|
95 4S 0.00000 -3.27209 0.00000 -1.34166 -7.62080
|
|
96 5S 0.00000 0.59611 0.00000 -1.31208 -0.83191
|
|
97 6PX -0.00041 0.00000 -0.00033 0.00000 0.00000
|
|
98 6PY 0.00000 0.00709 0.00000 -0.00371 -0.00116
|
|
99 6PZ 0.00000 -0.00079 0.00000 0.00236 0.00253
|
|
100 7PX -0.00223 0.00000 0.00646 0.00000 0.00000
|
|
101 7PY 0.00000 -0.05253 0.00000 0.01729 -0.01502
|
|
102 7PZ 0.00000 0.00576 0.00000 -0.01918 -0.00332
|
|
103 8PX -0.06786 0.00000 -0.25195 0.00000 0.00000
|
|
104 8PY 0.00000 0.22989 0.00000 0.27224 1.29698
|
|
105 8PZ 0.00000 -0.07233 0.00000 0.19388 -0.57777
|
|
106 9PX 0.25163 0.00000 -1.90071 0.00000 0.00000
|
|
107 9PY 0.00000 0.24095 0.00000 0.85473 2.65125
|
|
108 9PZ 0.00000 -0.60710 0.00000 0.73453 -1.64038
|
|
109 10D 0 0.00000 0.00000 0.00000 -0.00134 -0.00196
|
|
110 10D+1 -0.00107 0.00000 -0.00270 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00282 0.00000 0.00313 -0.00379
|
|
112 10D+2 0.00000 -0.00209 0.00000 -0.00597 -0.00835
|
|
113 10D-2 -0.00219 0.00000 -0.00156 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00034 0.00000 0.02671 0.03896
|
|
115 11D+1 0.00421 0.00000 0.00374 0.00000 0.00000
|
|
116 11D-1 0.00000 -0.01360 0.00000 -0.00757 0.08719
|
|
117 11D+2 0.00000 0.00817 0.00000 0.05496 0.12161
|
|
118 11D-2 0.01824 0.00000 0.01871 0.00000 0.00000
|
|
119 12D 0 0.00000 0.01583 0.00000 0.21696 0.10362
|
|
120 12D+1 -0.07156 0.00000 -0.11181 0.00000 0.00000
|
|
121 12D-1 0.00000 0.17514 0.00000 -0.26439 0.42627
|
|
122 12D+2 0.00000 0.04882 0.00000 0.03546 0.29832
|
|
123 12D-2 -0.04603 0.00000 0.50831 0.00000 0.00000
|
|
124 13F 0 0.00000 -0.00119 0.00000 0.00192 0.00515
|
|
125 13F+1 0.00036 0.00000 -0.00191 0.00000 0.00000
|
|
126 13F-1 0.00000 -0.00111 0.00000 -0.00219 -0.00228
|
|
127 13F+2 0.00000 -0.00142 0.00000 0.00546 0.00561
|
|
128 13F-2 -0.00163 0.00000 0.00158 0.00000 0.00000
|
|
129 13F+3 0.00250 0.00000 -0.00366 0.00000 0.00000
|
|
130 13F-3 0.00000 -0.00031 0.00000 -0.00158 -0.00862
|
|
131 14F 0 0.00000 0.01163 0.00000 -0.01600 0.02701
|
|
132 14F+1 -0.00302 0.00000 0.02030 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00768 0.00000 -0.05357 0.00440
|
|
134 14F+2 0.00000 0.01613 0.00000 -0.04621 0.05483
|
|
135 14F-2 0.01841 0.00000 0.03105 0.00000 0.00000
|
|
136 14F+3 -0.00797 0.00000 0.09743 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00112 0.00000 -0.02178 -0.01814
|
|
138 15G 0 0.00000 0.00031 0.00000 -0.00318 0.00115
|
|
139 15G+1 0.00021 0.00000 0.00150 0.00000 0.00000
|
|
140 15G-1 0.00000 -0.00006 0.00000 -0.00097 -0.00278
|
|
141 15G+2 0.00000 0.00051 0.00000 -0.00416 0.00136
|
|
142 15G-2 0.00045 0.00000 0.00010 0.00000 0.00000
|
|
143 15G+3 0.00129 0.00000 0.00405 0.00000 0.00000
|
|
144 15G-3 0.00000 -0.00052 0.00000 0.00125 -0.00378
|
|
145 15G+4 0.00000 0.00077 0.00000 -0.00163 -0.00088
|
|
146 15G-4 0.00007 0.00000 -0.00633 0.00000 0.00000
|
|
147 3 H 1S 0.01169 -0.00815 0.00450 -0.00260 0.00192
|
|
148 2S -0.12286 -0.04851 0.09472 -0.05468 0.20263
|
|
149 3S 2.83882 -0.13203 -0.83097 0.47976 -3.62190
|
|
150 4S 6.74196 -3.27209 -1.16191 0.67083 -7.62080
|
|
151 5S 0.91703 0.59611 -1.13629 0.65604 -0.83191
|
|
152 6PX 0.00030 0.00614 -0.00286 0.00146 -0.00101
|
|
153 6PY -0.00041 -0.00355 0.00146 -0.00118 0.00058
|
|
154 6PZ -0.00394 -0.00079 0.00204 -0.00118 0.00253
|
|
155 7PX 0.01895 -0.04549 0.01458 -0.00469 -0.01301
|
|
156 7PY -0.01223 0.02626 -0.00469 0.00917 0.00751
|
|
157 7PZ 0.01166 0.00576 -0.01661 0.00959 -0.00332
|
|
158 8PX -0.87790 0.19909 0.14119 -0.22698 1.12322
|
|
159 8PY 0.46768 -0.11494 -0.22698 -0.12091 -0.64849
|
|
160 8PZ 0.22742 -0.07233 0.16791 -0.09694 -0.57777
|
|
161 9PX -1.72308 0.20867 0.16587 -1.19314 2.29605
|
|
162 9PY 1.14010 -0.12048 -1.19314 -1.21185 -1.32563
|
|
163 9PZ 0.80549 -0.60710 0.63612 -0.36727 -1.64038
|
|
164 10D 0 0.00396 0.00000 -0.00116 0.00067 -0.00196
|
|
165 10D+1 0.00257 0.00244 0.00167 -0.00252 -0.00328
|
|
166 10D-1 -0.00210 -0.00141 -0.00252 -0.00124 0.00189
|
|
167 10D+2 -0.00443 0.00105 0.00191 -0.00266 0.00418
|
|
168 10D-2 0.00549 -0.00181 -0.00487 0.00191 -0.00724
|
|
169 11D 0 -0.04917 0.00034 0.02313 -0.01336 0.03896
|
|
170 11D+1 -0.05310 -0.01178 -0.00475 0.00490 0.07550
|
|
171 11D-1 0.03309 0.00680 0.00490 0.00091 -0.04359
|
|
172 11D+2 0.05763 -0.00409 -0.01570 0.02777 -0.06080
|
|
173 11D-2 -0.08158 0.00708 0.04590 -0.01570 0.10531
|
|
174 12D 0 -0.13394 0.01583 0.18789 -0.10848 0.10362
|
|
175 12D+1 -0.13433 0.15168 -0.22625 0.06607 0.36916
|
|
176 12D-1 0.03624 -0.08757 0.06607 -0.14996 -0.21314
|
|
177 12D+2 0.11853 -0.02441 0.20475 0.39010 -0.14916
|
|
178 12D-2 -0.25133 0.04228 0.15368 0.20475 0.25835
|
|
179 13F 0 -0.00326 -0.00119 0.00166 -0.00096 0.00515
|
|
180 13F+1 0.00299 -0.00096 -0.00212 0.00012 -0.00197
|
|
181 13F-1 -0.00152 0.00056 0.00012 -0.00198 0.00114
|
|
182 13F+2 0.00182 0.00071 -0.00168 0.00255 -0.00280
|
|
183 13F-2 -0.00477 -0.00123 0.00449 -0.00168 0.00486
|
|
184 13F+3 -0.00125 0.00000 0.00183 0.00317 0.00000
|
|
185 13F-3 0.00451 -0.00031 -0.00137 0.00079 -0.00862
|
|
186 14F 0 -0.02078 0.01163 -0.01386 0.00800 0.02701
|
|
187 14F+1 0.01241 0.00665 -0.03510 0.03199 0.00381
|
|
188 14F-1 -0.00891 -0.00384 0.03199 0.00183 -0.00220
|
|
189 14F+2 0.01863 -0.00806 0.03346 0.01174 -0.02742
|
|
190 14F-2 -0.01387 0.01397 -0.02690 0.03346 0.04748
|
|
191 14F+3 0.00399 0.00000 -0.04872 -0.08438 0.00000
|
|
192 14F-3 0.04140 0.00112 -0.01887 0.01089 -0.01814
|
|
193 15G 0 0.00011 0.00031 -0.00276 0.00159 0.00115
|
|
194 15G+1 0.00171 -0.00005 -0.00035 0.00107 -0.00241
|
|
195 15G-1 -0.00086 0.00003 0.00107 0.00088 0.00139
|
|
196 15G+2 -0.00031 -0.00025 0.00185 -0.00097 -0.00068
|
|
197 15G-2 0.00099 0.00044 -0.00310 0.00185 0.00118
|
|
198 15G+3 -0.00064 0.00000 -0.00202 -0.00351 0.00000
|
|
199 15G-3 0.00107 -0.00052 0.00108 -0.00062 -0.00378
|
|
200 15G+4 -0.00118 -0.00038 0.00344 0.00434 0.00044
|
|
201 15G-4 -0.00198 -0.00066 -0.00036 -0.00344 0.00076
|
|
202 4 H 1S -0.01169 -0.00815 -0.00450 -0.00260 0.00192
|
|
203 2S 0.12286 -0.04851 -0.09472 -0.05468 0.20263
|
|
204 3S -2.83882 -0.13203 0.83097 0.47976 -3.62190
|
|
205 4S -6.74196 -3.27209 1.16191 0.67083 -7.62080
|
|
206 5S -0.91703 0.59611 1.13629 0.65604 -0.83191
|
|
207 6PX 0.00030 -0.00614 -0.00286 -0.00146 0.00101
|
|
208 6PY 0.00041 -0.00355 -0.00146 -0.00118 0.00058
|
|
209 6PZ 0.00394 -0.00079 -0.00204 -0.00118 0.00253
|
|
210 7PX 0.01895 0.04549 0.01458 0.00469 0.01301
|
|
211 7PY 0.01223 0.02626 0.00469 0.00917 0.00751
|
|
212 7PZ -0.01166 0.00576 0.01661 0.00959 -0.00332
|
|
213 8PX -0.87790 -0.19909 0.14119 0.22698 -1.12322
|
|
214 8PY -0.46768 -0.11494 0.22698 -0.12091 -0.64849
|
|
215 8PZ -0.22742 -0.07233 -0.16791 -0.09694 -0.57777
|
|
216 9PX -1.72308 -0.20867 0.16587 1.19314 -2.29605
|
|
217 9PY -1.14010 -0.12048 1.19314 -1.21185 -1.32563
|
|
218 9PZ -0.80549 -0.60710 -0.63612 -0.36727 -1.64038
|
|
219 10D 0 -0.00396 0.00000 0.00116 0.00067 -0.00196
|
|
220 10D+1 0.00257 -0.00244 0.00167 0.00252 0.00328
|
|
221 10D-1 0.00210 -0.00141 0.00252 -0.00124 0.00189
|
|
222 10D+2 0.00443 0.00105 -0.00191 -0.00266 0.00418
|
|
223 10D-2 0.00549 0.00181 -0.00487 -0.00191 0.00724
|
|
224 11D 0 0.04917 0.00034 -0.02313 -0.01336 0.03896
|
|
225 11D+1 -0.05310 0.01178 -0.00475 -0.00490 -0.07550
|
|
226 11D-1 -0.03309 0.00680 -0.00490 0.00091 -0.04359
|
|
227 11D+2 -0.05763 -0.00409 0.01570 0.02777 -0.06080
|
|
228 11D-2 -0.08158 -0.00708 0.04590 0.01570 -0.10531
|
|
229 12D 0 0.13394 0.01583 -0.18789 -0.10848 0.10362
|
|
230 12D+1 -0.13433 -0.15168 -0.22625 -0.06607 -0.36916
|
|
231 12D-1 -0.03624 -0.08757 -0.06607 -0.14996 -0.21314
|
|
232 12D+2 -0.11853 -0.02441 -0.20475 0.39010 -0.14916
|
|
233 12D-2 -0.25133 -0.04228 0.15368 -0.20475 -0.25835
|
|
234 13F 0 0.00326 -0.00119 -0.00166 -0.00096 0.00515
|
|
235 13F+1 0.00299 0.00096 -0.00212 -0.00012 0.00197
|
|
236 13F-1 0.00152 0.00056 -0.00012 -0.00198 0.00114
|
|
237 13F+2 -0.00182 0.00071 0.00168 0.00255 -0.00280
|
|
238 13F-2 -0.00477 0.00123 0.00449 0.00168 -0.00486
|
|
239 13F+3 -0.00125 0.00000 0.00183 -0.00317 0.00000
|
|
240 13F-3 -0.00451 -0.00031 0.00137 0.00079 -0.00862
|
|
241 14F 0 0.02078 0.01163 0.01386 0.00800 0.02701
|
|
242 14F+1 0.01241 -0.00665 -0.03510 -0.03199 -0.00381
|
|
243 14F-1 0.00891 -0.00384 -0.03199 0.00183 -0.00220
|
|
244 14F+2 -0.01863 -0.00806 -0.03346 0.01174 -0.02742
|
|
245 14F-2 -0.01387 -0.01397 -0.02690 -0.03346 -0.04748
|
|
246 14F+3 0.00399 0.00000 -0.04872 0.08438 0.00000
|
|
247 14F-3 -0.04140 0.00112 0.01887 0.01089 -0.01814
|
|
248 15G 0 -0.00011 0.00031 0.00276 0.00159 0.00115
|
|
249 15G+1 0.00171 0.00005 -0.00035 -0.00107 0.00241
|
|
250 15G-1 0.00086 0.00003 -0.00107 0.00088 0.00139
|
|
251 15G+2 0.00031 -0.00025 -0.00185 -0.00097 -0.00068
|
|
252 15G-2 0.00099 -0.00044 -0.00310 -0.00185 -0.00118
|
|
253 15G+3 -0.00064 0.00000 -0.00202 0.00351 0.00000
|
|
254 15G-3 -0.00107 -0.00052 -0.00108 -0.00062 -0.00378
|
|
255 15G+4 0.00118 -0.00038 -0.00344 0.00434 0.00044
|
|
256 15G-4 -0.00198 0.00066 -0.00036 0.00344 -0.00076
|
|
16 17 18 19 20
|
|
(E)--V (E)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 0.48911 0.48911 0.68875 0.71225 0.71225
|
|
1 1 N 1S 0.00000 0.00000 0.01809 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 -0.01878 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 0.09940 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 -1.19947 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 3.84955 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 18.64960 0.00000 0.00000
|
|
7 7PX 0.08041 0.00000 0.00000 0.00000 0.02909
|
|
8 7PY 0.00000 0.08041 0.00000 -0.02909 0.00000
|
|
9 7PZ 0.00000 0.00000 -0.05731 0.00000 0.00000
|
|
10 8PX 0.15114 0.00000 0.00000 0.00000 -0.30072
|
|
11 8PY 0.00000 0.15114 0.00000 0.30072 0.00000
|
|
12 8PZ 0.00000 0.00000 0.01461 0.00000 0.00000
|
|
13 9PX -0.07129 0.00000 0.00000 0.00000 2.63063
|
|
14 9PY 0.00000 -0.07129 0.00000 -2.63063 0.00000
|
|
15 9PZ 0.00000 0.00000 -0.55360 0.00000 0.00000
|
|
16 10PX 1.45689 0.00000 0.00000 0.00000 12.29615
|
|
17 10PY 0.00000 1.45689 0.00000 -12.29615 0.00000
|
|
18 10PZ 0.00000 0.00000 -5.99605 0.00000 0.00000
|
|
19 11PX -1.79267 0.00000 0.00000 0.00000 3.80241
|
|
20 11PY 0.00000 -1.79267 0.00000 -3.80241 0.00000
|
|
21 11PZ 0.00000 0.00000 -3.71344 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00197 0.00000 0.00000
|
|
23 12D+1 -0.00579 0.00000 0.00000 0.00000 -0.00037
|
|
24 12D-1 0.00000 -0.00579 0.00000 0.00037 0.00000
|
|
25 12D+2 0.00000 -0.00012 0.00000 0.00184 0.00000
|
|
26 12D-2 -0.00012 0.00000 0.00000 0.00000 -0.00184
|
|
27 13D 0 0.00000 0.00000 -0.02323 0.00000 0.00000
|
|
28 13D+1 0.03888 0.00000 0.00000 0.00000 0.01794
|
|
29 13D-1 0.00000 0.03888 0.00000 -0.01794 0.00000
|
|
30 13D+2 0.00000 -0.00671 0.00000 -0.03264 0.00000
|
|
31 13D-2 -0.00671 0.00000 0.00000 0.00000 0.03264
|
|
32 14D 0 0.00000 0.00000 0.15508 0.00000 0.00000
|
|
33 14D+1 -0.09658 0.00000 0.00000 0.00000 -0.98140
|
|
34 14D-1 0.00000 -0.09658 0.00000 0.98140 0.00000
|
|
35 14D+2 0.00000 0.29822 0.00000 1.23545 0.00000
|
|
36 14D-2 0.29822 0.00000 0.00000 0.00000 -1.23545
|
|
37 15D 0 0.00000 0.00000 0.23053 0.00000 0.00000
|
|
38 15D+1 -0.32639 0.00000 0.00000 0.00000 -2.37723
|
|
39 15D-1 0.00000 -0.32639 0.00000 2.37723 0.00000
|
|
40 15D+2 0.00000 0.66776 0.00000 2.81908 0.00000
|
|
41 15D-2 0.66776 0.00000 0.00000 0.00000 -2.81908
|
|
42 16F 0 0.00000 0.00000 -0.00437 0.00000 0.00000
|
|
43 16F+1 0.00212 0.00000 0.00000 0.00000 0.00712
|
|
44 16F-1 0.00000 0.00212 0.00000 -0.00712 0.00000
|
|
45 16F+2 0.00000 0.00235 0.00000 0.00842 0.00000
|
|
46 16F-2 0.00235 0.00000 0.00000 0.00000 -0.00842
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00484 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.03381 0.00000 0.00000
|
|
50 17F+1 -0.00689 0.00000 0.00000 0.00000 -0.06816
|
|
51 17F-1 0.00000 -0.00689 0.00000 0.06816 0.00000
|
|
52 17F+2 0.00000 -0.03232 0.00000 -0.12386 0.00000
|
|
53 17F-2 -0.03232 0.00000 0.00000 0.00000 0.12386
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 -0.02431 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.39869 0.00000 0.00000
|
|
57 18F+1 0.04755 0.00000 0.00000 0.00000 -0.37128
|
|
58 18F-1 0.00000 0.04755 0.00000 0.37128 0.00000
|
|
59 18F+2 0.00000 -0.16050 0.00000 -0.37001 0.00000
|
|
60 18F-2 -0.16050 0.00000 0.00000 0.00000 0.37001
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 -0.22349 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00301 0.00000 0.00000
|
|
64 19G+1 -0.00234 0.00000 0.00000 0.00000 0.00336
|
|
65 19G-1 0.00000 -0.00234 0.00000 -0.00336 0.00000
|
|
66 19G+2 0.00000 -0.00205 0.00000 0.00214 0.00000
|
|
67 19G-2 -0.00205 0.00000 0.00000 0.00000 -0.00214
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 -0.00484 0.00000 0.00000
|
|
70 19G+4 0.00000 -0.00333 0.00000 -0.00382 0.00000
|
|
71 19G-4 0.00333 0.00000 0.00000 0.00000 -0.00382
|
|
72 20G 0 0.00000 0.00000 -0.07911 0.00000 0.00000
|
|
73 20G+1 0.01374 0.00000 0.00000 0.00000 0.10355
|
|
74 20G-1 0.00000 0.01374 0.00000 -0.10355 0.00000
|
|
75 20G+2 0.00000 0.00928 0.00000 -0.04996 0.00000
|
|
76 20G-2 0.00928 0.00000 0.00000 0.00000 0.04996
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.09989 0.00000 0.00000
|
|
79 20G+4 0.00000 0.04793 0.00000 -0.12388 0.00000
|
|
80 20G-4 -0.04793 0.00000 0.00000 0.00000 -0.12388
|
|
81 21H 0 0.00000 0.00000 0.00135 0.00000 0.00000
|
|
82 21H+1 -0.00113 0.00000 0.00000 0.00000 -0.00064
|
|
83 21H-1 0.00000 -0.00113 0.00000 0.00064 0.00000
|
|
84 21H+2 0.00000 0.00304 0.00000 0.00937 0.00000
|
|
85 21H-2 0.00304 0.00000 0.00000 0.00000 -0.00937
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 -0.01231 0.00000 0.00000
|
|
88 21H+4 0.00000 -0.00759 0.00000 0.01358 0.00000
|
|
89 21H-4 0.00759 0.00000 0.00000 0.00000 0.01358
|
|
90 21H+5 0.00605 0.00000 0.00000 0.00000 -0.00754
|
|
91 21H-5 0.00000 -0.00605 0.00000 -0.00754 0.00000
|
|
92 2 H 1S 0.00000 -0.00558 0.00620 -0.02450 0.00000
|
|
93 2S 0.00000 -0.12488 -0.01026 -0.43818 0.00000
|
|
94 3S 0.00000 0.34125 -1.48827 6.36816 0.00000
|
|
95 4S 0.00000 -0.59905 -7.33859 14.11088 0.00000
|
|
96 5S 0.00000 2.70655 -0.09497 -0.28217 0.00000
|
|
97 6PX -0.00294 0.00000 0.00000 0.00000 0.00047
|
|
98 6PY 0.00000 0.00313 -0.00166 0.00274 0.00000
|
|
99 6PZ 0.00000 -0.00432 -0.00458 -0.00668 0.00000
|
|
100 7PX 0.02910 0.00000 0.00000 0.00000 -0.00464
|
|
101 7PY 0.00000 -0.01512 0.00798 0.03474 0.00000
|
|
102 7PZ 0.00000 0.02404 0.01626 0.01087 0.00000
|
|
103 8PX -0.28465 0.00000 0.00000 0.00000 -0.08472
|
|
104 8PY 0.00000 -0.06845 0.58651 -2.27489 0.00000
|
|
105 8PZ 0.00000 0.00010 -0.13178 1.09224 0.00000
|
|
106 9PX -0.66374 0.00000 0.00000 0.00000 -1.10948
|
|
107 9PY 0.00000 -0.45575 1.99023 -4.65535 0.00000
|
|
108 9PZ 0.00000 0.73456 1.05501 3.60487 0.00000
|
|
109 10D 0 0.00000 0.00199 -0.00362 0.00468 0.00000
|
|
110 10D+1 0.00038 0.00000 0.00000 0.00000 0.00175
|
|
111 10D-1 0.00000 0.00452 -0.00131 0.01343 0.00000
|
|
112 10D+2 0.00000 0.00296 0.00213 0.01238 0.00000
|
|
113 10D-2 -0.00470 0.00000 0.00000 0.00000 -0.00050
|
|
114 11D 0 0.00000 -0.01277 0.04132 -0.07254 0.00000
|
|
115 11D+1 -0.00947 0.00000 0.00000 0.00000 -0.01589
|
|
116 11D-1 0.00000 -0.02297 0.02559 -0.21805 0.00000
|
|
117 11D+2 0.00000 -0.01841 0.03606 -0.21640 0.00000
|
|
118 11D-2 0.03940 0.00000 0.00000 0.00000 0.01130
|
|
119 12D 0 0.00000 0.02212 0.23651 0.04318 0.00000
|
|
120 12D+1 -0.09538 0.00000 0.00000 0.00000 -0.06048
|
|
121 12D-1 0.00000 -0.12761 -0.26293 -0.85864 0.00000
|
|
122 12D+2 0.00000 -0.09686 0.21495 -0.50922 0.00000
|
|
123 12D-2 0.28977 0.00000 0.00000 0.00000 0.29348
|
|
124 13F 0 0.00000 0.00091 0.00158 -0.00600 0.00000
|
|
125 13F+1 -0.00063 0.00000 0.00000 0.00000 -0.00090
|
|
126 13F-1 0.00000 0.00091 0.00016 0.00798 0.00000
|
|
127 13F+2 0.00000 0.00282 0.00618 -0.01342 0.00000
|
|
128 13F-2 0.00076 0.00000 0.00000 0.00000 -0.00060
|
|
129 13F+3 0.00172 0.00000 0.00000 0.00000 -0.00278
|
|
130 13F-3 0.00000 -0.00093 -0.00365 0.01165 0.00000
|
|
131 14F 0 0.00000 -0.02460 -0.01649 -0.08635 0.00000
|
|
132 14F+1 0.00996 0.00000 0.00000 0.00000 0.01381
|
|
133 14F-1 0.00000 -0.00945 -0.07260 -0.08499 0.00000
|
|
134 14F+2 0.00000 -0.03878 -0.05186 -0.12245 0.00000
|
|
135 14F-2 0.03563 0.00000 0.00000 0.00000 0.02867
|
|
136 14F+3 0.05796 0.00000 0.00000 0.00000 0.06348
|
|
137 14F-3 0.00000 0.02333 -0.01555 0.06071 0.00000
|
|
138 15G 0 0.00000 -0.00156 -0.00406 -0.00496 0.00000
|
|
139 15G+1 0.00103 0.00000 0.00000 0.00000 0.00070
|
|
140 15G-1 0.00000 0.00157 0.00031 0.00388 0.00000
|
|
141 15G+2 0.00000 -0.00087 -0.00460 -0.00621 0.00000
|
|
142 15G-2 0.00006 0.00000 0.00000 0.00000 -0.00142
|
|
143 15G+3 0.00371 0.00000 0.00000 0.00000 0.00152
|
|
144 15G-3 0.00000 0.00146 0.00225 0.00723 0.00000
|
|
145 15G+4 0.00000 0.00132 -0.00178 0.00326 0.00000
|
|
146 15G-4 -0.00474 0.00000 0.00000 0.00000 -0.00395
|
|
147 3 H 1S -0.00483 0.00279 0.00620 0.01225 0.02121
|
|
148 2S -0.10815 0.06244 -0.01026 0.21909 0.37947
|
|
149 3S 0.29553 -0.17062 -1.48827 -3.18408 -5.51499
|
|
150 4S -0.51879 0.29953 -7.33859 -7.05544 -12.22038
|
|
151 5S 2.34394 -1.35327 -0.09497 0.14109 0.24437
|
|
152 6PX 0.00161 -0.00263 -0.00144 -0.00139 -0.00194
|
|
153 6PY -0.00263 -0.00143 0.00083 0.00033 0.00139
|
|
154 6PZ -0.00374 0.00216 -0.00458 0.00334 0.00579
|
|
155 7PX -0.00407 0.01915 0.00691 -0.01303 -0.02721
|
|
156 7PY 0.01915 0.01804 -0.00399 0.01217 0.01303
|
|
157 7PZ 0.02082 -0.01202 0.01626 -0.00543 -0.00941
|
|
158 8PX -0.12250 -0.09362 0.50793 1.02174 1.68499
|
|
159 8PY -0.09362 -0.23060 -0.29325 -0.50518 -1.02174
|
|
160 8PZ 0.00009 -0.00005 -0.13178 -0.54612 -0.94591
|
|
161 9PX -0.50775 -0.09006 1.72359 2.49624 3.21414
|
|
162 9PY -0.09006 -0.61174 -0.99511 -0.33173 -2.49624
|
|
163 9PZ 0.63615 -0.36728 1.05501 -1.80243 -3.12191
|
|
164 10D 0 0.00172 -0.00099 -0.00362 -0.00234 -0.00405
|
|
165 10D+1 0.00349 -0.00179 -0.00113 -0.00657 -0.00964
|
|
166 10D-1 -0.00179 0.00142 0.00065 0.00205 0.00657
|
|
167 10D+2 -0.00331 -0.00279 -0.00107 0.00347 0.00515
|
|
168 10D-2 0.00104 -0.00331 0.00185 -0.00515 -0.00941
|
|
169 11D 0 -0.01106 0.00638 0.04132 0.03627 0.06282
|
|
170 11D+1 -0.01959 0.00585 0.02216 0.10130 0.15956
|
|
171 11D-1 0.00585 -0.01284 -0.01279 -0.04260 -0.10130
|
|
172 11D+2 0.02503 0.02495 -0.01803 -0.06258 -0.08881
|
|
173 11D-2 -0.00396 0.02503 0.03123 0.08881 0.16512
|
|
174 12D 0 0.01915 -0.01106 0.23651 -0.02159 -0.03740
|
|
175 12D+1 -0.11956 0.01396 -0.22771 0.39799 0.62886
|
|
176 12D-1 0.01396 -0.10344 0.13147 -0.16930 -0.39799
|
|
177 12D+2 0.16741 0.19311 -0.10748 -0.34741 -0.09342
|
|
178 12D-2 -0.00020 0.16741 0.18616 0.09342 0.45528
|
|
179 13F 0 0.00079 -0.00045 0.00158 0.00300 0.00519
|
|
180 13F+1 0.00053 -0.00067 0.00014 -0.00307 -0.00621
|
|
181 13F-1 -0.00067 -0.00024 -0.00008 0.00267 0.00307
|
|
182 13F+2 -0.00089 0.00127 -0.00309 -0.00290 -0.00607
|
|
183 13F-2 0.00231 -0.00089 0.00535 0.00607 0.00991
|
|
184 13F+3 -0.00086 -0.00149 0.00000 -0.00241 0.00139
|
|
185 13F-3 -0.00081 0.00047 -0.00365 -0.00583 -0.01009
|
|
186 14F 0 -0.02130 0.01230 -0.01649 0.04318 0.07478
|
|
187 14F+1 -0.00460 0.00841 -0.06287 0.03082 0.06719
|
|
188 14F-1 0.00841 0.00511 0.03630 -0.03160 -0.03082
|
|
189 14F+2 0.03222 0.01703 0.02593 -0.05212 -0.04061
|
|
190 14F-2 -0.02018 0.03222 -0.04492 0.04061 0.09900
|
|
191 14F+3 -0.02898 -0.05020 0.00000 0.05498 -0.03174
|
|
192 14F-3 0.02021 -0.01167 -0.01555 -0.03035 -0.05258
|
|
193 15G 0 -0.00135 0.00078 -0.00406 0.00248 0.00430
|
|
194 15G+1 0.00144 -0.00023 0.00027 -0.00198 -0.00274
|
|
195 15G-1 -0.00023 0.00117 -0.00016 0.00045 0.00198
|
|
196 15G+2 0.00040 -0.00017 0.00230 -0.00049 -0.00330
|
|
197 15G-2 -0.00064 0.00040 -0.00399 0.00330 0.00431
|
|
198 15G+3 -0.00185 -0.00321 0.00000 0.00131 -0.00076
|
|
199 15G-3 0.00127 -0.00073 0.00225 -0.00362 -0.00626
|
|
200 15G+4 0.00148 0.00389 0.00089 -0.00215 0.00312
|
|
201 15G-4 -0.00218 -0.00148 0.00154 0.00312 0.00146
|
|
202 4 H 1S 0.00483 0.00279 0.00620 0.01225 -0.02121
|
|
203 2S 0.10815 0.06244 -0.01026 0.21909 -0.37947
|
|
204 3S -0.29553 -0.17062 -1.48827 -3.18408 5.51499
|
|
205 4S 0.51879 0.29953 -7.33859 -7.05544 12.22038
|
|
206 5S -2.34394 -1.35327 -0.09497 0.14109 -0.24437
|
|
207 6PX 0.00161 0.00263 0.00144 0.00139 -0.00194
|
|
208 6PY 0.00263 -0.00143 0.00083 0.00033 -0.00139
|
|
209 6PZ 0.00374 0.00216 -0.00458 0.00334 -0.00579
|
|
210 7PX -0.00407 -0.01915 -0.00691 0.01303 -0.02721
|
|
211 7PY -0.01915 0.01804 -0.00399 0.01217 -0.01303
|
|
212 7PZ -0.02082 -0.01202 0.01626 -0.00543 0.00941
|
|
213 8PX -0.12250 0.09362 -0.50793 -1.02174 1.68499
|
|
214 8PY 0.09362 -0.23060 -0.29325 -0.50518 1.02174
|
|
215 8PZ -0.00009 -0.00005 -0.13178 -0.54612 0.94591
|
|
216 9PX -0.50775 0.09006 -1.72359 -2.49624 3.21414
|
|
217 9PY 0.09006 -0.61174 -0.99511 -0.33173 2.49624
|
|
218 9PZ -0.63615 -0.36728 1.05501 -1.80243 3.12191
|
|
219 10D 0 -0.00172 -0.00099 -0.00362 -0.00234 0.00405
|
|
220 10D+1 0.00349 0.00179 0.00113 0.00657 -0.00964
|
|
221 10D-1 0.00179 0.00142 0.00065 0.00205 -0.00657
|
|
222 10D+2 0.00331 -0.00279 -0.00107 0.00347 -0.00515
|
|
223 10D-2 0.00104 0.00331 -0.00185 0.00515 -0.00941
|
|
224 11D 0 0.01106 0.00638 0.04132 0.03627 -0.06282
|
|
225 11D+1 -0.01959 -0.00585 -0.02216 -0.10130 0.15956
|
|
226 11D-1 -0.00585 -0.01284 -0.01279 -0.04260 0.10130
|
|
227 11D+2 -0.02503 0.02495 -0.01803 -0.06258 0.08881
|
|
228 11D-2 -0.00396 -0.02503 -0.03123 -0.08881 0.16512
|
|
229 12D 0 -0.01915 -0.01106 0.23651 -0.02159 0.03740
|
|
230 12D+1 -0.11956 -0.01396 0.22771 -0.39799 0.62886
|
|
231 12D-1 -0.01396 -0.10344 0.13147 -0.16930 0.39799
|
|
232 12D+2 -0.16741 0.19311 -0.10748 -0.34741 0.09342
|
|
233 12D-2 -0.00020 -0.16741 -0.18616 -0.09342 0.45528
|
|
234 13F 0 -0.00079 -0.00045 0.00158 0.00300 -0.00519
|
|
235 13F+1 0.00053 0.00067 -0.00014 0.00307 -0.00621
|
|
236 13F-1 0.00067 -0.00024 -0.00008 0.00267 -0.00307
|
|
237 13F+2 0.00089 0.00127 -0.00309 -0.00290 0.00607
|
|
238 13F-2 0.00231 0.00089 -0.00535 -0.00607 0.00991
|
|
239 13F+3 -0.00086 0.00149 0.00000 0.00241 0.00139
|
|
240 13F-3 0.00081 0.00047 -0.00365 -0.00583 0.01009
|
|
241 14F 0 0.02130 0.01230 -0.01649 0.04318 -0.07478
|
|
242 14F+1 -0.00460 -0.00841 0.06287 -0.03082 0.06719
|
|
243 14F-1 -0.00841 0.00511 0.03630 -0.03160 0.03082
|
|
244 14F+2 -0.03222 0.01703 0.02593 -0.05212 0.04061
|
|
245 14F-2 -0.02018 -0.03222 0.04492 -0.04061 0.09900
|
|
246 14F+3 -0.02898 0.05020 0.00000 -0.05498 -0.03174
|
|
247 14F-3 -0.02021 -0.01167 -0.01555 -0.03035 0.05258
|
|
248 15G 0 0.00135 0.00078 -0.00406 0.00248 -0.00430
|
|
249 15G+1 0.00144 0.00023 -0.00027 0.00198 -0.00274
|
|
250 15G-1 0.00023 0.00117 -0.00016 0.00045 -0.00198
|
|
251 15G+2 -0.00040 -0.00017 0.00230 -0.00049 0.00330
|
|
252 15G-2 -0.00064 -0.00040 0.00399 -0.00330 0.00431
|
|
253 15G+3 -0.00185 0.00321 0.00000 -0.00131 -0.00076
|
|
254 15G-3 -0.00127 -0.00073 0.00225 -0.00362 0.00626
|
|
255 15G+4 -0.00148 0.00389 0.00089 -0.00215 -0.00312
|
|
256 15G-4 -0.00218 0.00148 -0.00154 -0.00312 0.00146
|
|
21 22 23 24 25
|
|
(A2)--V (E)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 0.71652 0.80415 0.80415 0.88352 0.88352
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 0.00631 0.00000 -0.02556
|
|
8 7PY 0.00000 0.00631 0.00000 -0.02556 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 0.20762 0.00000 0.24819
|
|
11 8PY 0.00000 0.20762 0.00000 0.24819 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 -1.89087 0.00000 -3.46148
|
|
14 9PY 0.00000 -1.89087 0.00000 -3.46148 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 -7.33713 0.00000 -5.48936
|
|
17 10PY 0.00000 -7.33713 0.00000 -5.48936 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 -0.81759 0.00000 -0.54255
|
|
20 11PY 0.00000 -0.81759 0.00000 -0.54255 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00538 0.00000 -0.00778
|
|
24 12D-1 0.00000 0.00538 0.00000 -0.00778 0.00000
|
|
25 12D+2 0.00000 0.00345 0.00000 -0.01557 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00345 0.00000 -0.01557
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 -0.04826 0.00000 0.00315
|
|
29 13D-1 0.00000 -0.04826 0.00000 0.00315 0.00000
|
|
30 13D+2 0.00000 -0.03888 0.00000 0.04006 0.00000
|
|
31 13D-2 0.00000 0.00000 -0.03888 0.00000 0.04006
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 1.26597 0.00000 1.07266
|
|
34 14D-1 0.00000 1.26597 0.00000 1.07266 0.00000
|
|
35 14D+2 0.00000 1.25949 0.00000 0.77545 0.00000
|
|
36 14D-2 0.00000 0.00000 1.25949 0.00000 0.77545
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 2.92939 0.00000 0.11867
|
|
39 15D-1 0.00000 2.92939 0.00000 0.11867 0.00000
|
|
40 15D+2 0.00000 2.96668 0.00000 -1.44529 0.00000
|
|
41 15D-2 0.00000 0.00000 2.96668 0.00000 -1.44529
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00532 0.00000 -0.00620
|
|
44 16F-1 0.00000 0.00532 0.00000 -0.00620 0.00000
|
|
45 16F+2 0.00000 0.01686 0.00000 0.01529 0.00000
|
|
46 16F-2 0.00000 0.00000 0.01686 0.00000 0.01529
|
|
47 16F+3 -0.01584 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 -0.03306 0.00000 0.05313
|
|
51 17F-1 0.00000 -0.03306 0.00000 0.05313 0.00000
|
|
52 17F+2 0.00000 -0.18773 0.00000 -0.18363 0.00000
|
|
53 17F-2 0.00000 0.00000 -0.18773 0.00000 -0.18363
|
|
54 17F+3 0.12081 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 -0.53831 0.00000 0.07824
|
|
58 18F-1 0.00000 -0.53831 0.00000 0.07824 0.00000
|
|
59 18F+2 0.00000 -0.96510 0.00000 0.46104 0.00000
|
|
60 18F-2 0.00000 0.00000 -0.96510 0.00000 0.46104
|
|
61 18F+3 0.92936 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 -0.00663 0.00000 -0.01160
|
|
65 19G-1 0.00000 -0.00663 0.00000 -0.01160 0.00000
|
|
66 19G+2 0.00000 -0.00389 0.00000 0.00656 0.00000
|
|
67 19G-2 0.00000 0.00000 -0.00389 0.00000 0.00656
|
|
68 19G+3 0.00593 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 -0.00715 0.00000 -0.00799 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00715 0.00000 0.00799
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 -0.02562 0.00000 -0.04548
|
|
74 20G-1 0.00000 -0.02562 0.00000 -0.04548 0.00000
|
|
75 20G+2 0.00000 0.10926 0.00000 -0.04794 0.00000
|
|
76 20G-2 0.00000 0.00000 0.10926 0.00000 -0.04794
|
|
77 20G+3 -0.16692 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.02667 0.00000 -0.10212 0.00000
|
|
80 20G-4 0.00000 0.00000 -0.02667 0.00000 0.10212
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.01460 0.00000 0.00049
|
|
83 21H-1 0.00000 0.01460 0.00000 0.00049 0.00000
|
|
84 21H+2 0.00000 0.00154 0.00000 0.00171 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00154 0.00000 0.00171
|
|
86 21H+3 0.00673 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00192 0.00000 0.01620 0.00000
|
|
89 21H-4 0.00000 0.00000 -0.00192 0.00000 -0.01620
|
|
90 21H+5 0.00000 0.00000 0.00677 0.00000 -0.00387
|
|
91 21H-5 0.00000 -0.00677 0.00000 0.00387 0.00000
|
|
92 2 H 1S 0.00000 -0.02336 0.00000 0.02654 0.00000
|
|
93 2S 0.00000 -0.39561 0.00000 -0.49811 0.00000
|
|
94 3S 0.00000 5.46874 0.00000 2.66230 0.00000
|
|
95 4S 0.00000 11.41029 0.00000 8.10067 0.00000
|
|
96 5S 0.00000 -0.92086 0.00000 0.22585 0.00000
|
|
97 6PX -0.00418 0.00000 0.00524 0.00000 0.00913
|
|
98 6PY 0.00000 0.00138 0.00000 0.00537 0.00000
|
|
99 6PZ 0.00000 0.00145 0.00000 -0.00324 0.00000
|
|
100 7PX 0.01030 0.00000 -0.01404 0.00000 -0.07384
|
|
101 7PY 0.00000 0.05447 0.00000 0.04582 0.00000
|
|
102 7PZ 0.00000 -0.01164 0.00000 -0.01756 0.00000
|
|
103 8PX 0.34995 0.00000 -0.18087 0.00000 0.61080
|
|
104 8PY 0.00000 -2.29135 0.00000 -1.59694 0.00000
|
|
105 8PZ 0.00000 0.46690 0.00000 0.85406 0.00000
|
|
106 9PX 1.92763 0.00000 -1.54481 0.00000 0.39971
|
|
107 9PY 0.00000 -5.57043 0.00000 -5.62096 0.00000
|
|
108 9PZ 0.00000 0.31871 0.00000 1.88889 0.00000
|
|
109 10D 0 0.00000 0.01057 0.00000 0.00176 0.00000
|
|
110 10D+1 -0.00513 0.00000 -0.00084 0.00000 -0.00012
|
|
111 10D-1 0.00000 0.00667 0.00000 0.01950 0.00000
|
|
112 10D+2 0.00000 0.01762 0.00000 0.01651 0.00000
|
|
113 10D-2 0.00345 0.00000 -0.00072 0.00000 0.01482
|
|
114 11D 0 0.00000 -0.12346 0.00000 -0.03195 0.00000
|
|
115 11D+1 0.03738 0.00000 0.00173 0.00000 0.00292
|
|
116 11D-1 0.00000 -0.11925 0.00000 -0.21003 0.00000
|
|
117 11D+2 0.00000 -0.23155 0.00000 -0.19368 0.00000
|
|
118 11D-2 -0.04698 0.00000 0.02346 0.00000 -0.10164
|
|
119 12D 0 0.00000 -0.67391 0.00000 -0.48805 0.00000
|
|
120 12D+1 0.27920 0.00000 -0.26450 0.00000 0.20232
|
|
121 12D-1 0.00000 -0.06310 0.00000 -0.91084 0.00000
|
|
122 12D+2 0.00000 -0.96832 0.00000 -1.06357 0.00000
|
|
123 12D-2 -0.66899 0.00000 0.40585 0.00000 -0.32700
|
|
124 13F 0 0.00000 -0.00943 0.00000 -0.00361 0.00000
|
|
125 13F+1 -0.00153 0.00000 -0.00121 0.00000 0.00066
|
|
126 13F-1 0.00000 -0.00072 0.00000 -0.00470 0.00000
|
|
127 13F+2 0.00000 -0.00847 0.00000 -0.00393 0.00000
|
|
128 13F-2 0.00258 0.00000 -0.00445 0.00000 0.00230
|
|
129 13F+3 0.00490 0.00000 -0.00043 0.00000 -0.00446
|
|
130 13F-3 0.00000 0.00854 0.00000 0.00738 0.00000
|
|
131 14F 0 0.00000 -0.02915 0.00000 -0.11664 0.00000
|
|
132 14F+1 -0.00598 0.00000 0.01478 0.00000 -0.02420
|
|
133 14F-1 0.00000 0.16182 0.00000 0.05315 0.00000
|
|
134 14F+2 0.00000 -0.03118 0.00000 -0.19976 0.00000
|
|
135 14F-2 -0.09016 0.00000 0.07734 0.00000 -0.05419
|
|
136 14F+3 -0.14880 0.00000 0.07022 0.00000 -0.07382
|
|
137 14F-3 0.00000 0.14606 0.00000 0.15391 0.00000
|
|
138 15G 0 0.00000 0.00532 0.00000 0.00058 0.00000
|
|
139 15G+1 -0.00220 0.00000 0.00187 0.00000 -0.00107
|
|
140 15G-1 0.00000 0.00507 0.00000 0.00902 0.00000
|
|
141 15G+2 0.00000 0.00915 0.00000 -0.00043 0.00000
|
|
142 15G-2 0.00258 0.00000 0.00017 0.00000 0.00152
|
|
143 15G+3 -0.00671 0.00000 0.00575 0.00000 -0.00360
|
|
144 15G-3 0.00000 0.00098 0.00000 0.01290 0.00000
|
|
145 15G+4 0.00000 0.00711 0.00000 0.00829 0.00000
|
|
146 15G-4 0.00981 0.00000 -0.00508 0.00000 0.00552
|
|
147 3 H 1S 0.00000 0.01168 -0.02023 -0.01327 0.02298
|
|
148 2S 0.00000 0.19780 -0.34260 0.24905 -0.43137
|
|
149 3S 0.00000 -2.73437 4.73607 -1.33115 2.30562
|
|
150 4S 0.00000 -5.70514 9.88160 -4.05034 7.01539
|
|
151 5S 0.00000 0.46043 -0.79749 -0.11293 0.19560
|
|
152 6PX 0.00209 0.00168 0.00234 0.00163 0.00631
|
|
153 6PY 0.00362 0.00428 0.00168 0.00819 0.00163
|
|
154 6PZ 0.00000 -0.00072 0.00125 0.00162 -0.00281
|
|
155 7PX -0.00515 -0.02966 0.03734 -0.05182 0.01591
|
|
156 7PY -0.00892 0.00309 -0.02966 -0.04392 -0.05182
|
|
157 7PZ 0.00000 0.00582 -0.01008 0.00878 -0.01521
|
|
158 8PX -0.17497 0.91387 -1.76373 0.95598 -1.04500
|
|
159 8PY -0.30306 -0.70849 0.91387 0.05886 0.95598
|
|
160 8PZ 0.00000 -0.23345 0.40435 -0.42703 0.73963
|
|
161 9PX -0.96382 1.74314 -4.56402 2.60703 -4.11579
|
|
162 9PY -1.66938 -2.55122 1.74314 -1.10545 2.60703
|
|
163 9PZ 0.00000 -0.15935 0.27601 -0.94445 1.63583
|
|
164 10D 0 0.00000 -0.00528 0.00915 -0.00088 0.00153
|
|
165 10D+1 0.00257 -0.00325 0.00479 -0.00850 0.01460
|
|
166 10D-1 0.00445 0.00104 -0.00325 0.00478 -0.00850
|
|
167 10D+2 -0.00298 0.00386 -0.00794 0.01524 -0.00073
|
|
168 10D-2 -0.00172 -0.00794 0.01303 -0.00073 0.01608
|
|
169 11D 0 0.00000 0.06173 -0.10692 0.01597 -0.02767
|
|
170 11D+1 -0.01869 0.05239 -0.08901 0.09221 -0.15680
|
|
171 11D-1 -0.03237 -0.02852 0.05239 -0.05032 0.09221
|
|
172 11D+2 0.04068 -0.04029 0.11042 -0.12465 0.03985
|
|
173 11D-2 0.02349 0.11042 -0.16780 0.03985 -0.17067
|
|
174 12D 0 0.00000 0.33695 -0.58362 0.24403 -0.42267
|
|
175 12D+1 -0.13960 -0.08721 -0.11345 0.48201 -0.63255
|
|
176 12D-1 -0.24180 -0.21415 -0.08721 -0.07597 0.48201
|
|
177 12D+2 0.57937 0.06231 0.59503 -0.51114 0.31895
|
|
178 12D-2 0.33450 0.59503 -0.62477 0.31895 -0.87943
|
|
179 13F 0 0.00000 0.00472 -0.00817 0.00181 -0.00313
|
|
180 13F+1 0.00077 -0.00021 -0.00084 0.00232 -0.00336
|
|
181 13F-1 0.00133 -0.00109 -0.00021 -0.00068 0.00232
|
|
182 13F+2 -0.00223 -0.00545 0.00174 0.00074 0.00270
|
|
183 13F-2 -0.00129 0.00174 -0.00746 0.00270 -0.00237
|
|
184 13F+3 0.00490 0.00037 0.00022 0.00386 0.00223
|
|
185 13F-3 0.00000 -0.00427 0.00739 -0.00369 0.00639
|
|
186 14F 0 0.00000 0.01457 -0.02524 0.05832 -0.10102
|
|
187 14F+1 0.00299 -0.06367 0.12506 -0.03349 0.03381
|
|
188 14F-1 0.00518 0.05154 -0.06367 -0.00486 -0.03349
|
|
189 14F+2 0.07808 0.05021 0.04699 -0.09058 0.06303
|
|
190 14F-2 0.04508 0.04699 -0.00405 0.06303 -0.16337
|
|
191 14F+3 -0.14880 -0.06081 -0.03511 0.06393 0.03691
|
|
192 14F-3 0.00000 -0.07303 0.12649 -0.07696 0.13329
|
|
193 15G 0 0.00000 -0.00266 0.00461 -0.00029 0.00050
|
|
194 15G+1 0.00110 -0.00139 0.00427 -0.00437 0.00650
|
|
195 15G-1 0.00190 0.00267 -0.00139 0.00145 -0.00437
|
|
196 15G+2 -0.00223 0.00242 -0.00389 0.00103 0.00084
|
|
197 15G-2 -0.00129 -0.00389 0.00690 0.00084 0.00006
|
|
198 15G+3 -0.00671 -0.00498 -0.00288 0.00312 0.00180
|
|
199 15G-3 0.00000 -0.00049 0.00085 -0.00645 0.01117
|
|
200 15G+4 0.00850 0.00558 -0.00088 -0.00207 -0.00598
|
|
201 15G-4 -0.00491 0.00088 -0.00660 0.00598 -0.00484
|
|
202 4 H 1S 0.00000 0.01168 0.02023 -0.01327 -0.02298
|
|
203 2S 0.00000 0.19780 0.34260 0.24905 0.43137
|
|
204 3S 0.00000 -2.73437 -4.73607 -1.33115 -2.30562
|
|
205 4S 0.00000 -5.70514 -9.88160 -4.05034 -7.01539
|
|
206 5S 0.00000 0.46043 0.79749 -0.11293 -0.19560
|
|
207 6PX 0.00209 -0.00168 0.00234 -0.00163 0.00631
|
|
208 6PY -0.00362 0.00428 -0.00168 0.00819 -0.00163
|
|
209 6PZ 0.00000 -0.00072 -0.00125 0.00162 0.00281
|
|
210 7PX -0.00515 0.02966 0.03734 0.05182 0.01591
|
|
211 7PY 0.00892 0.00309 0.02966 -0.04392 0.05182
|
|
212 7PZ 0.00000 0.00582 0.01008 0.00878 0.01521
|
|
213 8PX -0.17497 -0.91387 -1.76373 -0.95598 -1.04500
|
|
214 8PY 0.30306 -0.70849 -0.91387 0.05886 -0.95598
|
|
215 8PZ 0.00000 -0.23345 -0.40435 -0.42703 -0.73963
|
|
216 9PX -0.96382 -1.74314 -4.56402 -2.60703 -4.11579
|
|
217 9PY 1.66938 -2.55122 -1.74314 -1.10545 -2.60703
|
|
218 9PZ 0.00000 -0.15935 -0.27601 -0.94445 -1.63583
|
|
219 10D 0 0.00000 -0.00528 -0.00915 -0.00088 -0.00153
|
|
220 10D+1 0.00257 0.00325 0.00479 0.00850 0.01460
|
|
221 10D-1 -0.00445 0.00104 0.00325 0.00478 0.00850
|
|
222 10D+2 0.00298 0.00386 0.00794 0.01524 0.00073
|
|
223 10D-2 -0.00172 0.00794 0.01303 0.00073 0.01608
|
|
224 11D 0 0.00000 0.06173 0.10692 0.01597 0.02767
|
|
225 11D+1 -0.01869 -0.05239 -0.08901 -0.09221 -0.15680
|
|
226 11D-1 0.03237 -0.02852 -0.05239 -0.05032 -0.09221
|
|
227 11D+2 -0.04068 -0.04029 -0.11042 -0.12465 -0.03985
|
|
228 11D-2 0.02349 -0.11042 -0.16780 -0.03985 -0.17067
|
|
229 12D 0 0.00000 0.33695 0.58362 0.24403 0.42267
|
|
230 12D+1 -0.13960 0.08721 -0.11345 -0.48201 -0.63255
|
|
231 12D-1 0.24180 -0.21415 0.08721 -0.07597 -0.48201
|
|
232 12D+2 -0.57937 0.06231 -0.59503 -0.51114 -0.31895
|
|
233 12D-2 0.33450 -0.59503 -0.62477 -0.31895 -0.87943
|
|
234 13F 0 0.00000 0.00472 0.00817 0.00181 0.00313
|
|
235 13F+1 0.00077 0.00021 -0.00084 -0.00232 -0.00336
|
|
236 13F-1 -0.00133 -0.00109 0.00021 -0.00068 -0.00232
|
|
237 13F+2 0.00223 -0.00545 -0.00174 0.00074 -0.00270
|
|
238 13F-2 -0.00129 -0.00174 -0.00746 -0.00270 -0.00237
|
|
239 13F+3 0.00490 -0.00037 0.00022 -0.00386 0.00223
|
|
240 13F-3 0.00000 -0.00427 -0.00739 -0.00369 -0.00639
|
|
241 14F 0 0.00000 0.01457 0.02524 0.05832 0.10102
|
|
242 14F+1 0.00299 0.06367 0.12506 0.03349 0.03381
|
|
243 14F-1 -0.00518 0.05154 0.06367 -0.00486 0.03349
|
|
244 14F+2 -0.07808 0.05021 -0.04699 -0.09058 -0.06303
|
|
245 14F-2 0.04508 -0.04699 -0.00405 -0.06303 -0.16337
|
|
246 14F+3 -0.14880 0.06081 -0.03511 -0.06393 0.03691
|
|
247 14F-3 0.00000 -0.07303 -0.12649 -0.07696 -0.13329
|
|
248 15G 0 0.00000 -0.00266 -0.00461 -0.00029 -0.00050
|
|
249 15G+1 0.00110 0.00139 0.00427 0.00437 0.00650
|
|
250 15G-1 -0.00190 0.00267 0.00139 0.00145 0.00437
|
|
251 15G+2 0.00223 0.00242 0.00389 0.00103 -0.00084
|
|
252 15G-2 -0.00129 0.00389 0.00690 -0.00084 0.00006
|
|
253 15G+3 -0.00671 0.00498 -0.00288 -0.00312 0.00180
|
|
254 15G-3 0.00000 -0.00049 -0.00085 -0.00645 -0.01117
|
|
255 15G+4 -0.00850 0.00558 0.00088 -0.00207 0.00598
|
|
256 15G-4 -0.00491 -0.00088 -0.00660 -0.00598 -0.00484
|
|
26 27 28 29 30
|
|
(A1)--V (A1)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 0.88637 0.98372 1.02659 1.02659 1.15767
|
|
1 1 N 1S -0.02212 0.00157 0.00000 0.00000 -0.06602
|
|
2 2S -0.02265 -0.00582 0.00000 0.00000 0.07563
|
|
3 3S -0.33938 -0.02613 0.00000 0.00000 -0.16522
|
|
4 4S 0.02821 -1.16757 0.00000 0.00000 -1.39354
|
|
5 5S 15.82937 11.24848 0.00000 0.00000 14.29547
|
|
6 6S 23.10045 11.45195 0.00000 0.00000 11.34939
|
|
7 7PX 0.00000 0.00000 0.00000 -0.01027 0.00000
|
|
8 7PY 0.00000 0.00000 -0.01027 0.00000 0.00000
|
|
9 7PZ -0.04668 0.00850 0.00000 0.00000 -0.06985
|
|
10 8PX 0.00000 0.00000 0.00000 0.09577 0.00000
|
|
11 8PY 0.00000 0.00000 0.09577 0.00000 0.00000
|
|
12 8PZ 0.00852 0.02670 0.00000 0.00000 0.06425
|
|
13 9PX 0.00000 0.00000 0.00000 -1.58826 0.00000
|
|
14 9PY 0.00000 0.00000 -1.58826 0.00000 0.00000
|
|
15 9PZ -1.92086 -0.60522 0.00000 0.00000 -1.59252
|
|
16 10PX 0.00000 0.00000 0.00000 -1.50543 0.00000
|
|
17 10PY 0.00000 0.00000 -1.50543 0.00000 0.00000
|
|
18 10PZ -5.86911 -0.10831 0.00000 0.00000 -2.63733
|
|
19 11PX 0.00000 0.00000 0.00000 0.83569 0.00000
|
|
20 11PY 0.00000 0.00000 0.83569 0.00000 0.00000
|
|
21 11PZ -3.42788 -0.39179 0.00000 0.00000 -0.59138
|
|
22 12D 0 0.00704 -0.00415 0.00000 0.00000 -0.00163
|
|
23 12D+1 0.00000 0.00000 0.00000 -0.00923 0.00000
|
|
24 12D-1 0.00000 0.00000 -0.00923 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00713 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00713 0.00000
|
|
27 13D 0 -0.03206 0.00921 0.00000 0.00000 0.05099
|
|
28 13D+1 0.00000 0.00000 0.00000 0.02344 0.00000
|
|
29 13D-1 0.00000 0.00000 0.02344 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 -0.05637 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 -0.05637 0.00000
|
|
32 14D 0 -0.29446 -0.87667 0.00000 0.00000 -0.94612
|
|
33 14D+1 0.00000 0.00000 0.00000 -0.03942 0.00000
|
|
34 14D-1 0.00000 0.00000 -0.03942 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 1.40304 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 1.40304 0.00000
|
|
37 15D 0 0.54534 -3.46521 0.00000 0.00000 -2.17112
|
|
38 15D+1 0.00000 0.00000 0.00000 -3.02070 0.00000
|
|
39 15D-1 0.00000 0.00000 -3.02070 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 3.99235 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 3.99235 0.00000
|
|
42 16F 0 -0.00778 -0.00267 0.00000 0.00000 -0.01219
|
|
43 16F+1 0.00000 0.00000 0.00000 -0.00478 0.00000
|
|
44 16F-1 0.00000 0.00000 -0.00478 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00680 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00680 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00721 0.01130 0.00000 0.00000 0.02370
|
|
49 17F 0 0.14730 0.06605 0.00000 0.00000 0.14727
|
|
50 17F+1 0.00000 0.00000 0.00000 0.05487 0.00000
|
|
51 17F-1 0.00000 0.00000 0.05487 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 -0.09191 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 -0.09191 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 -0.18158 -0.14344 0.00000 0.00000 -0.24389
|
|
56 18F 0 -0.05673 0.20595 0.00000 0.00000 0.43191
|
|
57 18F+1 0.00000 0.00000 0.00000 0.89312 0.00000
|
|
58 18F-1 0.00000 0.00000 0.89312 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 -0.54570 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 -0.54570 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.16049 -0.81573 0.00000 0.00000 -0.99297
|
|
63 19G 0 -0.00136 -0.00879 0.00000 0.00000 -0.00746
|
|
64 19G+1 0.00000 0.00000 0.00000 -0.00131 0.00000
|
|
65 19G-1 0.00000 0.00000 -0.00131 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00005 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00005 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.01880 0.00257 0.00000 0.00000 0.01049
|
|
70 19G+4 0.00000 0.00000 -0.00151 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00151 0.00000
|
|
72 20G 0 -0.02967 0.12512 0.00000 0.00000 0.07257
|
|
73 20G+1 0.00000 0.00000 0.00000 -0.04020 0.00000
|
|
74 20G-1 0.00000 0.00000 -0.04020 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 -0.06472 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 -0.06472 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 -0.00923 0.01780 0.00000 0.00000 0.11146
|
|
79 20G+4 0.00000 0.00000 0.00022 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 -0.00022 0.00000
|
|
81 21H 0 0.00601 -0.00958 0.00000 0.00000 -0.01419
|
|
82 21H+1 0.00000 0.00000 0.00000 -0.01466 0.00000
|
|
83 21H-1 0.00000 0.00000 -0.01466 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.01400 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.01400 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 -0.00188 0.01809 0.00000 0.00000 0.01225
|
|
88 21H+4 0.00000 0.00000 -0.00929 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00929 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.01776 0.00000
|
|
91 21H-5 0.00000 0.00000 -0.01776 0.00000 0.00000
|
|
92 2 H 1S -0.00285 0.02451 0.00062 0.00000 -0.04094
|
|
93 2S 0.40943 0.13938 -0.13129 0.00000 0.25936
|
|
94 3S -1.80191 -2.06737 2.15203 0.00000 -5.23414
|
|
95 4S -11.65456 -6.08582 4.99147 0.00000 -3.70141
|
|
96 5S -0.07685 0.15732 -0.39872 0.00000 -0.64858
|
|
97 6PX 0.00000 0.00000 0.00000 -0.01474 0.00000
|
|
98 6PY 0.00784 0.00736 0.01062 0.00000 -0.02087
|
|
99 6PZ -0.00172 -0.00777 0.01119 0.00000 0.00118
|
|
100 7PX 0.00000 0.00000 0.00000 0.12390 0.00000
|
|
101 7PY -0.11774 -0.05847 -0.04621 0.00000 0.05292
|
|
102 7PZ 0.03806 0.08029 -0.11283 0.00000 0.03029
|
|
103 8PX 0.00000 0.00000 0.00000 -0.83352 0.00000
|
|
104 8PY 1.24154 0.98812 -0.66859 0.00000 1.23299
|
|
105 8PZ -0.38574 -0.92294 1.27988 0.00000 -0.96595
|
|
106 9PX 0.00000 0.00000 0.00000 -3.05088 0.00000
|
|
107 9PY 4.94183 1.43798 -2.65186 0.00000 2.23688
|
|
108 9PZ -1.08318 -2.49552 2.72778 0.00000 -1.64631
|
|
109 10D 0 -0.00528 -0.00394 -0.00404 0.00000 -0.00638
|
|
110 10D+1 0.00000 0.00000 0.00000 -0.00167 0.00000
|
|
111 10D-1 -0.00880 -0.00816 0.01452 0.00000 -0.01720
|
|
112 10D+2 -0.01282 -0.00475 0.00399 0.00000 -0.01020
|
|
113 10D-2 0.00000 0.00000 0.00000 -0.00893 0.00000
|
|
114 11D 0 0.04324 0.00989 0.01173 0.00000 0.04865
|
|
115 11D+1 0.00000 0.00000 0.00000 -0.00977 0.00000
|
|
116 11D-1 0.07812 0.09242 -0.15530 0.00000 0.19144
|
|
117 11D+2 0.09645 0.05986 -0.07205 0.00000 0.15041
|
|
118 11D-2 0.00000 0.00000 0.00000 0.05336 0.00000
|
|
119 12D 0 0.41119 -0.28275 0.30936 0.00000 -0.13720
|
|
120 12D+1 0.00000 0.00000 0.00000 -0.13423 0.00000
|
|
121 12D-1 0.53231 0.81815 -1.10062 0.00000 0.53669
|
|
122 12D+2 0.91959 0.20550 -0.33035 0.00000 0.30181
|
|
123 12D-2 0.00000 0.00000 0.00000 1.06690 0.00000
|
|
124 13F 0 -0.00014 0.00222 -0.00134 0.00000 0.00990
|
|
125 13F+1 0.00000 0.00000 0.00000 -0.00474 0.00000
|
|
126 13F-1 0.00032 0.00161 -0.00337 0.00000 0.00205
|
|
127 13F+2 0.00547 -0.00039 0.00061 0.00000 0.00893
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00969 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 -0.00473 0.00000
|
|
130 13F-3 0.00271 -0.00350 0.00001 0.00000 -0.00979
|
|
131 14F 0 0.08849 0.04690 -0.09479 0.00000 0.03610
|
|
132 14F+1 0.00000 0.00000 0.00000 0.04967 0.00000
|
|
133 14F-1 -0.05509 0.09263 -0.10311 0.00000 0.04661
|
|
134 14F+2 0.09430 0.11394 -0.16877 0.00000 0.10229
|
|
135 14F-2 0.00000 0.00000 0.00000 0.02085 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.18814 0.00000
|
|
137 14F-3 -0.15189 -0.00420 0.04710 0.00000 -0.03167
|
|
138 15G 0 -0.00038 0.00664 -0.00797 0.00000 0.00517
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00225 0.00000
|
|
140 15G-1 -0.00822 -0.00095 0.00276 0.00000 -0.00393
|
|
141 15G+2 -0.00111 0.00777 -0.00883 0.00000 0.00560
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00676 0.00000
|
|
144 15G-3 -0.00905 -0.00449 0.00720 0.00000 -0.00645
|
|
145 15G+4 -0.00865 0.00100 0.00070 0.00000 -0.00242
|
|
146 15G-4 0.00000 0.00000 0.00000 -0.01224 0.00000
|
|
147 3 H 1S -0.00285 0.02451 -0.00031 0.00054 -0.04094
|
|
148 2S 0.40943 0.13938 0.06565 -0.11370 0.25936
|
|
149 3S -1.80191 -2.06737 -1.07601 1.86371 -5.23414
|
|
150 4S -11.65456 -6.08582 -2.49573 4.32274 -3.70141
|
|
151 5S -0.07685 0.15732 0.19936 -0.34530 -0.64858
|
|
152 6PX 0.00679 0.00638 -0.01098 0.00428 -0.01808
|
|
153 6PY -0.00392 -0.00368 -0.00840 -0.01098 0.01044
|
|
154 6PZ -0.00172 -0.00777 -0.00559 0.00969 0.00118
|
|
155 7PX -0.10196 -0.05063 0.07366 -0.00369 0.04583
|
|
156 7PY 0.05887 0.02923 0.08137 0.07366 -0.02646
|
|
157 7PZ 0.03806 0.08029 0.05642 -0.09772 0.03029
|
|
158 8PX 1.07521 0.85574 -0.07142 -0.70982 1.06780
|
|
159 8PY -0.62077 -0.49406 -0.79228 -0.07142 -0.61649
|
|
160 8PZ -0.38574 -0.92294 -0.63994 1.10841 -0.96595
|
|
161 9PX 4.27975 1.24533 -0.17278 -2.75161 1.93720
|
|
162 9PY -2.47092 -0.71899 -2.95113 -0.17278 -1.11844
|
|
163 9PZ -1.08318 -2.49552 -1.36389 2.36232 -1.64631
|
|
164 10D 0 -0.00528 -0.00394 0.00202 -0.00350 -0.00638
|
|
165 10D+1 -0.00762 -0.00707 -0.00701 0.01047 -0.01490
|
|
166 10D-1 0.00440 0.00408 0.00238 -0.00701 0.00860
|
|
167 10D+2 0.00641 0.00238 -0.00570 -0.00560 0.00510
|
|
168 10D-2 -0.01110 -0.00411 -0.00560 0.00076 -0.00883
|
|
169 11D 0 0.04324 0.00989 -0.00587 0.01016 0.04865
|
|
170 11D+1 0.06765 0.08003 0.06302 -0.11892 0.16579
|
|
171 11D-1 -0.03906 -0.04621 -0.04615 0.06302 -0.09572
|
|
172 11D+2 -0.04822 -0.02993 0.02201 0.05430 -0.07521
|
|
173 11D-2 0.08353 0.05184 0.05430 -0.04070 0.13026
|
|
174 12D 0 0.41119 -0.28275 -0.15468 0.26792 -0.13720
|
|
175 12D+1 0.46099 0.70854 0.41846 -0.85902 0.46479
|
|
176 12D-1 -0.26615 -0.40907 -0.37582 0.41846 -0.26835
|
|
177 12D+2 -0.45980 -0.10275 0.71759 0.60503 -0.15090
|
|
178 12D-2 0.79639 0.17796 0.60503 0.01896 0.26137
|
|
179 13F 0 -0.00014 0.00222 0.00067 -0.00116 0.00990
|
|
180 13F+1 0.00027 0.00139 -0.00059 -0.00371 0.00178
|
|
181 13F-1 -0.00016 -0.00080 -0.00440 -0.00059 -0.00102
|
|
182 13F+2 -0.00273 0.00019 0.00742 0.00393 -0.00446
|
|
183 13F-2 0.00474 -0.00034 0.00393 0.00288 0.00773
|
|
184 13F+3 0.00000 0.00000 0.00410 0.00236 0.00000
|
|
185 13F-3 0.00271 -0.00350 -0.00001 0.00001 -0.00979
|
|
186 14F 0 0.08849 0.04690 0.04740 -0.08209 0.03610
|
|
187 14F+1 -0.04771 0.08022 0.06616 -0.06492 0.04036
|
|
188 14F-1 0.02754 -0.04631 0.01147 0.06616 -0.02330
|
|
189 14F+2 -0.04715 -0.05697 -0.02655 0.08211 -0.05115
|
|
190 14F-2 0.08167 0.09867 0.08211 -0.12137 0.08859
|
|
191 14F+3 0.00000 0.00000 -0.16293 -0.09407 0.00000
|
|
192 14F-3 -0.15189 -0.00420 -0.02355 0.04079 -0.03167
|
|
193 15G 0 -0.00038 0.00664 0.00399 -0.00690 0.00517
|
|
194 15G+1 -0.00712 -0.00083 -0.00022 0.00264 -0.00341
|
|
195 15G-1 0.00411 0.00048 0.00238 -0.00022 0.00197
|
|
196 15G+2 0.00055 -0.00388 -0.00220 0.00383 -0.00280
|
|
197 15G-2 -0.00096 0.00673 0.00383 -0.00662 0.00485
|
|
198 15G+3 0.00000 0.00000 -0.00585 -0.00338 0.00000
|
|
199 15G-3 -0.00905 -0.00449 -0.00360 0.00623 -0.00645
|
|
200 15G+4 0.00432 -0.00050 0.00936 0.00500 0.00121
|
|
201 15G-4 0.00749 -0.00087 -0.00500 -0.00359 0.00210
|
|
202 4 H 1S -0.00285 0.02451 -0.00031 -0.00054 -0.04094
|
|
203 2S 0.40943 0.13938 0.06565 0.11370 0.25936
|
|
204 3S -1.80191 -2.06737 -1.07601 -1.86371 -5.23414
|
|
205 4S -11.65456 -6.08582 -2.49573 -4.32274 -3.70141
|
|
206 5S -0.07685 0.15732 0.19936 0.34530 -0.64858
|
|
207 6PX -0.00679 -0.00638 0.01098 0.00428 0.01808
|
|
208 6PY -0.00392 -0.00368 -0.00840 0.01098 0.01044
|
|
209 6PZ -0.00172 -0.00777 -0.00559 -0.00969 0.00118
|
|
210 7PX 0.10196 0.05063 -0.07366 -0.00369 -0.04583
|
|
211 7PY 0.05887 0.02923 0.08137 -0.07366 -0.02646
|
|
212 7PZ 0.03806 0.08029 0.05642 0.09772 0.03029
|
|
213 8PX -1.07521 -0.85574 0.07142 -0.70982 -1.06780
|
|
214 8PY -0.62077 -0.49406 -0.79228 0.07142 -0.61649
|
|
215 8PZ -0.38574 -0.92294 -0.63994 -1.10841 -0.96595
|
|
216 9PX -4.27975 -1.24533 0.17278 -2.75161 -1.93720
|
|
217 9PY -2.47092 -0.71899 -2.95113 0.17278 -1.11844
|
|
218 9PZ -1.08318 -2.49552 -1.36389 -2.36232 -1.64631
|
|
219 10D 0 -0.00528 -0.00394 0.00202 0.00350 -0.00638
|
|
220 10D+1 0.00762 0.00707 0.00701 0.01047 0.01490
|
|
221 10D-1 0.00440 0.00408 0.00238 0.00701 0.00860
|
|
222 10D+2 0.00641 0.00238 -0.00570 0.00560 0.00510
|
|
223 10D-2 0.01110 0.00411 0.00560 0.00076 0.00883
|
|
224 11D 0 0.04324 0.00989 -0.00587 -0.01016 0.04865
|
|
225 11D+1 -0.06765 -0.08003 -0.06302 -0.11892 -0.16579
|
|
226 11D-1 -0.03906 -0.04621 -0.04615 -0.06302 -0.09572
|
|
227 11D+2 -0.04822 -0.02993 0.02201 -0.05430 -0.07521
|
|
228 11D-2 -0.08353 -0.05184 -0.05430 -0.04070 -0.13026
|
|
229 12D 0 0.41119 -0.28275 -0.15468 -0.26792 -0.13720
|
|
230 12D+1 -0.46099 -0.70854 -0.41846 -0.85902 -0.46479
|
|
231 12D-1 -0.26615 -0.40907 -0.37582 -0.41846 -0.26835
|
|
232 12D+2 -0.45980 -0.10275 0.71759 -0.60503 -0.15090
|
|
233 12D-2 -0.79639 -0.17796 -0.60503 0.01896 -0.26137
|
|
234 13F 0 -0.00014 0.00222 0.00067 0.00116 0.00990
|
|
235 13F+1 -0.00027 -0.00139 0.00059 -0.00371 -0.00178
|
|
236 13F-1 -0.00016 -0.00080 -0.00440 0.00059 -0.00102
|
|
237 13F+2 -0.00273 0.00019 0.00742 -0.00393 -0.00446
|
|
238 13F-2 -0.00474 0.00034 -0.00393 0.00288 -0.00773
|
|
239 13F+3 0.00000 0.00000 -0.00410 0.00236 0.00000
|
|
240 13F-3 0.00271 -0.00350 -0.00001 -0.00001 -0.00979
|
|
241 14F 0 0.08849 0.04690 0.04740 0.08209 0.03610
|
|
242 14F+1 0.04771 -0.08022 -0.06616 -0.06492 -0.04036
|
|
243 14F-1 0.02754 -0.04631 0.01147 -0.06616 -0.02330
|
|
244 14F+2 -0.04715 -0.05697 -0.02655 -0.08211 -0.05115
|
|
245 14F-2 -0.08167 -0.09867 -0.08211 -0.12137 -0.08859
|
|
246 14F+3 0.00000 0.00000 0.16293 -0.09407 0.00000
|
|
247 14F-3 -0.15189 -0.00420 -0.02355 -0.04079 -0.03167
|
|
248 15G 0 -0.00038 0.00664 0.00399 0.00690 0.00517
|
|
249 15G+1 0.00712 0.00083 0.00022 0.00264 0.00341
|
|
250 15G-1 0.00411 0.00048 0.00238 0.00022 0.00197
|
|
251 15G+2 0.00055 -0.00388 -0.00220 -0.00383 -0.00280
|
|
252 15G-2 0.00096 -0.00673 -0.00383 -0.00662 -0.00485
|
|
253 15G+3 0.00000 0.00000 0.00585 -0.00338 0.00000
|
|
254 15G-3 -0.00905 -0.00449 -0.00360 -0.00623 -0.00645
|
|
255 15G+4 0.00432 -0.00050 0.00936 -0.00500 0.00121
|
|
256 15G-4 -0.00749 0.00087 0.00500 -0.00359 -0.00210
|
|
31 32 33 34 35
|
|
(E)--V (E)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 1.24257 1.24257 1.32326 1.51949 1.51949
|
|
1 1 N 1S 0.00000 0.00000 -0.04199 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.07160 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 0.05506 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 -3.71249 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 22.01001 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 22.02633 0.00000 0.00000
|
|
7 7PX 0.00000 -0.12199 0.00000 0.00000 -0.03647
|
|
8 7PY -0.12199 0.00000 0.00000 -0.03647 0.00000
|
|
9 7PZ 0.00000 0.00000 0.06344 0.00000 0.00000
|
|
10 8PX 0.00000 -0.11284 0.00000 0.00000 -0.56925
|
|
11 8PY -0.11284 0.00000 0.00000 -0.56925 0.00000
|
|
12 8PZ 0.00000 0.00000 0.50582 0.00000 0.00000
|
|
13 9PX 0.00000 -1.06694 0.00000 0.00000 2.21566
|
|
14 9PY -1.06694 0.00000 0.00000 2.21566 0.00000
|
|
15 9PZ 0.00000 0.00000 -1.87464 0.00000 0.00000
|
|
16 10PX 0.00000 -3.58399 0.00000 0.00000 19.09610
|
|
17 10PY -3.58399 0.00000 0.00000 19.09610 0.00000
|
|
18 10PZ 0.00000 0.00000 -11.24545 0.00000 0.00000
|
|
19 11PX 0.00000 -2.51170 0.00000 0.00000 1.96089
|
|
20 11PY -2.51170 0.00000 0.00000 1.96089 0.00000
|
|
21 11PZ 0.00000 0.00000 -1.63511 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 -0.00180 0.00000 0.00000
|
|
23 12D+1 0.00000 -0.00516 0.00000 0.00000 -0.01248
|
|
24 12D-1 -0.00516 0.00000 0.00000 -0.01248 0.00000
|
|
25 12D+2 -0.00136 0.00000 0.00000 -0.00106 0.00000
|
|
26 12D-2 0.00000 -0.00136 0.00000 0.00000 -0.00106
|
|
27 13D 0 0.00000 0.00000 0.01492 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00265 0.00000 0.00000 0.12611
|
|
29 13D-1 0.00265 0.00000 0.00000 0.12611 0.00000
|
|
30 13D+2 -0.04552 0.00000 0.00000 0.10064 0.00000
|
|
31 13D-2 0.00000 -0.04552 0.00000 0.00000 0.10064
|
|
32 14D 0 0.00000 0.00000 -0.59336 0.00000 0.00000
|
|
33 14D+1 0.00000 0.44933 0.00000 0.00000 -1.52986
|
|
34 14D-1 0.44933 0.00000 0.00000 -1.52986 0.00000
|
|
35 14D+2 0.78404 0.00000 0.00000 -1.20231 0.00000
|
|
36 14D-2 0.00000 0.78404 0.00000 0.00000 -1.20231
|
|
37 15D 0 0.00000 0.00000 -1.53595 0.00000 0.00000
|
|
38 15D+1 0.00000 2.28120 0.00000 0.00000 -3.93765
|
|
39 15D-1 2.28120 0.00000 0.00000 -3.93765 0.00000
|
|
40 15D+2 2.81100 0.00000 0.00000 -4.10552 0.00000
|
|
41 15D-2 0.00000 2.81100 0.00000 0.00000 -4.10552
|
|
42 16F 0 0.00000 0.00000 -0.02887 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00732 0.00000 0.00000 0.01502
|
|
44 16F-1 0.00732 0.00000 0.00000 0.01502 0.00000
|
|
45 16F+2 0.01442 0.00000 0.00000 -0.01462 0.00000
|
|
46 16F-2 0.00000 0.01442 0.00000 0.00000 -0.01462
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.02685 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.24500 0.00000 0.00000
|
|
50 17F+1 0.00000 -0.03831 0.00000 0.00000 -0.09408
|
|
51 17F-1 -0.03831 0.00000 0.00000 -0.09408 0.00000
|
|
52 17F+2 -0.12338 0.00000 0.00000 0.11785 0.00000
|
|
53 17F-2 0.00000 -0.12338 0.00000 0.00000 0.11785
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 -0.28776 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 1.35441 0.00000 0.00000
|
|
57 18F+1 0.00000 -0.39496 0.00000 0.00000 -0.56227
|
|
58 18F-1 -0.39496 0.00000 0.00000 -0.56227 0.00000
|
|
59 18F+2 -0.93398 0.00000 0.00000 0.73423 0.00000
|
|
60 18F-2 0.00000 -0.93398 0.00000 0.00000 0.73423
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 -0.77114 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.01147 0.00000 0.00000
|
|
64 19G+1 0.00000 -0.00580 0.00000 0.00000 -0.00300
|
|
65 19G-1 -0.00580 0.00000 0.00000 -0.00300 0.00000
|
|
66 19G+2 -0.00814 0.00000 0.00000 -0.00042 0.00000
|
|
67 19G-2 0.00000 -0.00814 0.00000 0.00000 -0.00042
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.01162 0.00000 0.00000
|
|
70 19G+4 -0.01000 0.00000 0.00000 -0.00268 0.00000
|
|
71 19G-4 0.00000 0.01000 0.00000 0.00000 0.00268
|
|
72 20G 0 0.00000 0.00000 -0.20787 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00006 0.00000 0.00000 0.20890
|
|
74 20G-1 0.00006 0.00000 0.00000 0.20890 0.00000
|
|
75 20G+2 0.10921 0.00000 0.00000 0.03235 0.00000
|
|
76 20G-2 0.00000 0.10921 0.00000 0.00000 0.03235
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.24438 0.00000 0.00000
|
|
79 20G+4 0.09244 0.00000 0.00000 0.27544 0.00000
|
|
80 20G-4 0.00000 -0.09244 0.00000 0.00000 -0.27544
|
|
81 21H 0 0.00000 0.00000 -0.00137 0.00000 0.00000
|
|
82 21H+1 0.00000 0.01200 0.00000 0.00000 -0.00763
|
|
83 21H-1 0.01200 0.00000 0.00000 -0.00763 0.00000
|
|
84 21H+2 0.00648 0.00000 0.00000 -0.01420 0.00000
|
|
85 21H-2 0.00000 0.00648 0.00000 0.00000 -0.01420
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 -0.02705 0.00000 0.00000
|
|
88 21H+4 -0.00685 0.00000 0.00000 -0.03634 0.00000
|
|
89 21H-4 0.00000 0.00685 0.00000 0.00000 0.03634
|
|
90 21H+5 0.00000 0.01601 0.00000 0.00000 -0.01007
|
|
91 21H-5 -0.01601 0.00000 0.00000 0.01007 0.00000
|
|
92 2 H 1S 0.04826 0.00000 0.00452 -0.00279 0.00000
|
|
93 2S -0.23767 0.00000 0.33303 0.30402 0.00000
|
|
94 3S 5.42120 0.00000 -7.03145 -10.99649 0.00000
|
|
95 4S 3.95643 0.00000 -9.19331 -13.77625 0.00000
|
|
96 5S 1.80719 0.00000 -0.24534 0.80111 0.00000
|
|
97 6PX 0.00000 -0.01270 0.00000 0.00000 0.01483
|
|
98 6PY 0.02499 0.00000 -0.00012 -0.02459 0.00000
|
|
99 6PZ -0.01486 0.00000 0.00811 -0.00504 0.00000
|
|
100 7PX 0.00000 0.08698 0.00000 0.00000 -0.02693
|
|
101 7PY -0.07307 0.00000 -0.05375 0.13158 0.00000
|
|
102 7PZ 0.07221 0.00000 -0.03798 0.03087 0.00000
|
|
103 8PX 0.00000 -0.77357 0.00000 0.00000 -0.04885
|
|
104 8PY -0.95694 0.00000 2.83126 2.81284 0.00000
|
|
105 8PZ -0.17257 0.00000 -0.64174 -1.72592 0.00000
|
|
106 9PX 0.00000 -0.30814 0.00000 0.00000 -1.44325
|
|
107 9PY -2.52973 0.00000 3.57081 5.11121 0.00000
|
|
108 9PZ 0.66884 0.00000 -0.76677 -2.87124 0.00000
|
|
109 10D 0 0.01018 0.00000 -0.00012 -0.00410 0.00000
|
|
110 10D+1 0.00000 0.00582 0.00000 0.00000 -0.01862
|
|
111 10D-1 0.00722 0.00000 -0.00106 -0.00508 0.00000
|
|
112 10D+2 0.01694 0.00000 -0.03088 -0.01722 0.00000
|
|
113 10D-2 0.00000 -0.00993 0.00000 0.00000 -0.00705
|
|
114 11D 0 -0.11068 0.00000 0.09832 0.11019 0.00000
|
|
115 11D+1 0.00000 -0.03960 0.00000 0.00000 0.05467
|
|
116 11D-1 -0.06847 0.00000 0.12405 0.27729 0.00000
|
|
117 11D+2 -0.17134 0.00000 0.34181 0.34588 0.00000
|
|
118 11D-2 0.00000 0.10308 0.00000 0.00000 0.06685
|
|
119 12D 0 -0.24521 0.00000 0.78015 -0.23162 0.00000
|
|
120 12D+1 0.00000 -0.22168 0.00000 0.00000 -0.60973
|
|
121 12D-1 0.25674 0.00000 0.22220 0.69141 0.00000
|
|
122 12D+2 -0.26356 0.00000 0.27453 0.02505 0.00000
|
|
123 12D-2 0.00000 0.46973 0.00000 0.00000 0.64932
|
|
124 13F 0 -0.00424 0.00000 0.00915 0.01323 0.00000
|
|
125 13F+1 0.00000 -0.00031 0.00000 0.00000 -0.00165
|
|
126 13F-1 0.00640 0.00000 -0.00596 -0.00881 0.00000
|
|
127 13F+2 -0.00600 0.00000 0.01536 0.03156 0.00000
|
|
128 13F-2 0.00000 -0.00112 0.00000 0.00000 -0.00204
|
|
129 13F+3 0.00000 0.01027 0.00000 0.00000 -0.00455
|
|
130 13F-3 0.00330 0.00000 -0.02679 -0.01900 0.00000
|
|
131 14F 0 -0.01877 0.00000 0.03272 0.04957 0.00000
|
|
132 14F+1 0.00000 0.01826 0.00000 0.00000 0.01140
|
|
133 14F-1 0.07220 0.00000 -0.13348 0.09346 0.00000
|
|
134 14F+2 0.01210 0.00000 0.00952 0.02856 0.00000
|
|
135 14F-2 0.00000 0.08993 0.00000 0.00000 0.12387
|
|
136 14F+3 0.00000 0.07835 0.00000 0.00000 0.16292
|
|
137 14F-3 0.08761 0.00000 0.00775 -0.02276 0.00000
|
|
138 15G 0 0.00134 0.00000 -0.00639 0.00376 0.00000
|
|
139 15G+1 0.00000 0.00194 0.00000 0.00000 0.00265
|
|
140 15G-1 0.00369 0.00000 -0.00529 -0.00102 0.00000
|
|
141 15G+2 0.00537 0.00000 -0.00635 0.00590 0.00000
|
|
142 15G-2 0.00000 -0.00050 0.00000 0.00000 0.00076
|
|
143 15G+3 0.00000 0.00743 0.00000 0.00000 0.00946
|
|
144 15G-3 -0.00091 0.00000 -0.00277 -0.00429 0.00000
|
|
145 15G+4 0.00506 0.00000 -0.00002 -0.00087 0.00000
|
|
146 15G-4 0.00000 -0.00815 0.00000 0.00000 -0.00953
|
|
147 3 H 1S -0.02413 0.04180 0.00452 0.00139 -0.00241
|
|
148 2S 0.11883 -0.20582 0.33303 -0.15201 0.26329
|
|
149 3S -2.71060 4.69490 -7.03145 5.49825 -9.52324
|
|
150 4S -1.97821 3.42637 -9.19331 6.88813 -11.93058
|
|
151 5S -0.90360 1.56507 -0.24534 -0.40055 0.69378
|
|
152 6PX -0.01632 0.01557 -0.00010 0.01707 -0.01473
|
|
153 6PY -0.00328 -0.01632 0.00006 0.00498 0.01707
|
|
154 6PZ 0.00743 -0.01287 0.00811 0.00252 -0.00437
|
|
155 7PX 0.06930 -0.03306 -0.04655 -0.06863 0.09195
|
|
156 7PY 0.04697 0.06930 0.02687 0.01270 -0.06863
|
|
157 7PZ -0.03610 0.06253 -0.03798 -0.01543 0.02673
|
|
158 8PX 0.07940 -0.91110 2.45195 -1.23915 2.09742
|
|
159 8PY -0.81941 0.07940 -1.41563 0.66657 -1.23915
|
|
160 8PZ 0.08629 -0.14945 -0.64174 0.86296 -1.49469
|
|
161 9PX 0.96197 -1.97433 3.09242 -2.83817 3.47260
|
|
162 9PY -0.86354 0.96197 -1.78541 0.19536 -2.83817
|
|
163 9PZ -0.33442 0.57924 -0.76677 1.43562 -2.48657
|
|
164 10D 0 -0.00509 0.00882 -0.00012 0.00205 -0.00355
|
|
165 10D+1 -0.00061 0.00687 -0.00092 -0.00587 -0.00846
|
|
166 10D-1 0.00617 -0.00061 0.00053 -0.01524 -0.00587
|
|
167 10D+2 -0.00321 -0.01163 0.01544 -0.00959 0.00441
|
|
168 10D-2 -0.01163 0.01022 -0.02674 0.00441 -0.01468
|
|
169 11D 0 0.05534 -0.09585 0.09832 -0.05509 0.09543
|
|
170 11D+1 0.01250 -0.06125 0.10743 -0.09640 0.22164
|
|
171 11D-1 -0.04682 0.01250 -0.06203 0.11032 -0.09640
|
|
172 11D+2 0.03448 0.11883 -0.17090 0.13661 -0.12082
|
|
173 11D-2 0.11883 -0.10274 0.29601 -0.12082 0.27612
|
|
174 12D 0 0.12260 -0.21236 0.78015 0.11581 -0.20059
|
|
175 12D+1 -0.20716 0.13713 0.19243 -0.56341 0.36613
|
|
176 12D-1 -0.10207 -0.20716 -0.11110 -0.28445 -0.56341
|
|
177 12D+2 0.28641 0.31752 -0.13726 0.49326 0.27032
|
|
178 12D-2 0.31752 -0.08024 0.23775 0.27032 0.18112
|
|
179 13F 0 0.00212 -0.00367 0.00915 -0.00662 0.01146
|
|
180 13F+1 -0.00290 0.00472 -0.00517 0.00310 -0.00702
|
|
181 13F-1 0.00137 -0.00290 0.00298 -0.00344 0.00310
|
|
182 13F+2 -0.00234 0.00211 -0.00768 0.00636 -0.01455
|
|
183 13F-2 0.00211 -0.00478 0.01330 -0.01455 0.02316
|
|
184 13F+3 -0.00890 -0.00514 0.00000 0.00394 0.00228
|
|
185 13F-3 -0.00165 0.00286 -0.02679 0.00950 -0.01646
|
|
186 14F 0 0.00938 -0.01625 0.03272 -0.02478 0.04293
|
|
187 14F+1 -0.02336 0.05872 -0.11560 -0.03553 0.07294
|
|
188 14F-1 0.03175 -0.02336 0.06674 0.03192 -0.03553
|
|
189 14F+2 0.07047 0.03370 -0.00476 0.10004 0.04127
|
|
190 14F-2 0.03370 0.03156 0.00824 0.04127 0.05239
|
|
191 14F+3 -0.06786 -0.03918 0.00000 -0.14109 -0.08146
|
|
192 14F-3 -0.04381 0.07587 0.00775 0.01138 -0.01971
|
|
193 15G 0 -0.00067 0.00116 -0.00639 -0.00188 0.00326
|
|
194 15G+1 -0.00076 0.00325 -0.00458 0.00159 -0.00010
|
|
195 15G-1 0.00238 -0.00076 0.00264 0.00173 0.00159
|
|
196 15G+2 0.00096 -0.00254 0.00317 0.00204 -0.00222
|
|
197 15G-2 -0.00254 0.00390 -0.00550 -0.00222 0.00461
|
|
198 15G+3 -0.00643 -0.00372 0.00000 -0.00819 -0.00473
|
|
199 15G-3 0.00046 -0.00079 -0.00277 0.00214 -0.00371
|
|
200 15G+4 0.00738 0.00134 0.00001 0.00693 0.00451
|
|
201 15G-4 -0.00134 -0.00583 0.00002 -0.00451 -0.00173
|
|
202 4 H 1S -0.02413 -0.04180 0.00452 0.00139 0.00241
|
|
203 2S 0.11883 0.20582 0.33303 -0.15201 -0.26329
|
|
204 3S -2.71060 -4.69490 -7.03145 5.49825 9.52324
|
|
205 4S -1.97821 -3.42637 -9.19331 6.88813 11.93058
|
|
206 5S -0.90360 -1.56507 -0.24534 -0.40055 -0.69378
|
|
207 6PX 0.01632 0.01557 0.00010 -0.01707 -0.01473
|
|
208 6PY -0.00328 0.01632 0.00006 0.00498 -0.01707
|
|
209 6PZ 0.00743 0.01287 0.00811 0.00252 0.00437
|
|
210 7PX -0.06930 -0.03306 0.04655 0.06863 0.09195
|
|
211 7PY 0.04697 -0.06930 0.02687 0.01270 0.06863
|
|
212 7PZ -0.03610 -0.06253 -0.03798 -0.01543 -0.02673
|
|
213 8PX -0.07940 -0.91110 -2.45195 1.23915 2.09742
|
|
214 8PY -0.81941 -0.07940 -1.41563 0.66657 1.23915
|
|
215 8PZ 0.08629 0.14945 -0.64174 0.86296 1.49469
|
|
216 9PX -0.96197 -1.97433 -3.09242 2.83817 3.47260
|
|
217 9PY -0.86354 -0.96197 -1.78541 0.19536 2.83817
|
|
218 9PZ -0.33442 -0.57924 -0.76677 1.43562 2.48657
|
|
219 10D 0 -0.00509 -0.00882 -0.00012 0.00205 0.00355
|
|
220 10D+1 0.00061 0.00687 0.00092 0.00587 -0.00846
|
|
221 10D-1 0.00617 0.00061 0.00053 -0.01524 0.00587
|
|
222 10D+2 -0.00321 0.01163 0.01544 -0.00959 -0.00441
|
|
223 10D-2 0.01163 0.01022 0.02674 -0.00441 -0.01468
|
|
224 11D 0 0.05534 0.09585 0.09832 -0.05509 -0.09543
|
|
225 11D+1 -0.01250 -0.06125 -0.10743 0.09640 0.22164
|
|
226 11D-1 -0.04682 -0.01250 -0.06203 0.11032 0.09640
|
|
227 11D+2 0.03448 -0.11883 -0.17090 0.13661 0.12082
|
|
228 11D-2 -0.11883 -0.10274 -0.29601 0.12082 0.27612
|
|
229 12D 0 0.12260 0.21236 0.78015 0.11581 0.20059
|
|
230 12D+1 0.20716 0.13713 -0.19243 0.56341 0.36613
|
|
231 12D-1 -0.10207 0.20716 -0.11110 -0.28445 0.56341
|
|
232 12D+2 0.28641 -0.31752 -0.13726 0.49326 -0.27032
|
|
233 12D-2 -0.31752 -0.08024 -0.23775 -0.27032 0.18112
|
|
234 13F 0 0.00212 0.00367 0.00915 -0.00662 -0.01146
|
|
235 13F+1 0.00290 0.00472 0.00517 -0.00310 -0.00702
|
|
236 13F-1 0.00137 0.00290 0.00298 -0.00344 -0.00310
|
|
237 13F+2 -0.00234 -0.00211 -0.00768 0.00636 0.01455
|
|
238 13F-2 -0.00211 -0.00478 -0.01330 0.01455 0.02316
|
|
239 13F+3 0.00890 -0.00514 0.00000 -0.00394 0.00228
|
|
240 13F-3 -0.00165 -0.00286 -0.02679 0.00950 0.01646
|
|
241 14F 0 0.00938 0.01625 0.03272 -0.02478 -0.04293
|
|
242 14F+1 0.02336 0.05872 0.11560 0.03553 0.07294
|
|
243 14F-1 0.03175 0.02336 0.06674 0.03192 0.03553
|
|
244 14F+2 0.07047 -0.03370 -0.00476 0.10004 -0.04127
|
|
245 14F-2 -0.03370 0.03156 -0.00824 -0.04127 0.05239
|
|
246 14F+3 0.06786 -0.03918 0.00000 0.14109 -0.08146
|
|
247 14F-3 -0.04381 -0.07587 0.00775 0.01138 0.01971
|
|
248 15G 0 -0.00067 -0.00116 -0.00639 -0.00188 -0.00326
|
|
249 15G+1 0.00076 0.00325 0.00458 -0.00159 -0.00010
|
|
250 15G-1 0.00238 0.00076 0.00264 0.00173 -0.00159
|
|
251 15G+2 0.00096 0.00254 0.00317 0.00204 0.00222
|
|
252 15G-2 0.00254 0.00390 0.00550 0.00222 0.00461
|
|
253 15G+3 0.00643 -0.00372 0.00000 0.00819 -0.00473
|
|
254 15G-3 0.00046 0.00079 -0.00277 0.00214 0.00371
|
|
255 15G+4 0.00738 -0.00134 0.00001 0.00693 -0.00451
|
|
256 15G-4 0.00134 -0.00583 -0.00002 0.00451 -0.00173
|
|
36 37 38 39 40
|
|
(A1)--V (A2)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 1.64032 1.70717 1.77735 1.77735 1.78785
|
|
1 1 N 1S -0.01672 0.00000 0.00000 0.00000 0.00000
|
|
2 2S 0.04548 0.00000 0.00000 0.00000 0.00000
|
|
3 3S 0.11099 0.00000 0.00000 0.00000 0.00000
|
|
4 4S -1.93198 0.00000 0.00000 0.00000 0.00000
|
|
5 5S 10.64757 0.00000 0.00000 0.00000 0.00000
|
|
6 6S 18.32167 0.00000 0.00000 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 0.00000 -0.00912 0.00055
|
|
8 7PY 0.00000 0.00000 -0.00912 0.00000 0.00000
|
|
9 7PZ 0.06189 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 0.00000 -0.31947 -0.06988
|
|
11 8PY 0.00000 0.00000 -0.31947 0.00000 0.00000
|
|
12 8PZ 0.27987 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 0.00000 1.09033 1.07865
|
|
14 9PY 0.00000 0.00000 1.09033 0.00000 0.00000
|
|
15 9PZ -0.54516 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 0.00000 13.07613 -1.27161
|
|
17 10PY 0.00000 0.00000 13.07613 0.00000 0.00000
|
|
18 10PZ -8.79531 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 0.00000 1.71280 0.11376
|
|
20 11PY 0.00000 0.00000 1.71280 0.00000 0.00000
|
|
21 11PZ -2.80506 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00216 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 -0.00488 0.02031
|
|
24 12D-1 0.00000 0.00000 -0.00488 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 -0.00617 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 -0.00617 -0.00950
|
|
27 13D 0 0.00589 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 0.12104 -0.13142
|
|
29 13D-1 0.00000 0.00000 0.12104 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.09745 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 0.09745 0.05048
|
|
32 14D 0 0.05617 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 -1.10901 0.66818
|
|
34 14D-1 0.00000 0.00000 -1.10901 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 -1.19371 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 -1.19371 -0.74626
|
|
37 15D 0 1.55990 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 -4.89808 2.38868
|
|
39 15D-1 0.00000 0.00000 -4.89808 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 -4.42513 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 -4.42513 0.14371
|
|
42 16F 0 -0.00761 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 -0.00239 0.00708
|
|
44 16F-1 0.00000 0.00000 -0.00239 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 -0.01327 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 -0.01327 0.00397
|
|
47 16F+3 0.00000 -0.03620 0.00000 0.00000 0.00000
|
|
48 16F-3 0.01319 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.08941 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 -0.02918 -0.08242
|
|
51 17F-1 0.00000 0.00000 -0.02918 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.12482 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.12482 -0.01091
|
|
54 17F+3 0.00000 0.29543 0.00000 0.00000 0.00000
|
|
55 17F-3 -0.07946 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.44229 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.23323 -0.90833
|
|
58 18F-1 0.00000 0.00000 0.23323 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.77998 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.77998 -0.28677
|
|
61 18F+3 0.00000 2.65724 0.00000 0.00000 0.00000
|
|
62 18F-3 -0.69402 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00229 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00766 0.00566
|
|
65 19G-1 0.00000 0.00000 0.00766 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 -0.00712 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 -0.00712 0.00405
|
|
68 19G+3 0.00000 0.01659 0.00000 0.00000 0.00000
|
|
69 19G-3 -0.00876 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00279 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 -0.00279 0.00661
|
|
72 20G 0 -0.11512 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.07600 -0.00294
|
|
74 20G-1 0.00000 0.00000 0.07600 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.04888 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.04888 0.08885
|
|
77 20G+3 0.00000 -0.41325 0.00000 0.00000 0.00000
|
|
78 20G-3 0.19242 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.10490 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 -0.10490 -0.05597
|
|
81 21H 0 0.00469 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 -0.00704 0.01229
|
|
83 21H-1 0.00000 0.00000 -0.00704 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 -0.01336 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 -0.01336 -0.00977
|
|
86 21H+3 0.00000 0.01486 0.00000 0.00000 0.00000
|
|
87 21H-3 -0.02013 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 -0.01762 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.01762 -0.00679
|
|
90 21H+5 0.00000 0.00000 0.00000 -0.00994 -0.00543
|
|
91 21H-5 0.00000 0.00000 0.00994 0.00000 0.00000
|
|
92 2 H 1S 0.01199 0.00000 -0.01119 0.00000 0.00000
|
|
93 2S 0.02002 0.00000 0.31392 0.00000 0.00000
|
|
94 3S -2.74955 0.00000 -9.98420 0.00000 0.00000
|
|
95 4S -7.87238 0.00000 -7.95016 0.00000 0.00000
|
|
96 5S -0.11087 0.00000 0.32804 0.00000 0.00000
|
|
97 6PX 0.00000 -0.00396 0.00000 -0.00893 -0.00564
|
|
98 6PY -0.00131 0.00000 0.00308 0.00000 0.00000
|
|
99 6PZ -0.00332 0.00000 0.02714 0.00000 0.00000
|
|
100 7PX 0.00000 -0.05871 0.00000 0.04834 0.00512
|
|
101 7PY 0.00112 0.00000 -0.03023 0.00000 0.00000
|
|
102 7PZ -0.01347 0.00000 -0.12512 0.00000 0.00000
|
|
103 8PX 0.00000 1.08280 0.00000 -0.18038 0.04180
|
|
104 8PY 1.19728 0.00000 2.82749 0.00000 0.00000
|
|
105 8PZ -0.31031 0.00000 -0.39523 0.00000 0.00000
|
|
106 9PX 0.00000 2.26504 0.00000 -0.50688 0.32465
|
|
107 9PY 3.01900 0.00000 2.34268 0.00000 0.00000
|
|
108 9PZ 0.73706 0.00000 -1.27846 0.00000 0.00000
|
|
109 10D 0 -0.03238 0.00000 -0.02092 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00984 0.00000 0.03756 -0.02575
|
|
111 10D-1 -0.01078 0.00000 -0.02826 0.00000 0.00000
|
|
112 10D+2 0.01697 0.00000 0.00929 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00486 0.00000 0.00440 -0.01592
|
|
114 11D 0 0.19220 0.00000 0.17228 0.00000 0.00000
|
|
115 11D+1 0.00000 -0.01086 0.00000 -0.18721 0.12336
|
|
116 11D-1 0.09900 0.00000 0.30496 0.00000 0.00000
|
|
117 11D+2 0.00641 0.00000 0.15778 0.00000 0.00000
|
|
118 11D-2 0.00000 -0.10779 0.00000 -0.02286 0.06433
|
|
119 12D 0 -0.17684 0.00000 -0.17405 0.00000 0.00000
|
|
120 12D+1 0.00000 1.14251 0.00000 0.97017 -0.53684
|
|
121 12D-1 -0.46384 0.00000 -0.48905 0.00000 0.00000
|
|
122 12D+2 0.83738 0.00000 0.53828 0.00000 0.00000
|
|
123 12D-2 0.00000 -1.81680 0.00000 0.41465 -0.60973
|
|
124 13F 0 0.00786 0.00000 0.01444 0.00000 0.00000
|
|
125 13F+1 0.00000 -0.00693 0.00000 0.00221 -0.00011
|
|
126 13F-1 -0.00266 0.00000 -0.01046 0.00000 0.00000
|
|
127 13F+2 0.00777 0.00000 0.02028 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00561 0.00000 0.01355 -0.00144
|
|
129 13F+3 0.00000 0.00640 0.00000 -0.00531 -0.00227
|
|
130 13F-3 -0.00254 0.00000 -0.01826 0.00000 0.00000
|
|
131 14F 0 -0.04961 0.00000 -0.02176 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00884 0.00000 0.01604 -0.01491
|
|
133 14F-1 -0.07976 0.00000 0.03534 0.00000 0.00000
|
|
134 14F+2 -0.04922 0.00000 -0.01353 0.00000 0.00000
|
|
135 14F-2 0.00000 -0.22484 0.00000 -0.11605 -0.00104
|
|
136 14F+3 0.00000 -0.33679 0.00000 0.08225 -0.04434
|
|
137 14F-3 -0.08163 0.00000 -0.01358 0.00000 0.00000
|
|
138 15G 0 -0.00433 0.00000 -0.00007 0.00000 0.00000
|
|
139 15G+1 0.00000 -0.00520 0.00000 -0.00289 -0.00152
|
|
140 15G-1 0.00220 0.00000 0.00232 0.00000 0.00000
|
|
141 15G+2 -0.00546 0.00000 -0.00055 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00436 0.00000 -0.00604 0.00196
|
|
143 15G+3 0.00000 -0.01626 0.00000 -0.00699 -0.00148
|
|
144 15G-3 0.00137 0.00000 0.00001 0.00000 0.00000
|
|
145 15G+4 -0.00550 0.00000 -0.00349 0.00000 0.00000
|
|
146 15G-4 0.00000 0.02210 0.00000 -0.00537 0.00506
|
|
147 3 H 1S 0.01199 0.00000 0.00560 -0.00969 0.00105
|
|
148 2S 0.02002 0.00000 -0.15696 0.27186 0.05687
|
|
149 3S -2.74955 0.00000 4.99210 -8.64657 0.88210
|
|
150 4S -7.87238 0.00000 3.97508 -6.88504 -0.18931
|
|
151 5S -0.11087 0.00000 -0.16402 0.28409 -0.13814
|
|
152 6PX -0.00114 0.00198 -0.00520 0.00008 0.00262
|
|
153 6PY 0.00066 0.00343 -0.00592 -0.00520 -0.00477
|
|
154 6PZ -0.00332 0.00000 -0.01357 0.02350 0.00808
|
|
155 7PX 0.00097 0.02936 0.03402 -0.01059 -0.01677
|
|
156 7PY -0.00056 0.05085 0.02870 0.03402 0.01264
|
|
157 7PZ -0.01347 0.00000 0.06256 -0.10836 0.01636
|
|
158 8PX 1.03687 -0.54140 -1.30245 2.07552 -0.02382
|
|
159 8PY -0.59864 -0.93773 0.57159 -1.30245 0.03788
|
|
160 8PZ -0.31031 0.00000 0.19762 -0.34228 -0.44487
|
|
161 9PX 2.61453 -1.13252 -1.23390 1.63029 0.04475
|
|
162 9PY -1.50950 -1.96158 0.20551 -1.23390 0.16160
|
|
163 9PZ 0.73706 0.00000 0.63923 -1.10718 -1.49689
|
|
164 10D 0 -0.03238 0.00000 0.01046 -0.01812 -0.02751
|
|
165 10D+1 -0.00934 -0.00492 0.02850 -0.01181 -0.01876
|
|
166 10D-1 0.00539 -0.00852 0.02110 0.02850 -0.00404
|
|
167 10D+2 -0.00849 -0.00421 0.00562 -0.00212 -0.01607
|
|
168 10D-2 0.01470 -0.00243 -0.00212 0.00807 0.01192
|
|
169 11D 0 0.19220 0.00000 -0.08614 0.14920 0.09829
|
|
170 11D+1 0.08574 0.00543 -0.21312 0.18192 0.11279
|
|
171 11D-1 -0.04950 0.00940 -0.06417 -0.21312 0.00610
|
|
172 11D+2 -0.00320 0.09335 0.02230 -0.07822 0.07503
|
|
173 11D-2 0.00555 0.05390 -0.07822 0.11262 -0.06563
|
|
174 12D 0 -0.17684 0.00000 0.08703 -0.15074 -1.04813
|
|
175 12D+1 -0.40169 -0.57126 0.63186 -0.12425 0.63715
|
|
176 12D-1 0.23192 -0.98944 0.60537 0.63186 -0.67781
|
|
177 12D+2 -0.41869 1.57339 0.44556 -0.05353 -0.39954
|
|
178 12D-2 0.72519 0.90840 -0.05353 0.50737 0.08229
|
|
179 13F 0 0.00786 0.00000 -0.00722 0.01251 -0.00605
|
|
180 13F+1 -0.00230 0.00346 0.00549 -0.00729 -0.00054
|
|
181 13F-1 0.00133 0.00600 -0.00095 0.00549 0.00025
|
|
182 13F+2 -0.00388 -0.00486 0.01523 -0.00291 0.00212
|
|
183 13F-2 0.00673 -0.00281 -0.00291 0.01859 -0.00511
|
|
184 13F+3 0.00000 0.00640 0.00460 0.00266 0.00113
|
|
185 13F-3 -0.00254 0.00000 0.00913 -0.01581 -0.00232
|
|
186 14F 0 -0.04961 0.00000 0.01088 -0.01885 0.07632
|
|
187 14F+1 -0.06908 -0.00442 -0.00836 0.03051 0.14033
|
|
188 14F-1 0.03988 -0.00765 0.02086 -0.00836 -0.08963
|
|
189 14F+2 0.02461 0.19472 -0.09042 -0.04439 -0.07476
|
|
190 14F-2 -0.04262 0.11242 -0.04439 -0.03916 0.12846
|
|
191 14F+3 0.00000 -0.33679 -0.07123 -0.04112 0.02217
|
|
192 14F-3 -0.08163 0.00000 0.00679 -0.01176 0.02528
|
|
193 15G 0 -0.00433 0.00000 0.00003 -0.00006 0.00858
|
|
194 15G+1 0.00190 0.00260 -0.00226 0.00102 0.00183
|
|
195 15G-1 -0.00110 0.00451 -0.00159 -0.00226 -0.00193
|
|
196 15G+2 0.00273 -0.00377 -0.00467 -0.00238 -0.00557
|
|
197 15G-2 -0.00473 -0.00218 -0.00238 -0.00192 0.01161
|
|
198 15G+3 0.00000 -0.01626 0.00605 0.00349 0.00074
|
|
199 15G-3 0.00137 0.00000 0.00000 0.00001 -0.00767
|
|
200 15G+4 0.00275 0.01914 0.00315 0.00384 -0.00206
|
|
201 15G-4 0.00476 -0.01105 -0.00384 0.00127 0.00148
|
|
202 4 H 1S 0.01199 0.00000 0.00560 0.00969 -0.00105
|
|
203 2S 0.02002 0.00000 -0.15696 -0.27186 -0.05687
|
|
204 3S -2.74955 0.00000 4.99210 8.64657 -0.88210
|
|
205 4S -7.87238 0.00000 3.97508 6.88504 0.18931
|
|
206 5S -0.11087 0.00000 -0.16402 -0.28409 0.13814
|
|
207 6PX 0.00114 0.00198 0.00520 0.00008 0.00262
|
|
208 6PY 0.00066 -0.00343 -0.00592 0.00520 0.00477
|
|
209 6PZ -0.00332 0.00000 -0.01357 -0.02350 -0.00808
|
|
210 7PX -0.00097 0.02936 -0.03402 -0.01059 -0.01677
|
|
211 7PY -0.00056 -0.05085 0.02870 -0.03402 -0.01264
|
|
212 7PZ -0.01347 0.00000 0.06256 0.10836 -0.01636
|
|
213 8PX -1.03687 -0.54140 1.30245 2.07552 -0.02382
|
|
214 8PY -0.59864 0.93773 0.57159 1.30245 -0.03788
|
|
215 8PZ -0.31031 0.00000 0.19762 0.34228 0.44487
|
|
216 9PX -2.61453 -1.13252 1.23390 1.63029 0.04475
|
|
217 9PY -1.50950 1.96158 0.20551 1.23390 -0.16160
|
|
218 9PZ 0.73706 0.00000 0.63923 1.10718 1.49689
|
|
219 10D 0 -0.03238 0.00000 0.01046 0.01812 0.02751
|
|
220 10D+1 0.00934 -0.00492 -0.02850 -0.01181 -0.01876
|
|
221 10D-1 0.00539 0.00852 0.02110 -0.02850 0.00404
|
|
222 10D+2 -0.00849 0.00421 0.00562 0.00212 0.01607
|
|
223 10D-2 -0.01470 -0.00243 0.00212 0.00807 0.01192
|
|
224 11D 0 0.19220 0.00000 -0.08614 -0.14920 -0.09829
|
|
225 11D+1 -0.08574 0.00543 0.21312 0.18192 0.11279
|
|
226 11D-1 -0.04950 -0.00940 -0.06417 0.21312 -0.00610
|
|
227 11D+2 -0.00320 -0.09335 0.02230 0.07822 -0.07503
|
|
228 11D-2 -0.00555 0.05390 0.07822 0.11262 -0.06563
|
|
229 12D 0 -0.17684 0.00000 0.08703 0.15074 1.04813
|
|
230 12D+1 0.40169 -0.57126 -0.63186 -0.12425 0.63715
|
|
231 12D-1 0.23192 0.98944 0.60537 -0.63186 0.67781
|
|
232 12D+2 -0.41869 -1.57339 0.44556 0.05353 0.39954
|
|
233 12D-2 -0.72519 0.90840 0.05353 0.50737 0.08229
|
|
234 13F 0 0.00786 0.00000 -0.00722 -0.01251 0.00605
|
|
235 13F+1 0.00230 0.00346 -0.00549 -0.00729 -0.00054
|
|
236 13F-1 0.00133 -0.00600 -0.00095 -0.00549 -0.00025
|
|
237 13F+2 -0.00388 0.00486 0.01523 0.00291 -0.00212
|
|
238 13F-2 -0.00673 -0.00281 0.00291 0.01859 -0.00511
|
|
239 13F+3 0.00000 0.00640 -0.00460 0.00266 0.00113
|
|
240 13F-3 -0.00254 0.00000 0.00913 0.01581 0.00232
|
|
241 14F 0 -0.04961 0.00000 0.01088 0.01885 -0.07632
|
|
242 14F+1 0.06908 -0.00442 0.00836 0.03051 0.14033
|
|
243 14F-1 0.03988 0.00765 0.02086 0.00836 0.08963
|
|
244 14F+2 0.02461 -0.19472 -0.09042 0.04439 0.07476
|
|
245 14F-2 0.04262 0.11242 0.04439 -0.03916 0.12846
|
|
246 14F+3 0.00000 -0.33679 0.07123 -0.04112 0.02217
|
|
247 14F-3 -0.08163 0.00000 0.00679 0.01176 -0.02528
|
|
248 15G 0 -0.00433 0.00000 0.00003 0.00006 -0.00858
|
|
249 15G+1 -0.00190 0.00260 0.00226 0.00102 0.00183
|
|
250 15G-1 -0.00110 -0.00451 -0.00159 0.00226 0.00193
|
|
251 15G+2 0.00273 0.00377 -0.00467 0.00238 0.00557
|
|
252 15G-2 0.00473 -0.00218 0.00238 -0.00192 0.01161
|
|
253 15G+3 0.00000 -0.01626 -0.00605 0.00349 0.00074
|
|
254 15G-3 0.00137 0.00000 0.00000 -0.00001 0.00767
|
|
255 15G+4 0.00275 -0.01914 0.00315 -0.00384 0.00206
|
|
256 15G-4 -0.00476 -0.01105 0.00384 0.00127 0.00148
|
|
41 42 43 44 45
|
|
(E)--V (A2)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 1.78785 1.83536 1.88302 1.88302 1.91049
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.00461
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 -0.09542
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 -0.39197
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 -0.21213
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 17.35981
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 8.72335
|
|
7 7PX 0.00000 0.00000 -0.02574 0.00000 0.00000
|
|
8 7PY 0.00055 0.00000 0.00000 -0.02574 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.03681
|
|
10 8PX 0.00000 0.00000 0.03642 0.00000 0.00000
|
|
11 8PY -0.06988 0.00000 0.00000 0.03642 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.03231
|
|
13 9PX 0.00000 0.00000 0.13316 0.00000 0.00000
|
|
14 9PY 1.07865 0.00000 0.00000 0.13316 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 -1.14458
|
|
16 10PX 0.00000 0.00000 -1.09306 0.00000 0.00000
|
|
17 10PY -1.27161 0.00000 0.00000 -1.09306 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 -1.77325
|
|
19 11PX 0.00000 0.00000 -1.05686 0.00000 0.00000
|
|
20 11PY 0.11376 0.00000 0.00000 -1.05686 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.24319
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.02214
|
|
23 12D+1 0.00000 0.00000 -0.01503 0.00000 0.00000
|
|
24 12D-1 0.02031 0.00000 0.00000 -0.01503 0.00000
|
|
25 12D+2 -0.00950 0.00000 0.00000 -0.00455 0.00000
|
|
26 12D-2 0.00000 0.00000 -0.00455 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.10684
|
|
28 13D+1 0.00000 0.00000 0.12066 0.00000 0.00000
|
|
29 13D-1 -0.13142 0.00000 0.00000 0.12066 0.00000
|
|
30 13D+2 0.05048 0.00000 0.00000 0.04693 0.00000
|
|
31 13D-2 0.00000 0.00000 0.04693 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 -1.47784
|
|
33 14D+1 0.00000 0.00000 -1.21050 0.00000 0.00000
|
|
34 14D-1 0.66818 0.00000 0.00000 -1.21050 0.00000
|
|
35 14D+2 -0.74626 0.00000 0.00000 -0.62828 0.00000
|
|
36 14D-2 0.00000 0.00000 -0.62828 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 -1.00397
|
|
38 15D+1 0.00000 0.00000 -0.18573 0.00000 0.00000
|
|
39 15D-1 2.38868 0.00000 0.00000 -0.18573 0.00000
|
|
40 15D+2 0.14371 0.00000 0.00000 -1.09918 0.00000
|
|
41 15D-2 0.00000 0.00000 -1.09918 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 -0.00311
|
|
43 16F+1 0.00000 0.00000 -0.00995 0.00000 0.00000
|
|
44 16F-1 0.00708 0.00000 0.00000 -0.00995 0.00000
|
|
45 16F+2 0.00397 0.00000 0.00000 -0.01926 0.00000
|
|
46 16F-2 0.00000 0.00000 -0.01926 0.00000 0.00000
|
|
47 16F+3 0.00000 -0.00479 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00654
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.10694
|
|
50 17F+1 0.00000 0.00000 0.12229 0.00000 0.00000
|
|
51 17F-1 -0.08242 0.00000 0.00000 0.12229 0.00000
|
|
52 17F+2 -0.01091 0.00000 0.00000 0.17325 0.00000
|
|
53 17F-2 0.00000 0.00000 0.17325 0.00000 0.00000
|
|
54 17F+3 0.00000 0.09083 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 -0.18448
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.02985
|
|
57 18F+1 0.00000 0.00000 1.31374 0.00000 0.00000
|
|
58 18F-1 -0.90833 0.00000 0.00000 1.31374 0.00000
|
|
59 18F+2 -0.28677 0.00000 0.00000 1.18970 0.00000
|
|
60 18F-2 0.00000 0.00000 1.18970 0.00000 0.00000
|
|
61 18F+3 0.00000 0.40958 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 -0.74302
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 -0.00033
|
|
64 19G+1 0.00000 0.00000 0.00990 0.00000 0.00000
|
|
65 19G-1 0.00566 0.00000 0.00000 0.00990 0.00000
|
|
66 19G+2 0.00405 0.00000 0.00000 0.00971 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00971 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00320 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00859
|
|
70 19G+4 -0.00661 0.00000 0.00000 -0.00019 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00019 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.05749
|
|
73 20G+1 0.00000 0.00000 -0.07163 0.00000 0.00000
|
|
74 20G-1 -0.00294 0.00000 0.00000 -0.07163 0.00000
|
|
75 20G+2 0.08885 0.00000 0.00000 -0.23652 0.00000
|
|
76 20G-2 0.00000 0.00000 -0.23652 0.00000 0.00000
|
|
77 20G+3 0.00000 -0.11799 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00296
|
|
79 20G+4 0.05597 0.00000 0.00000 -0.09774 0.00000
|
|
80 20G-4 0.00000 0.00000 0.09774 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00198
|
|
82 21H+1 0.00000 0.00000 -0.02087 0.00000 0.00000
|
|
83 21H-1 0.01229 0.00000 0.00000 -0.02087 0.00000
|
|
84 21H+2 -0.00977 0.00000 0.00000 0.00566 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00566 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00089 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00948
|
|
88 21H+4 0.00679 0.00000 0.00000 0.00119 0.00000
|
|
89 21H-4 0.00000 0.00000 -0.00119 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00109 0.00000 0.00000
|
|
91 21H-5 0.00543 0.00000 0.00000 -0.00109 0.00000
|
|
92 2 H 1S 0.00121 0.00000 0.00000 0.00595 -0.01867
|
|
93 2S 0.06567 0.00000 0.00000 0.02739 0.42065
|
|
94 3S 1.01856 0.00000 0.00000 -1.38853 -3.63490
|
|
95 4S -0.21860 0.00000 0.00000 -2.22899 -5.16776
|
|
96 5S -0.15950 0.00000 0.00000 0.52293 -0.08308
|
|
97 6PX 0.00000 -0.01327 0.00018 0.00000 0.00000
|
|
98 6PY 0.00538 0.00000 0.00000 -0.00475 0.01734
|
|
99 6PZ 0.00933 0.00000 0.00000 -0.01854 0.01380
|
|
100 7PX 0.00000 0.04154 -0.04006 0.00000 0.00000
|
|
101 7PY -0.02407 0.00000 0.00000 -0.02323 -0.15801
|
|
102 7PZ 0.01889 0.00000 0.00000 0.02736 0.00271
|
|
103 8PX 0.00000 -0.10663 0.44117 0.00000 0.00000
|
|
104 8PY -0.04569 0.00000 0.00000 1.11533 1.65327
|
|
105 8PZ -0.51369 0.00000 0.00000 0.13211 -0.57279
|
|
106 9PX 0.00000 0.90183 1.96672 0.00000 0.00000
|
|
107 9PY -0.04855 0.00000 0.00000 2.40198 2.66400
|
|
108 9PZ -1.72846 0.00000 0.00000 1.51688 -2.25172
|
|
109 10D 0 -0.03176 0.00000 0.00000 -0.02270 -0.01274
|
|
110 10D+1 0.00000 -0.04855 -0.01624 0.00000 0.00000
|
|
111 10D-1 -0.01642 0.00000 0.00000 -0.01068 0.00597
|
|
112 10D+2 0.02120 0.00000 0.00000 0.00583 -0.00575
|
|
113 10D-2 0.00000 -0.00544 -0.01453 0.00000 0.00000
|
|
114 11D 0 0.11349 0.00000 0.00000 0.17312 0.06700
|
|
115 11D+1 0.00000 0.23207 0.07971 0.00000 0.00000
|
|
116 11D-1 0.10927 0.00000 0.00000 0.04235 0.03176
|
|
117 11D+2 -0.10895 0.00000 0.00000 0.06050 0.06943
|
|
118 11D-2 0.00000 0.01368 0.04860 0.00000 0.00000
|
|
119 12D 0 -1.21028 0.00000 0.00000 0.94897 -0.26711
|
|
120 12D+1 0.00000 -0.66919 0.10188 0.00000 0.00000
|
|
121 12D-1 1.02849 0.00000 0.00000 -1.17412 1.56490
|
|
122 12D+2 0.31296 0.00000 0.00000 1.37799 0.93683
|
|
123 12D-2 0.00000 -0.57905 -1.26353 0.00000 0.00000
|
|
124 13F 0 -0.00699 0.00000 0.00000 0.00577 0.00511
|
|
125 13F+1 0.00000 0.00416 0.00418 0.00000 0.00000
|
|
126 13F-1 -0.00069 0.00000 0.00000 0.00981 -0.00522
|
|
127 13F+2 -0.00634 0.00000 0.00000 0.00311 0.00028
|
|
128 13F-2 0.00000 0.00195 0.00504 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00630 0.00256 0.00000 0.00000
|
|
130 13F-3 -0.00268 0.00000 0.00000 -0.00191 0.00032
|
|
131 14F 0 0.08813 0.00000 0.00000 -0.04588 0.07877
|
|
132 14F+1 0.00000 -0.03853 -0.05511 0.00000 0.00000
|
|
133 14F-1 0.19208 0.00000 0.00000 -0.35386 0.10047
|
|
134 14F+2 0.17162 0.00000 0.00000 -0.10216 0.18212
|
|
135 14F-2 0.00000 -0.05408 -0.09837 0.00000 0.00000
|
|
136 14F+3 0.00000 -0.11665 -0.13970 0.00000 0.00000
|
|
137 14F-3 0.02919 0.00000 0.00000 -0.17839 -0.09953
|
|
138 15G 0 0.00991 0.00000 0.00000 -0.01509 0.00708
|
|
139 15G+1 0.00000 -0.00150 -0.00319 0.00000 0.00000
|
|
140 15G-1 0.00295 0.00000 0.00000 -0.00026 -0.00616
|
|
141 15G+2 0.01483 0.00000 0.00000 -0.02137 0.00827
|
|
142 15G-2 0.00000 0.00412 0.00366 0.00000 0.00000
|
|
143 15G+3 0.00000 -0.00246 -0.00684 0.00000 0.00000
|
|
144 15G-3 -0.00885 0.00000 0.00000 0.00606 -0.01250
|
|
145 15G+4 -0.00029 0.00000 0.00000 -0.00910 -0.00282
|
|
146 15G-4 0.00000 0.00722 0.00969 0.00000 0.00000
|
|
147 3 H 1S -0.00061 0.00000 0.00516 -0.00298 -0.01867
|
|
148 2S -0.03283 0.00000 0.02372 -0.01370 0.42065
|
|
149 3S -0.50928 0.00000 -1.20250 0.69426 -3.63490
|
|
150 4S 0.10930 0.00000 -1.93036 1.11449 -5.16776
|
|
151 5S 0.07975 0.00000 0.45287 -0.26146 -0.08308
|
|
152 6PX -0.00477 0.00664 -0.00352 0.00213 0.01502
|
|
153 6PY -0.00289 0.01149 0.00213 -0.00105 -0.00867
|
|
154 6PZ -0.00466 0.00000 -0.01606 0.00927 0.01380
|
|
155 7PX 0.01264 -0.02077 -0.02744 -0.00729 -0.13684
|
|
156 7PY -0.00217 -0.03598 -0.00729 -0.03585 0.07901
|
|
157 7PZ -0.00945 0.00000 0.02370 -0.01368 0.00271
|
|
158 8PX 0.03788 0.05332 0.94679 -0.29192 1.43177
|
|
159 8PY 0.01993 0.09235 -0.29192 0.60971 -0.82663
|
|
160 8PZ 0.25685 0.00000 0.11441 -0.06605 -0.57279
|
|
161 9PX 0.16160 -0.45092 2.29316 -0.18847 2.30709
|
|
162 9PY 0.23135 -0.78101 -0.18847 2.07553 -1.33200
|
|
163 9PZ 0.86423 0.00000 1.31366 -0.75844 -2.25172
|
|
164 10D 0 0.01588 0.00000 -0.01966 0.01135 -0.01274
|
|
165 10D+1 -0.00404 0.02427 -0.01207 -0.00241 0.00517
|
|
166 10D-1 -0.02342 0.04204 -0.00241 -0.01485 -0.00298
|
|
167 10D+2 -0.00664 0.00471 -0.00882 -0.00944 0.00287
|
|
168 10D-2 -0.01607 0.00272 0.00074 -0.00882 -0.00498
|
|
169 11D 0 -0.05675 0.00000 0.14992 -0.08656 0.06700
|
|
170 11D+1 0.00610 -0.11604 0.05169 0.01617 0.02750
|
|
171 11D-1 0.11984 -0.20098 0.01617 0.07037 -0.01588
|
|
172 11D+2 0.02101 -0.01185 -0.00515 0.05157 -0.03472
|
|
173 11D-2 0.07503 -0.00684 0.05752 -0.00515 0.06013
|
|
174 12D 0 0.60514 0.00000 0.82183 -0.47449 -0.26711
|
|
175 12D+1 -0.67781 0.33459 -0.85512 0.55253 1.35524
|
|
176 12D-1 -0.14551 0.57953 0.55253 -0.21712 -0.78245
|
|
177 12D+2 -0.37906 0.50147 -1.14381 -0.60315 -0.46842
|
|
178 12D-2 -0.39954 0.28952 0.71761 -1.14381 0.81132
|
|
179 13F 0 0.00349 0.00000 0.00500 -0.00288 0.00511
|
|
180 13F+1 0.00025 -0.00208 0.00841 -0.00244 -0.00452
|
|
181 13F-1 -0.00026 -0.00360 -0.00244 0.00559 0.00261
|
|
182 13F+2 -0.00266 -0.00169 0.00083 0.00456 -0.00014
|
|
183 13F-2 0.00212 -0.00097 0.00359 0.00083 0.00024
|
|
184 13F+3 0.00196 0.00630 -0.00128 -0.00221 0.00000
|
|
185 13F-3 0.00134 0.00000 -0.00166 0.00096 0.00032
|
|
186 14F 0 -0.04406 0.00000 -0.03973 0.02294 0.07877
|
|
187 14F+1 -0.08963 0.01926 -0.27917 0.12936 0.08701
|
|
188 14F-1 0.03683 0.03337 0.12936 -0.12980 -0.05024
|
|
189 14F+2 0.04213 0.04683 0.00164 -0.09931 -0.09106
|
|
190 14F-2 -0.07476 0.02704 -0.10121 0.00164 0.15772
|
|
191 14F+3 0.03840 -0.11665 0.06985 0.12098 0.00000
|
|
192 14F-3 -0.01460 0.00000 -0.15449 0.08919 -0.09953
|
|
193 15G 0 -0.00496 0.00000 -0.01307 0.00754 0.00708
|
|
194 15G+1 -0.00193 0.00075 -0.00100 -0.00127 -0.00533
|
|
195 15G-1 -0.00040 0.00130 -0.00127 -0.00246 0.00308
|
|
196 15G+2 0.00518 -0.00356 0.01084 -0.00259 -0.00413
|
|
197 15G-2 -0.00557 -0.00206 -0.01511 0.01084 0.00716
|
|
198 15G+3 0.00129 -0.00246 0.00342 0.00592 0.00000
|
|
199 15G-3 0.00443 0.00000 0.00525 -0.00303 -0.01250
|
|
200 15G+4 -0.00387 0.00625 -0.00026 -0.00955 0.00141
|
|
201 15G-4 0.00206 -0.00361 0.00925 0.00026 0.00244
|
|
202 4 H 1S -0.00061 0.00000 -0.00516 -0.00298 -0.01867
|
|
203 2S -0.03283 0.00000 -0.02372 -0.01370 0.42065
|
|
204 3S -0.50928 0.00000 1.20250 0.69426 -3.63490
|
|
205 4S 0.10930 0.00000 1.93036 1.11449 -5.16776
|
|
206 5S 0.07975 0.00000 -0.45287 -0.26146 -0.08308
|
|
207 6PX 0.00477 0.00664 -0.00352 -0.00213 -0.01502
|
|
208 6PY -0.00289 -0.01149 -0.00213 -0.00105 -0.00867
|
|
209 6PZ -0.00466 0.00000 0.01606 0.00927 0.01380
|
|
210 7PX -0.01264 -0.02077 -0.02744 0.00729 0.13684
|
|
211 7PY -0.00217 0.03598 0.00729 -0.03585 0.07901
|
|
212 7PZ -0.00945 0.00000 -0.02370 -0.01368 0.00271
|
|
213 8PX -0.03788 0.05332 0.94679 0.29192 -1.43177
|
|
214 8PY 0.01993 -0.09235 0.29192 0.60971 -0.82663
|
|
215 8PZ 0.25685 0.00000 -0.11441 -0.06605 -0.57279
|
|
216 9PX -0.16160 -0.45092 2.29316 0.18847 -2.30709
|
|
217 9PY 0.23135 0.78101 0.18847 2.07553 -1.33200
|
|
218 9PZ 0.86423 0.00000 -1.31366 -0.75844 -2.25172
|
|
219 10D 0 0.01588 0.00000 0.01966 0.01135 -0.01274
|
|
220 10D+1 0.00404 0.02427 -0.01207 0.00241 -0.00517
|
|
221 10D-1 -0.02342 -0.04204 0.00241 -0.01485 -0.00298
|
|
222 10D+2 -0.00664 -0.00471 0.00882 -0.00944 0.00287
|
|
223 10D-2 0.01607 0.00272 0.00074 0.00882 0.00498
|
|
224 11D 0 -0.05675 0.00000 -0.14992 -0.08656 0.06700
|
|
225 11D+1 -0.00610 -0.11604 0.05169 -0.01617 -0.02750
|
|
226 11D-1 0.11984 0.20098 -0.01617 0.07037 -0.01588
|
|
227 11D+2 0.02101 0.01185 0.00515 0.05157 -0.03472
|
|
228 11D-2 -0.07503 -0.00684 0.05752 0.00515 -0.06013
|
|
229 12D 0 0.60514 0.00000 -0.82183 -0.47449 -0.26711
|
|
230 12D+1 0.67781 0.33459 -0.85512 -0.55253 -1.35524
|
|
231 12D-1 -0.14551 -0.57953 -0.55253 -0.21712 -0.78245
|
|
232 12D+2 -0.37906 -0.50147 1.14381 -0.60315 -0.46842
|
|
233 12D-2 0.39954 0.28952 0.71761 1.14381 -0.81132
|
|
234 13F 0 0.00349 0.00000 -0.00500 -0.00288 0.00511
|
|
235 13F+1 -0.00025 -0.00208 0.00841 0.00244 0.00452
|
|
236 13F-1 -0.00026 0.00360 0.00244 0.00559 0.00261
|
|
237 13F+2 -0.00266 0.00169 -0.00083 0.00456 -0.00014
|
|
238 13F-2 -0.00212 -0.00097 0.00359 -0.00083 -0.00024
|
|
239 13F+3 -0.00196 0.00630 -0.00128 0.00221 0.00000
|
|
240 13F-3 0.00134 0.00000 0.00166 0.00096 0.00032
|
|
241 14F 0 -0.04406 0.00000 0.03973 0.02294 0.07877
|
|
242 14F+1 0.08963 0.01926 -0.27917 -0.12936 -0.08701
|
|
243 14F-1 0.03683 -0.03337 -0.12936 -0.12980 -0.05024
|
|
244 14F+2 0.04213 -0.04683 -0.00164 -0.09931 -0.09106
|
|
245 14F-2 0.07476 0.02704 -0.10121 -0.00164 -0.15772
|
|
246 14F+3 -0.03840 -0.11665 0.06985 -0.12098 0.00000
|
|
247 14F-3 -0.01460 0.00000 0.15449 0.08919 -0.09953
|
|
248 15G 0 -0.00496 0.00000 0.01307 0.00754 0.00708
|
|
249 15G+1 0.00193 0.00075 -0.00100 0.00127 0.00533
|
|
250 15G-1 -0.00040 -0.00130 0.00127 -0.00246 0.00308
|
|
251 15G+2 0.00518 0.00356 -0.01084 -0.00259 -0.00413
|
|
252 15G-2 0.00557 -0.00206 -0.01511 -0.01084 -0.00716
|
|
253 15G+3 -0.00129 -0.00246 0.00342 -0.00592 0.00000
|
|
254 15G-3 0.00443 0.00000 -0.00525 -0.00303 -0.01250
|
|
255 15G+4 -0.00387 -0.00625 0.00026 -0.00955 0.00141
|
|
256 15G-4 -0.00206 -0.00361 0.00925 -0.00026 -0.00244
|
|
46 47 48 49 50
|
|
(E)--V (E)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 1.95886 1.95886 2.02285 2.02285 2.05310
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.03098
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 -0.16646
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 -0.57341
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 0.96130
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 15.71716
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 16.70413
|
|
7 7PX 0.00000 0.00575 0.01431 0.00000 0.00000
|
|
8 7PY 0.00575 0.00000 0.00000 0.01431 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.03218
|
|
10 8PX 0.00000 0.86822 -0.13924 0.00000 0.00000
|
|
11 8PY 0.86822 0.00000 0.00000 -0.13924 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.28379
|
|
13 9PX 0.00000 -9.35417 1.54777 0.00000 0.00000
|
|
14 9PY -9.35417 0.00000 0.00000 1.54777 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 -2.89353
|
|
16 10PX 0.00000 -11.29377 0.42644 0.00000 0.00000
|
|
17 10PY -11.29377 0.00000 0.00000 0.42644 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 -7.61649
|
|
19 11PX 0.00000 -1.41354 0.37656 0.00000 0.00000
|
|
20 11PY -1.41354 0.00000 0.00000 0.37656 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 -2.55057
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.02202
|
|
23 12D+1 0.00000 -0.01936 -0.00784 0.00000 0.00000
|
|
24 12D-1 -0.01936 0.00000 0.00000 -0.00784 0.00000
|
|
25 12D+2 -0.01280 0.00000 0.00000 0.02595 0.00000
|
|
26 12D-2 0.00000 -0.01280 0.02595 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.18569
|
|
28 13D+1 0.00000 0.02137 0.05127 0.00000 0.00000
|
|
29 13D-1 0.02137 0.00000 0.00000 0.05127 0.00000
|
|
30 13D+2 0.01113 0.00000 0.00000 -0.23999 0.00000
|
|
31 13D-2 0.00000 0.01113 -0.23999 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.41720
|
|
33 14D+1 0.00000 3.07443 -0.81463 0.00000 0.00000
|
|
34 14D-1 3.07443 0.00000 0.00000 -0.81463 0.00000
|
|
35 14D+2 3.71674 0.00000 0.00000 1.35059 0.00000
|
|
36 14D-2 0.00000 3.71674 1.35059 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 1.88845
|
|
38 15D+1 0.00000 1.94010 -0.24129 0.00000 0.00000
|
|
39 15D-1 1.94010 0.00000 0.00000 -0.24129 0.00000
|
|
40 15D+2 1.41791 0.00000 0.00000 3.02707 0.00000
|
|
41 15D-2 0.00000 1.41791 3.02707 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 -0.00977
|
|
43 16F+1 0.00000 -0.00621 0.00158 0.00000 0.00000
|
|
44 16F-1 -0.00621 0.00000 0.00000 0.00158 0.00000
|
|
45 16F+2 0.04500 0.00000 0.00000 0.00131 0.00000
|
|
46 16F-2 0.00000 0.04500 0.00131 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00814
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.19684
|
|
50 17F+1 0.00000 0.08363 -0.00411 0.00000 0.00000
|
|
51 17F-1 0.08363 0.00000 0.00000 -0.00411 0.00000
|
|
52 17F+2 -0.55397 0.00000 0.00000 -0.01042 0.00000
|
|
53 17F-2 0.00000 -0.55397 -0.01042 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 -0.20513
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 -0.27120
|
|
57 18F+1 0.00000 -0.02708 0.41429 0.00000 0.00000
|
|
58 18F-1 -0.02708 0.00000 0.00000 0.41429 0.00000
|
|
59 18F+2 -0.53929 0.00000 0.00000 -1.36983 0.00000
|
|
60 18F-2 0.00000 -0.53929 -1.36983 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 1.45796
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00090
|
|
64 19G+1 0.00000 -0.02434 0.01234 0.00000 0.00000
|
|
65 19G-1 -0.02434 0.00000 0.00000 0.01234 0.00000
|
|
66 19G+2 0.00298 0.00000 0.00000 -0.00670 0.00000
|
|
67 19G-2 0.00000 0.00298 -0.00670 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.03410
|
|
70 19G+4 -0.02715 0.00000 0.00000 0.00064 0.00000
|
|
71 19G-4 0.00000 0.02715 -0.00064 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 -0.13748
|
|
73 20G+1 0.00000 -0.12407 -0.02812 0.00000 0.00000
|
|
74 20G-1 -0.12407 0.00000 0.00000 -0.02812 0.00000
|
|
75 20G+2 0.01041 0.00000 0.00000 0.02225 0.00000
|
|
76 20G-2 0.00000 0.01041 0.02225 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 -0.08717
|
|
79 20G+4 -0.08819 0.00000 0.00000 0.14904 0.00000
|
|
80 20G-4 0.00000 0.08819 -0.14904 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.01841
|
|
82 21H+1 0.00000 0.00897 -0.00533 0.00000 0.00000
|
|
83 21H-1 0.00897 0.00000 0.00000 -0.00533 0.00000
|
|
84 21H+2 0.00981 0.00000 0.00000 0.01149 0.00000
|
|
85 21H-2 0.00000 0.00981 0.01149 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 -0.01256
|
|
88 21H+4 0.01551 0.00000 0.00000 -0.02201 0.00000
|
|
89 21H-4 0.00000 -0.01551 0.02201 0.00000 0.00000
|
|
90 21H+5 0.00000 0.01280 0.02472 0.00000 0.00000
|
|
91 21H-5 -0.01280 0.00000 0.00000 -0.02472 0.00000
|
|
92 2 H 1S 0.03179 0.00000 0.00000 -0.01609 -0.03359
|
|
93 2S -1.42911 0.00000 0.00000 0.33520 0.65639
|
|
94 3S 12.66998 0.00000 0.00000 1.16163 -1.64044
|
|
95 4S 14.09024 0.00000 0.00000 0.92926 -9.42371
|
|
96 5S 0.04541 0.00000 0.00000 -0.41365 0.02792
|
|
97 6PX 0.00000 0.01556 0.00087 0.00000 0.00000
|
|
98 6PY 0.00535 0.00000 0.00000 -0.00788 0.01032
|
|
99 6PZ -0.01151 0.00000 0.00000 0.00340 -0.00717
|
|
100 7PX 0.00000 -0.06528 0.06856 0.00000 0.00000
|
|
101 7PY 0.22758 0.00000 0.00000 -0.01647 -0.19954
|
|
102 7PZ -0.04674 0.00000 0.00000 -0.01377 0.05205
|
|
103 8PX 0.00000 0.38481 -1.04691 0.00000 0.00000
|
|
104 8PY -6.02272 0.00000 0.00000 -0.27452 1.35242
|
|
105 8PZ 2.36214 0.00000 0.00000 0.31114 -0.03680
|
|
106 9PX 0.00000 -0.50244 -2.26947 0.00000 0.00000
|
|
107 9PY -8.88851 0.00000 0.00000 0.31491 4.87838
|
|
108 9PZ 3.20064 0.00000 0.00000 0.33810 -0.06927
|
|
109 10D 0 0.00166 0.00000 0.00000 -0.01840 -0.00470
|
|
110 10D+1 0.00000 0.00085 -0.01075 0.00000 0.00000
|
|
111 10D-1 0.03660 0.00000 0.00000 -0.01925 -0.01327
|
|
112 10D+2 0.05885 0.00000 0.00000 0.01567 -0.01161
|
|
113 10D-2 0.00000 0.01522 -0.00135 0.00000 0.00000
|
|
114 11D 0 -0.14827 0.00000 0.00000 0.08497 0.05547
|
|
115 11D+1 0.00000 -0.01190 0.01952 0.00000 0.00000
|
|
116 11D-1 -0.51709 0.00000 0.00000 0.07503 0.07013
|
|
117 11D+2 -0.67598 0.00000 0.00000 -0.07813 0.09339
|
|
118 11D-2 0.00000 -0.07106 0.08403 0.00000 0.00000
|
|
119 12D 0 -1.64034 0.00000 0.00000 0.06833 1.21709
|
|
120 12D+1 0.00000 0.01228 -0.80877 0.00000 0.00000
|
|
121 12D-1 -2.63746 0.00000 0.00000 -0.35642 0.19721
|
|
122 12D+2 -3.00107 0.00000 0.00000 0.78762 1.68448
|
|
123 12D-2 0.00000 0.31730 1.95132 0.00000 0.00000
|
|
124 13F 0 -0.01449 0.00000 0.00000 -0.00159 -0.00216
|
|
125 13F+1 0.00000 0.00085 -0.00072 0.00000 0.00000
|
|
126 13F-1 0.00049 0.00000 0.00000 -0.00123 0.00247
|
|
127 13F+2 -0.01646 0.00000 0.00000 0.00017 0.00762
|
|
128 13F-2 0.00000 0.00331 0.00358 0.00000 0.00000
|
|
129 13F+3 0.00000 -0.00208 -0.00096 0.00000 0.00000
|
|
130 13F-3 0.02194 0.00000 0.00000 0.00089 0.00043
|
|
131 14F 0 -0.31644 0.00000 0.00000 0.01159 0.12597
|
|
132 14F+1 0.00000 -0.02357 0.03732 0.00000 0.00000
|
|
133 14F-1 0.14329 0.00000 0.00000 -0.07309 -0.21098
|
|
134 14F+2 -0.48678 0.00000 0.00000 0.02463 0.08205
|
|
135 14F-2 0.00000 0.02213 0.16806 0.00000 0.00000
|
|
136 14F+3 0.00000 0.02384 0.32660 0.00000 0.00000
|
|
137 14F-3 0.44610 0.00000 0.00000 -0.08561 -0.23488
|
|
138 15G 0 -0.00119 0.00000 0.00000 -0.00530 -0.00734
|
|
139 15G+1 0.00000 0.00063 0.00497 0.00000 0.00000
|
|
140 15G-1 0.02428 0.00000 0.00000 -0.00347 -0.01399
|
|
141 15G+2 0.00106 0.00000 0.00000 -0.00532 -0.00924
|
|
142 15G-2 0.00000 0.00336 0.00143 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00475 0.01888 0.00000 0.00000
|
|
144 15G-3 0.02694 0.00000 0.00000 -0.00540 -0.01213
|
|
145 15G+4 0.02120 0.00000 0.00000 -0.00883 -0.01610
|
|
146 15G-4 0.00000 -0.00254 -0.02400 0.00000 0.00000
|
|
147 3 H 1S -0.01590 0.02753 -0.01393 0.00804 -0.03359
|
|
148 2S 0.71456 -1.23765 0.29029 -0.16760 0.65639
|
|
149 3S -6.33499 10.97253 1.00600 -0.58081 -1.64044
|
|
150 4S -7.04512 12.20251 0.80477 -0.46463 -9.42371
|
|
151 5S -0.02270 0.03933 -0.35823 0.20683 0.02792
|
|
152 6PX 0.00442 0.00791 -0.00569 0.00379 0.00893
|
|
153 6PY 0.01301 0.00442 0.00379 -0.00132 -0.00516
|
|
154 6PZ 0.00576 -0.00997 0.00295 -0.00170 -0.00717
|
|
155 7PX -0.12681 0.15436 0.00479 0.03682 -0.17281
|
|
156 7PY 0.00793 -0.12681 0.03682 0.04730 0.09977
|
|
157 7PZ 0.02337 -0.04048 -0.01193 0.00689 0.05205
|
|
158 8PX 2.77454 -4.42084 -0.46762 -0.33446 1.17123
|
|
159 8PY -1.21707 2.77454 -0.33446 -0.85381 -0.67621
|
|
160 8PZ -1.18107 2.04567 0.26946 -0.15557 -0.03680
|
|
161 9PX 3.63128 -6.79200 -0.33118 -1.11907 4.22480
|
|
162 9PY -2.59896 3.63128 -1.11907 -1.62338 -2.43919
|
|
163 9PZ -1.60032 2.77184 0.29281 -0.16905 -0.06927
|
|
164 10D 0 -0.00083 0.00144 -0.01594 0.00920 -0.00470
|
|
165 10D+1 -0.01548 0.02766 -0.01712 0.00368 -0.01149
|
|
166 10D-1 0.00979 -0.01548 0.00368 -0.01288 0.00663
|
|
167 10D+2 0.02612 -0.01889 -0.00737 0.00291 0.00580
|
|
168 10D-2 -0.01889 0.04794 0.01141 -0.00737 -0.01005
|
|
169 11D 0 0.07413 -0.12840 0.07359 -0.04249 0.05547
|
|
170 11D+1 0.21875 -0.39079 0.06115 -0.02404 0.06073
|
|
171 11D-1 -0.13820 0.21875 -0.02404 0.03339 -0.03506
|
|
172 11D+2 -0.22229 0.26194 0.07022 0.04349 -0.04670
|
|
173 11D-2 0.26194 -0.52475 -0.03759 0.07022 0.08088
|
|
174 12D 0 0.82017 -1.42058 0.05918 -0.03417 1.21709
|
|
175 12D+1 1.14737 -1.97503 -0.46951 -0.19587 0.17079
|
|
176 12D-1 -0.65016 1.14737 -0.19587 -0.69568 -0.09860
|
|
177 12D+2 -0.51229 1.43689 0.50389 1.66039 -0.84224
|
|
178 12D-2 1.43689 -2.17148 1.07855 0.50389 1.45880
|
|
179 13F 0 0.00725 -0.01255 -0.00138 0.00079 -0.00216
|
|
180 13F+1 0.00016 0.00058 -0.00110 0.00022 0.00214
|
|
181 13F-1 0.00076 0.00016 0.00022 -0.00085 -0.00124
|
|
182 13F+2 -0.00163 0.00856 0.00148 0.00273 -0.00381
|
|
183 13F-2 0.00856 -0.01152 0.00102 0.00148 0.00660
|
|
184 13F+3 0.00180 0.00104 0.00048 0.00083 0.00000
|
|
185 13F-3 -0.01097 0.01900 0.00077 -0.00044 0.00043
|
|
186 14F 0 0.15822 -0.27404 0.01004 -0.00580 0.12597
|
|
187 14F+1 -0.07225 0.10158 -0.04549 0.04781 -0.18271
|
|
188 14F-1 0.01815 -0.07225 0.04781 0.00972 0.10549
|
|
189 14F+2 -0.10510 0.22036 0.06211 0.13220 -0.04102
|
|
190 14F-2 0.22036 -0.35955 0.06049 0.06211 0.07106
|
|
191 14F+3 -0.02065 -0.01192 -0.16330 -0.28284 0.00000
|
|
192 14F-3 -0.22305 0.38634 -0.07414 0.04280 -0.23488
|
|
193 15G 0 0.00059 -0.00103 -0.00459 0.00265 -0.00734
|
|
194 15G+1 -0.01024 0.01837 -0.00136 0.00365 -0.01211
|
|
195 15G-1 0.00654 -0.01024 0.00365 0.00286 0.00699
|
|
196 15G+2 0.00279 0.00100 0.00292 -0.00025 0.00462
|
|
197 15G-2 0.00100 0.00164 -0.00363 0.00292 -0.00800
|
|
198 15G+3 -0.00411 -0.00237 -0.00944 -0.01635 0.00000
|
|
199 15G-3 -0.01347 0.02333 -0.00468 0.00270 -0.01213
|
|
200 15G+4 0.00720 -0.00808 0.01422 0.01579 0.00805
|
|
201 15G-4 0.00808 -0.01653 0.00063 -0.01422 0.01394
|
|
202 4 H 1S -0.01590 -0.02753 0.01393 0.00804 -0.03359
|
|
203 2S 0.71456 1.23765 -0.29029 -0.16760 0.65639
|
|
204 3S -6.33499 -10.97253 -1.00600 -0.58081 -1.64044
|
|
205 4S -7.04512 -12.20251 -0.80477 -0.46463 -9.42371
|
|
206 5S -0.02270 -0.03933 0.35823 0.20683 0.02792
|
|
207 6PX -0.00442 0.00791 -0.00569 -0.00379 -0.00893
|
|
208 6PY 0.01301 -0.00442 -0.00379 -0.00132 -0.00516
|
|
209 6PZ 0.00576 0.00997 -0.00295 -0.00170 -0.00717
|
|
210 7PX 0.12681 0.15436 0.00479 -0.03682 0.17281
|
|
211 7PY 0.00793 0.12681 -0.03682 0.04730 0.09977
|
|
212 7PZ 0.02337 0.04048 0.01193 0.00689 0.05205
|
|
213 8PX -2.77454 -4.42084 -0.46762 0.33446 -1.17123
|
|
214 8PY -1.21707 -2.77454 0.33446 -0.85381 -0.67621
|
|
215 8PZ -1.18107 -2.04567 -0.26946 -0.15557 -0.03680
|
|
216 9PX -3.63128 -6.79200 -0.33118 1.11907 -4.22480
|
|
217 9PY -2.59896 -3.63128 1.11907 -1.62338 -2.43919
|
|
218 9PZ -1.60032 -2.77184 -0.29281 -0.16905 -0.06927
|
|
219 10D 0 -0.00083 -0.00144 0.01594 0.00920 -0.00470
|
|
220 10D+1 0.01548 0.02766 -0.01712 -0.00368 0.01149
|
|
221 10D-1 0.00979 0.01548 -0.00368 -0.01288 0.00663
|
|
222 10D+2 0.02612 0.01889 0.00737 0.00291 0.00580
|
|
223 10D-2 0.01889 0.04794 0.01141 0.00737 0.01005
|
|
224 11D 0 0.07413 0.12840 -0.07359 -0.04249 0.05547
|
|
225 11D+1 -0.21875 -0.39079 0.06115 0.02404 -0.06073
|
|
226 11D-1 -0.13820 -0.21875 0.02404 0.03339 -0.03506
|
|
227 11D+2 -0.22229 -0.26194 -0.07022 0.04349 -0.04670
|
|
228 11D-2 -0.26194 -0.52475 -0.03759 -0.07022 -0.08088
|
|
229 12D 0 0.82017 1.42058 -0.05918 -0.03417 1.21709
|
|
230 12D+1 -1.14737 -1.97503 -0.46951 0.19587 -0.17079
|
|
231 12D-1 -0.65016 -1.14737 0.19587 -0.69568 -0.09860
|
|
232 12D+2 -0.51229 -1.43689 -0.50389 1.66039 -0.84224
|
|
233 12D-2 -1.43689 -2.17148 1.07855 -0.50389 -1.45880
|
|
234 13F 0 0.00725 0.01255 0.00138 0.00079 -0.00216
|
|
235 13F+1 -0.00016 0.00058 -0.00110 -0.00022 -0.00214
|
|
236 13F-1 0.00076 -0.00016 -0.00022 -0.00085 -0.00124
|
|
237 13F+2 -0.00163 -0.00856 -0.00148 0.00273 -0.00381
|
|
238 13F-2 -0.00856 -0.01152 0.00102 -0.00148 -0.00660
|
|
239 13F+3 -0.00180 0.00104 0.00048 -0.00083 0.00000
|
|
240 13F-3 -0.01097 -0.01900 -0.00077 -0.00044 0.00043
|
|
241 14F 0 0.15822 0.27404 -0.01004 -0.00580 0.12597
|
|
242 14F+1 0.07225 0.10158 -0.04549 -0.04781 0.18271
|
|
243 14F-1 0.01815 0.07225 -0.04781 0.00972 0.10549
|
|
244 14F+2 -0.10510 -0.22036 -0.06211 0.13220 -0.04102
|
|
245 14F-2 -0.22036 -0.35955 0.06049 -0.06211 -0.07106
|
|
246 14F+3 0.02065 -0.01192 -0.16330 0.28284 0.00000
|
|
247 14F-3 -0.22305 -0.38634 0.07414 0.04280 -0.23488
|
|
248 15G 0 0.00059 0.00103 0.00459 0.00265 -0.00734
|
|
249 15G+1 0.01024 0.01837 -0.00136 -0.00365 0.01211
|
|
250 15G-1 0.00654 0.01024 -0.00365 0.00286 0.00699
|
|
251 15G+2 0.00279 -0.00100 -0.00292 -0.00025 0.00462
|
|
252 15G-2 -0.00100 0.00164 -0.00363 -0.00292 0.00800
|
|
253 15G+3 0.00411 -0.00237 -0.00944 0.01635 0.00000
|
|
254 15G-3 -0.01347 -0.02333 0.00468 0.00270 -0.01213
|
|
255 15G+4 0.00720 0.00808 -0.01422 0.01579 0.00805
|
|
256 15G-4 -0.00808 -0.01653 0.00063 0.01422 -0.01394
|
|
51 52 53 54 55
|
|
(E)--V (E)--V (A1)--V (A1)--V (E)--V
|
|
Eigenvalues -- 2.15382 2.15382 2.19497 2.28077 2.40417
|
|
1 1 N 1S 0.00000 0.00000 0.03720 -0.01076 0.00000
|
|
2 2S 0.00000 0.00000 -0.09689 -0.03082 0.00000
|
|
3 3S 0.00000 0.00000 -0.14685 -0.15667 0.00000
|
|
4 4S 0.00000 0.00000 -1.97248 -2.22640 0.00000
|
|
5 5S 0.00000 0.00000 18.74439 22.81122 0.00000
|
|
6 6S 0.00000 0.00000 9.51411 15.63944 0.00000
|
|
7 7PX -0.01743 0.00000 0.00000 0.00000 0.00000
|
|
8 7PY 0.00000 -0.01743 0.00000 0.00000 -0.05478
|
|
9 7PZ 0.00000 0.00000 0.04957 -0.02207 0.00000
|
|
10 8PX -0.11070 0.00000 0.00000 0.00000 0.00000
|
|
11 8PY 0.00000 -0.11070 0.00000 0.00000 0.21405
|
|
12 8PZ 0.00000 0.00000 0.06151 0.31496 0.00000
|
|
13 9PX 1.85438 0.00000 0.00000 0.00000 0.00000
|
|
14 9PY 0.00000 1.85438 0.00000 0.00000 -4.01125
|
|
15 9PZ 0.00000 0.00000 -1.10560 -2.55910 0.00000
|
|
16 10PX -2.54484 0.00000 0.00000 0.00000 0.00000
|
|
17 10PY 0.00000 -2.54484 0.00000 0.00000 -4.48593
|
|
18 10PZ 0.00000 0.00000 0.81430 -5.24106 0.00000
|
|
19 11PX -0.55463 0.00000 0.00000 0.00000 0.00000
|
|
20 11PY 0.00000 -0.55463 0.00000 0.00000 -1.14178
|
|
21 11PZ 0.00000 0.00000 -0.50281 -1.49927 0.00000
|
|
22 12D 0 0.00000 0.00000 0.01842 -0.00341 0.00000
|
|
23 12D+1 -0.00434 0.00000 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 -0.00434 0.00000 0.00000 -0.01129
|
|
25 12D+2 0.00000 0.00898 0.00000 0.00000 -0.01646
|
|
26 12D-2 0.00898 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.06593 0.09449 0.00000
|
|
28 13D+1 -0.09891 0.00000 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00000 -0.09891 0.00000 0.00000 -0.01654
|
|
30 13D+2 0.00000 0.03948 0.00000 0.00000 0.00015
|
|
31 13D-2 0.03948 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 -1.23963 -1.11885 0.00000
|
|
33 14D+1 -0.03416 0.00000 0.00000 0.00000 0.00000
|
|
34 14D-1 0.00000 -0.03416 0.00000 0.00000 1.06959
|
|
35 14D+2 0.00000 -1.16975 0.00000 0.00000 1.10728
|
|
36 14D-2 -1.16975 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 -4.04777 -2.34418 0.00000
|
|
38 15D+1 3.51972 0.00000 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 3.51972 0.00000 0.00000 1.42144
|
|
40 15D+2 0.00000 -2.98263 0.00000 0.00000 2.08532
|
|
41 15D-2 -2.98263 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 -0.02221 0.01010 0.00000
|
|
43 16F+1 0.01800 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.01800 0.00000 0.00000 0.00460
|
|
45 16F+2 0.00000 -0.01318 0.00000 0.00000 -0.00397
|
|
46 16F-2 -0.01318 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.03389 0.00055 0.00000
|
|
49 17F 0 0.00000 0.00000 0.21160 0.04645 0.00000
|
|
50 17F+1 -0.11960 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 -0.11960 0.00000 0.00000 -0.02069
|
|
52 17F+2 0.00000 0.12532 0.00000 0.00000 -0.10949
|
|
53 17F-2 0.12532 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 -0.36060 -0.14436 0.00000
|
|
56 18F 0 0.00000 0.00000 -0.15089 1.21174 0.00000
|
|
57 18F+1 -0.84192 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 -0.84192 0.00000 0.00000 -0.72362
|
|
59 18F+2 0.00000 -0.17002 0.00000 0.00000 -1.64930
|
|
60 18F-2 -0.17002 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 -0.91120 -2.40400 0.00000
|
|
63 19G 0 0.00000 0.00000 -0.01842 -0.00969 0.00000
|
|
64 19G+1 0.01110 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.01110 0.00000 0.00000 -0.00855
|
|
66 19G+2 0.00000 -0.01192 0.00000 0.00000 -0.01604
|
|
67 19G-2 -0.01192 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.02143 -0.01243 0.00000
|
|
70 19G+4 0.00000 0.00677 0.00000 0.00000 -0.01472
|
|
71 19G-4 -0.00677 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.24416 0.13126 0.00000
|
|
73 20G+1 -0.03022 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 -0.03022 0.00000 0.00000 0.04837
|
|
75 20G+2 0.00000 0.17064 0.00000 0.00000 0.23753
|
|
76 20G-2 0.17064 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 -0.04180 0.21442 0.00000
|
|
79 20G+4 0.00000 -0.03753 0.00000 0.00000 0.17981
|
|
80 20G-4 0.03753 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 -0.01476 -0.02194 0.00000
|
|
82 21H+1 0.02307 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.02307 0.00000 0.00000 0.02360
|
|
84 21H+2 0.00000 -0.01088 0.00000 0.00000 -0.01381
|
|
85 21H-2 -0.01088 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.03737 0.02327 0.00000
|
|
88 21H+4 0.00000 0.01675 0.00000 0.00000 -0.03480
|
|
89 21H-4 -0.01675 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 -0.01748 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.01748 0.00000 0.00000 -0.00335
|
|
92 2 H 1S 0.00000 -0.00480 -0.00341 0.01470 0.00760
|
|
93 2S 0.00000 0.35040 0.30514 0.30731 -0.38290
|
|
94 3S 0.00000 -0.79729 -3.91286 -6.74051 6.14876
|
|
95 4S 0.00000 -0.53900 -5.78905 -6.99657 4.81802
|
|
96 5S 0.00000 -0.09300 0.11992 -0.29246 0.02058
|
|
97 6PX 0.04146 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 -0.01964 0.00301 -0.01201 -0.02836
|
|
99 6PZ 0.00000 -0.03248 -0.03526 -0.01784 0.01540
|
|
100 7PX -0.23505 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.04298 -0.09027 0.01922 0.26203
|
|
102 7PZ 0.00000 0.21698 0.23694 0.12312 -0.09437
|
|
103 8PX 1.45747 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.01919 1.64221 1.96279 -3.45060
|
|
105 8PZ 0.00000 -1.86809 -2.22695 -1.89395 0.46091
|
|
106 9PX 2.03710 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.71565 1.94871 3.41487 -2.20823
|
|
108 9PZ 0.00000 -1.90465 -2.62775 -1.39746 1.30446
|
|
109 10D 0 0.00000 -0.01237 -0.00627 0.02487 0.04344
|
|
110 10D+1 0.02798 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 -0.01801 -0.01411 -0.01685 -0.01406
|
|
112 10D+2 0.00000 0.00380 -0.02362 0.00410 0.02516
|
|
113 10D-2 0.01413 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.03532 0.01755 -0.10939 -0.32421
|
|
115 11D+1 -0.10727 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.16897 0.19887 0.19756 0.09206
|
|
117 11D+2 0.00000 -0.00598 0.18830 0.06313 -0.23648
|
|
118 11D-2 -0.09207 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 -0.92125 -0.44485 0.43957 -0.12996
|
|
120 12D+1 0.79689 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 1.46579 1.66409 0.97793 -1.21476
|
|
122 12D+2 0.00000 0.59551 0.19356 1.10147 -1.52161
|
|
123 12D-2 -0.95400 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00207 0.00563 0.00081 0.00143
|
|
125 13F+1 0.00639 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00618 0.01073 0.00169 0.01614
|
|
127 13F+2 0.00000 0.00262 0.01029 0.01190 0.00329
|
|
128 13F-2 -0.01440 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 -0.00400 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00746 -0.00729 0.00556 0.00217
|
|
131 14F 0 0.00000 0.09649 0.11810 0.08207 -0.12578
|
|
132 14F+1 -0.04247 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.16655 0.12808 0.07369 0.10485
|
|
134 14F+2 0.00000 0.19986 0.20206 0.08985 -0.11437
|
|
135 14F-2 -0.03710 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 -0.13967 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 -0.08220 -0.02900 -0.13280 0.22321
|
|
138 15G 0 0.00000 0.01258 0.01263 0.00551 -0.00270
|
|
139 15G+1 -0.00345 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 -0.00125 -0.00494 -0.00562 0.01142
|
|
141 15G+2 0.00000 0.01382 0.01570 0.00388 0.00368
|
|
142 15G-2 -0.00332 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 -0.01139 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 -0.01055 -0.00997 -0.00563 0.00227
|
|
145 15G+4 0.00000 -0.00223 0.00044 -0.00713 0.01187
|
|
146 15G-4 0.00941 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00416 0.00240 -0.00341 0.01470 -0.00380
|
|
148 2S 0.30345 -0.17520 0.30514 0.30731 0.19145
|
|
149 3S -0.69047 0.39865 -3.91286 -6.74051 -3.07438
|
|
150 4S -0.46679 0.26950 -5.78905 -6.99657 -2.40901
|
|
151 5S -0.08054 0.04650 0.11992 -0.29246 -0.01029
|
|
152 6PX -0.00437 0.02646 0.00261 -0.01040 0.00679
|
|
153 6PY 0.02646 0.02618 -0.00151 0.00601 -0.01659
|
|
154 6PZ -0.02813 0.01624 -0.03526 -0.01784 -0.00770
|
|
155 7PX -0.02653 -0.12039 -0.07818 0.01664 -0.07662
|
|
156 7PY -0.12039 -0.16554 0.04514 -0.00961 0.12932
|
|
157 7PZ 0.18791 -0.10849 0.23694 0.12312 0.04718
|
|
158 8PX 0.37876 0.62279 1.42220 1.69983 1.02705
|
|
159 8PY 0.62279 1.09790 -0.82111 -0.98140 -1.67170
|
|
160 8PZ -1.61782 0.93405 -2.22695 -1.89395 -0.23046
|
|
161 9PX 1.04601 0.57221 1.68764 2.95736 1.10679
|
|
162 9PY 0.57221 1.70674 -0.97436 -1.70743 -0.29121
|
|
163 9PZ -1.64947 0.95232 -2.62775 -1.39746 -0.65223
|
|
164 10D 0 -0.01071 0.00619 -0.00627 0.02487 -0.02172
|
|
165 10D+1 -0.00651 0.01992 -0.01222 -0.01459 0.01145
|
|
166 10D-1 0.01992 0.01648 0.00706 0.00842 0.00577
|
|
167 10D+2 0.00447 0.01155 0.01181 -0.00205 -0.02894
|
|
168 10D-2 0.00639 0.00447 -0.02046 0.00355 -0.03123
|
|
169 11D 0 0.03059 -0.01766 0.01755 -0.10939 0.16211
|
|
170 11D+1 0.09991 -0.11961 0.17223 0.17109 -0.07982
|
|
171 11D-1 -0.11961 -0.03821 -0.09944 -0.09878 -0.04620
|
|
172 11D+2 -0.03728 -0.07055 -0.09415 -0.03156 0.17598
|
|
173 11D-2 -0.02750 -0.03728 0.16308 0.05467 0.23813
|
|
174 12D 0 -0.79782 0.46062 -0.44485 0.43957 0.06498
|
|
175 12D+1 1.29857 -0.28964 1.44114 0.84691 0.55996
|
|
176 12D-1 -0.28964 0.96412 -0.83204 -0.48897 -0.24489
|
|
177 12D+2 -0.67096 -0.56662 -0.09678 -0.55074 -0.68307
|
|
178 12D-2 0.20813 -0.67096 0.16763 0.95390 0.48413
|
|
179 13F 0 0.00179 -0.00103 0.00563 0.00081 -0.00072
|
|
180 13F+1 0.00623 0.00009 0.00929 0.00147 -0.00472
|
|
181 13F-1 0.00009 0.00634 -0.00536 -0.00085 0.00796
|
|
182 13F+2 -0.00737 -0.01014 -0.00515 -0.00595 0.00661
|
|
183 13F-2 -0.00164 -0.00737 0.00891 0.01031 0.00191
|
|
184 13F+3 0.00200 0.00347 0.00000 0.00000 -0.00712
|
|
185 13F-3 0.00646 -0.00373 -0.00729 0.00556 -0.00109
|
|
186 14F 0 0.08356 -0.04825 0.11810 0.08207 0.06289
|
|
187 14F+1 0.11429 -0.09051 0.11092 0.06382 -0.04554
|
|
188 14F-1 -0.09051 0.00978 -0.06404 -0.03685 0.02598
|
|
189 14F+2 -0.10261 0.02214 -0.10103 -0.04492 -0.02468
|
|
190 14F-2 0.14062 -0.10261 0.17499 0.07781 0.05178
|
|
191 14F+3 0.06983 0.12096 0.00000 0.00000 -0.07385
|
|
192 14F-3 -0.07119 0.04110 -0.02900 -0.13280 -0.11160
|
|
193 15G 0 0.01090 -0.00629 0.01263 0.00551 0.00135
|
|
194 15G+1 -0.00180 -0.00096 -0.00428 -0.00486 -0.00549
|
|
195 15G-1 -0.00096 -0.00290 0.00247 0.00281 0.00190
|
|
196 15G+2 -0.00742 0.00096 -0.00785 -0.00194 -0.00226
|
|
197 15G-2 0.00953 -0.00742 0.01360 0.00336 -0.00343
|
|
198 15G+3 0.00570 0.00987 0.00000 0.00000 0.00047
|
|
199 15G-3 -0.00913 0.00527 -0.00997 -0.00563 -0.00114
|
|
200 15G+4 -0.00311 -0.00762 -0.00022 0.00357 0.00583
|
|
201 15G-4 0.00403 0.00311 -0.00038 0.00618 0.00349
|
|
202 4 H 1S 0.00416 0.00240 -0.00341 0.01470 -0.00380
|
|
203 2S -0.30345 -0.17520 0.30514 0.30731 0.19145
|
|
204 3S 0.69047 0.39865 -3.91286 -6.74051 -3.07438
|
|
205 4S 0.46679 0.26950 -5.78905 -6.99657 -2.40901
|
|
206 5S 0.08054 0.04650 0.11992 -0.29246 -0.01029
|
|
207 6PX -0.00437 -0.02646 -0.00261 0.01040 -0.00679
|
|
208 6PY -0.02646 0.02618 -0.00151 0.00601 -0.01659
|
|
209 6PZ 0.02813 0.01624 -0.03526 -0.01784 -0.00770
|
|
210 7PX -0.02653 0.12039 0.07818 -0.01664 0.07662
|
|
211 7PY 0.12039 -0.16554 0.04514 -0.00961 0.12932
|
|
212 7PZ -0.18791 -0.10849 0.23694 0.12312 0.04718
|
|
213 8PX 0.37876 -0.62279 -1.42220 -1.69983 -1.02705
|
|
214 8PY -0.62279 1.09790 -0.82111 -0.98140 -1.67170
|
|
215 8PZ 1.61782 0.93405 -2.22695 -1.89395 -0.23046
|
|
216 9PX 1.04601 -0.57221 -1.68764 -2.95736 -1.10679
|
|
217 9PY -0.57221 1.70674 -0.97436 -1.70743 -0.29121
|
|
218 9PZ 1.64947 0.95232 -2.62775 -1.39746 -0.65223
|
|
219 10D 0 0.01071 0.00619 -0.00627 0.02487 -0.02172
|
|
220 10D+1 -0.00651 -0.01992 0.01222 0.01459 -0.01145
|
|
221 10D-1 -0.01992 0.01648 0.00706 0.00842 0.00577
|
|
222 10D+2 -0.00447 0.01155 0.01181 -0.00205 -0.02894
|
|
223 10D-2 0.00639 -0.00447 0.02046 -0.00355 0.03123
|
|
224 11D 0 -0.03059 -0.01766 0.01755 -0.10939 0.16211
|
|
225 11D+1 0.09991 0.11961 -0.17223 -0.17109 0.07982
|
|
226 11D-1 0.11961 -0.03821 -0.09944 -0.09878 -0.04620
|
|
227 11D+2 0.03728 -0.07055 -0.09415 -0.03156 0.17598
|
|
228 11D-2 -0.02750 0.03728 -0.16308 -0.05467 -0.23813
|
|
229 12D 0 0.79782 0.46062 -0.44485 0.43957 0.06498
|
|
230 12D+1 1.29857 0.28964 -1.44114 -0.84691 -0.55996
|
|
231 12D-1 0.28964 0.96412 -0.83204 -0.48897 -0.24489
|
|
232 12D+2 0.67096 -0.56662 -0.09678 -0.55074 -0.68307
|
|
233 12D-2 0.20813 0.67096 -0.16763 -0.95390 -0.48413
|
|
234 13F 0 -0.00179 -0.00103 0.00563 0.00081 -0.00072
|
|
235 13F+1 0.00623 -0.00009 -0.00929 -0.00147 0.00472
|
|
236 13F-1 -0.00009 0.00634 -0.00536 -0.00085 0.00796
|
|
237 13F+2 0.00737 -0.01014 -0.00515 -0.00595 0.00661
|
|
238 13F-2 -0.00164 0.00737 -0.00891 -0.01031 -0.00191
|
|
239 13F+3 0.00200 -0.00347 0.00000 0.00000 0.00712
|
|
240 13F-3 -0.00646 -0.00373 -0.00729 0.00556 -0.00109
|
|
241 14F 0 -0.08356 -0.04825 0.11810 0.08207 0.06289
|
|
242 14F+1 0.11429 0.09051 -0.11092 -0.06382 0.04554
|
|
243 14F-1 0.09051 0.00978 -0.06404 -0.03685 0.02598
|
|
244 14F+2 0.10261 0.02214 -0.10103 -0.04492 -0.02468
|
|
245 14F-2 0.14062 0.10261 -0.17499 -0.07781 -0.05178
|
|
246 14F+3 0.06983 -0.12096 0.00000 0.00000 0.07385
|
|
247 14F-3 0.07119 0.04110 -0.02900 -0.13280 -0.11160
|
|
248 15G 0 -0.01090 -0.00629 0.01263 0.00551 0.00135
|
|
249 15G+1 -0.00180 0.00096 0.00428 0.00486 0.00549
|
|
250 15G-1 0.00096 -0.00290 0.00247 0.00281 0.00190
|
|
251 15G+2 0.00742 0.00096 -0.00785 -0.00194 -0.00226
|
|
252 15G-2 0.00953 0.00742 -0.01360 -0.00336 0.00343
|
|
253 15G+3 0.00570 -0.00987 0.00000 0.00000 -0.00047
|
|
254 15G-3 0.00913 0.00527 -0.00997 -0.00563 -0.00114
|
|
255 15G+4 0.00311 -0.00762 -0.00022 0.00357 0.00583
|
|
256 15G-4 0.00403 -0.00311 0.00038 -0.00618 -0.00349
|
|
56 57 58 59 60
|
|
(E)--V (A2)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 2.40417 2.57606 2.60340 2.60340 2.69301
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 -0.01609
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 0.03449
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 -0.00862
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 0.13236
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 1.40573
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 -0.54340
|
|
7 7PX -0.05478 0.00000 0.00000 -0.00991 0.00000
|
|
8 7PY 0.00000 0.00000 -0.00991 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.05307
|
|
10 8PX 0.21405 0.00000 0.00000 -0.29509 0.00000
|
|
11 8PY 0.00000 0.00000 -0.29509 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.05189
|
|
13 9PX -4.01125 0.00000 0.00000 2.84166 0.00000
|
|
14 9PY 0.00000 0.00000 2.84166 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 -0.87527
|
|
16 10PX -4.48593 0.00000 0.00000 -1.48580 0.00000
|
|
17 10PY 0.00000 0.00000 -1.48580 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 -0.00348
|
|
19 11PX -1.14178 0.00000 0.00000 0.07115 0.00000
|
|
20 11PY 0.00000 0.00000 0.07115 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.43824
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.01044
|
|
23 12D+1 -0.01129 0.00000 0.00000 -0.00800 0.00000
|
|
24 12D-1 0.00000 0.00000 -0.00800 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.01186 0.00000 0.00000
|
|
26 12D-2 -0.01646 0.00000 0.00000 0.01186 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.04950
|
|
28 13D+1 -0.01654 0.00000 0.00000 0.01491 0.00000
|
|
29 13D-1 0.00000 0.00000 0.01491 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.04290 0.00000 0.00000
|
|
31 13D-2 0.00015 0.00000 0.00000 0.04290 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.60689
|
|
33 14D+1 1.06959 0.00000 0.00000 -1.03040 0.00000
|
|
34 14D-1 0.00000 0.00000 -1.03040 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 -1.33232 0.00000 0.00000
|
|
36 14D-2 1.10728 0.00000 0.00000 -1.33232 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 -1.44683
|
|
38 15D+1 1.42144 0.00000 0.00000 1.78385 0.00000
|
|
39 15D-1 0.00000 0.00000 1.78385 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 -1.50839 0.00000 0.00000
|
|
41 15D-2 2.08532 0.00000 0.00000 -1.50839 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.05135
|
|
43 16F+1 0.00460 0.00000 0.00000 -0.03212 0.00000
|
|
44 16F-1 0.00000 0.00000 -0.03212 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 -0.00168 0.00000 0.00000
|
|
46 16F-2 -0.00397 0.00000 0.00000 -0.00168 0.00000
|
|
47 16F+3 0.00000 0.01363 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.01377
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 -0.23117
|
|
50 17F+1 -0.02069 0.00000 0.00000 0.11636 0.00000
|
|
51 17F-1 0.00000 0.00000 0.11636 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.11752 0.00000 0.00000
|
|
53 17F-2 -0.10949 0.00000 0.00000 0.11752 0.00000
|
|
54 17F+3 0.00000 -0.05562 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 -0.03202
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 2.05053
|
|
57 18F+1 -0.72362 0.00000 0.00000 -1.22537 0.00000
|
|
58 18F-1 0.00000 0.00000 -1.22537 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 1.67162 0.00000 0.00000
|
|
60 18F-2 -1.64930 0.00000 0.00000 1.67162 0.00000
|
|
61 18F+3 0.00000 0.96791 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 1.83564
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.01181
|
|
64 19G+1 -0.00855 0.00000 0.00000 0.00073 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00073 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.01155 0.00000 0.00000
|
|
67 19G-2 -0.01604 0.00000 0.00000 0.01155 0.00000
|
|
68 19G+3 0.00000 0.01196 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00521
|
|
70 19G+4 0.00000 0.00000 0.00509 0.00000 0.00000
|
|
71 19G-4 0.01472 0.00000 0.00000 -0.00509 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 -0.21339
|
|
73 20G+1 0.04837 0.00000 0.00000 0.07205 0.00000
|
|
74 20G-1 0.00000 0.00000 0.07205 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 -0.07141 0.00000 0.00000
|
|
76 20G-2 0.23753 0.00000 0.00000 -0.07141 0.00000
|
|
77 20G+3 0.00000 -0.19438 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 -0.04167
|
|
79 20G+4 0.00000 0.00000 -0.02537 0.00000 0.00000
|
|
80 20G-4 -0.17981 0.00000 0.00000 0.02537 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00641
|
|
82 21H+1 0.02360 0.00000 0.00000 0.01397 0.00000
|
|
83 21H-1 0.00000 0.00000 0.01397 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 -0.02229 0.00000 0.00000
|
|
85 21H-2 -0.01381 0.00000 0.00000 -0.02229 0.00000
|
|
86 21H+3 0.00000 0.02272 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 -0.03559
|
|
88 21H+4 0.00000 0.00000 0.01057 0.00000 0.00000
|
|
89 21H-4 0.03480 0.00000 0.00000 -0.01057 0.00000
|
|
90 21H+5 0.00335 0.00000 0.00000 -0.02245 0.00000
|
|
91 21H-5 0.00000 0.00000 0.02245 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.02401 0.00000 -0.01346
|
|
93 2S 0.00000 0.00000 0.23979 0.00000 -0.01766
|
|
94 3S 0.00000 0.00000 -2.56706 0.00000 -0.23507
|
|
95 4S 0.00000 0.00000 -2.75204 0.00000 -0.10218
|
|
96 5S 0.00000 0.00000 -0.25810 0.00000 0.09091
|
|
97 6PX -0.01267 -0.01851 0.00000 0.03867 0.00000
|
|
98 6PY 0.00000 0.00000 -0.01385 0.00000 0.02052
|
|
99 6PZ 0.00000 0.00000 0.00474 0.00000 -0.00466
|
|
100 7PX 0.08509 0.06286 0.00000 -0.23234 0.00000
|
|
101 7PY 0.00000 0.00000 0.03970 0.00000 -0.12774
|
|
102 7PZ 0.00000 0.00000 0.01566 0.00000 -0.00007
|
|
103 8PX -1.07873 0.23564 0.00000 1.69930 0.00000
|
|
104 8PY 0.00000 0.00000 1.46510 0.00000 0.63530
|
|
105 8PZ 0.00000 0.00000 -1.01514 0.00000 0.49113
|
|
106 9PX 0.34779 -1.23681 0.00000 1.42552 0.00000
|
|
107 9PY 0.00000 0.00000 2.61943 0.00000 -0.17870
|
|
108 9PZ 0.00000 0.00000 -0.47462 0.00000 -0.43164
|
|
109 10D 0 0.00000 0.00000 0.03518 0.00000 -0.00514
|
|
110 10D+1 0.01238 0.00463 0.00000 -0.02745 0.00000
|
|
111 10D-1 0.00000 0.00000 -0.04635 0.00000 0.03144
|
|
112 10D+2 0.00000 0.00000 0.00099 0.00000 -0.01814
|
|
113 10D-2 -0.04697 0.06660 0.00000 0.02140 0.00000
|
|
114 11D 0 0.00000 0.00000 -0.14231 0.00000 0.04576
|
|
115 11D+1 -0.09228 -0.00534 0.00000 0.16459 0.00000
|
|
116 11D-1 0.00000 0.00000 0.33259 0.00000 -0.22833
|
|
117 11D+2 0.00000 0.00000 0.09908 0.00000 0.10224
|
|
118 11D-2 0.31347 -0.42692 0.00000 -0.12159 0.00000
|
|
119 12D 0 0.00000 0.00000 1.21321 0.00000 0.94618
|
|
120 12D+1 0.07840 0.23998 0.00000 -0.66829 0.00000
|
|
121 12D-1 0.00000 0.00000 0.24863 0.00000 0.53873
|
|
122 12D+2 0.00000 0.00000 1.31208 0.00000 -0.51458
|
|
123 12D-2 -0.40356 1.52984 0.00000 -1.22304 0.00000
|
|
124 13F 0 0.00000 0.00000 -0.00130 0.00000 -0.00873
|
|
125 13F+1 0.00524 -0.00189 0.00000 0.01013 0.00000
|
|
126 13F-1 0.00000 0.00000 -0.00181 0.00000 0.00075
|
|
127 13F+2 0.00000 0.00000 -0.00222 0.00000 -0.00626
|
|
128 13F-2 0.00771 0.00003 0.00000 -0.01071 0.00000
|
|
129 13F+3 0.00822 -0.01608 0.00000 0.00545 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00069 0.00000 -0.01776
|
|
131 14F 0 0.00000 0.00000 0.14751 0.00000 0.07391
|
|
132 14F+1 -0.00031 -0.01120 0.00000 -0.11682 0.00000
|
|
133 14F-1 0.00000 0.00000 -0.04380 0.00000 -0.19017
|
|
134 14F+2 0.00000 0.00000 0.17013 0.00000 -0.01217
|
|
135 14F-2 0.00521 -0.00573 0.00000 0.02140 0.00000
|
|
136 14F+3 0.08527 0.04754 0.00000 -0.23230 0.00000
|
|
137 14F-3 0.00000 0.00000 -0.16617 0.00000 0.13608
|
|
138 15G 0 0.00000 0.00000 -0.00142 0.00000 -0.00853
|
|
139 15G+1 -0.00127 -0.00119 0.00000 0.00054 0.00000
|
|
140 15G-1 0.00000 0.00000 -0.01021 0.00000 -0.00468
|
|
141 15G+2 0.00000 0.00000 -0.00654 0.00000 -0.00618
|
|
142 15G-2 -0.00424 0.00197 0.00000 0.00517 0.00000
|
|
143 15G+3 -0.00054 0.00688 0.00000 -0.00155 0.00000
|
|
144 15G-3 0.00000 0.00000 -0.00405 0.00000 -0.00171
|
|
145 15G+4 0.00000 0.00000 -0.00820 0.00000 0.00559
|
|
146 15G-4 -0.00381 -0.00494 0.00000 0.01301 0.00000
|
|
147 3 H 1S 0.00658 0.00000 -0.01200 0.02079 -0.01346
|
|
148 2S -0.33160 0.00000 -0.11989 0.20766 -0.01766
|
|
149 3S 5.32498 0.00000 1.28353 -2.22314 -0.23507
|
|
150 4S 4.17252 0.00000 1.37602 -2.38333 -0.10218
|
|
151 5S 0.01783 0.00000 0.12905 -0.22352 0.09091
|
|
152 6PX -0.02444 0.00926 0.02274 -0.00072 0.01777
|
|
153 6PY 0.00679 0.01603 0.02554 0.02274 -0.01026
|
|
154 6PZ 0.01333 0.00000 -0.00237 0.00411 -0.00466
|
|
155 7PX 0.21780 -0.03143 -0.11780 -0.02831 -0.11063
|
|
156 7PY -0.07662 -0.05444 -0.16433 -0.11780 0.06387
|
|
157 7PZ -0.08172 0.00000 -0.00783 0.01356 -0.00007
|
|
158 8PX -2.85763 -0.11782 0.10141 1.52365 0.55019
|
|
159 8PY 1.02705 -0.20407 1.64075 0.10141 -0.31765
|
|
160 8PZ 0.39916 0.00000 0.50757 -0.87914 0.49113
|
|
161 9PX -1.56922 0.61840 -0.51697 2.32095 -0.15476
|
|
162 9PY 1.10679 1.07111 1.72400 -0.51697 0.08935
|
|
163 9PZ 1.12970 0.00000 0.23731 -0.41103 -0.43164
|
|
164 10D 0 0.03762 0.00000 -0.01759 0.03047 -0.00514
|
|
165 10D+1 -0.00745 -0.00231 0.00818 -0.04162 0.02723
|
|
166 10D-1 0.01145 -0.00401 -0.03218 0.00818 -0.01572
|
|
167 10D+2 -0.03123 -0.05767 0.01629 0.00883 0.00907
|
|
168 10D-2 0.00713 -0.03330 0.00883 0.00609 -0.01571
|
|
169 11D 0 -0.28078 0.00000 0.07116 -0.12325 0.04576
|
|
170 11D+1 0.04597 0.00267 -0.07275 0.29059 -0.19774
|
|
171 11D-1 -0.07982 0.00462 0.20659 -0.07275 0.11416
|
|
172 11D+2 0.23813 0.36972 -0.06642 -0.09555 -0.05112
|
|
173 11D-2 -0.09899 0.21346 -0.09555 0.04391 0.08854
|
|
174 12D 0 -0.11255 0.00000 -0.60661 1.05067 0.94618
|
|
175 12D+1 -0.89147 -0.11999 -0.39704 0.01940 0.46655
|
|
176 12D-1 0.55996 -0.20783 -0.43906 -0.39704 -0.26936
|
|
177 12D+2 0.48413 -1.32488 -0.58926 -1.09774 0.25729
|
|
178 12D-2 -1.24210 -0.76492 -1.09774 0.67830 -0.44564
|
|
179 13F 0 0.00124 0.00000 0.00065 -0.00112 -0.00873
|
|
180 13F+1 0.01341 0.00095 0.00517 0.00118 0.00065
|
|
181 13F-1 -0.00472 0.00164 0.00714 0.00517 -0.00038
|
|
182 13F+2 0.00191 -0.00003 -0.00859 -0.00368 0.00313
|
|
183 13F-2 0.00440 -0.00002 -0.00368 -0.00434 -0.00542
|
|
184 13F+3 -0.00411 -0.01608 -0.00472 -0.00273 0.00000
|
|
185 13F-3 0.00188 0.00000 -0.00034 0.00060 -0.01776
|
|
186 14F 0 -0.10893 0.00000 -0.07375 0.12775 0.07391
|
|
187 14F+1 0.07856 0.00560 -0.03162 -0.06205 -0.16469
|
|
188 14F-1 -0.04554 0.00970 -0.09857 -0.03162 0.09508
|
|
189 14F+2 0.05178 0.00496 0.05858 -0.06440 0.00609
|
|
190 14F-2 -0.08448 0.00287 -0.06440 0.13295 -0.01054
|
|
191 14F+3 -0.04263 0.04754 0.20118 0.11615 0.00000
|
|
192 14F-3 0.19331 0.00000 0.08308 -0.14391 0.13608
|
|
193 15G 0 -0.00234 0.00000 0.00071 -0.00123 -0.00853
|
|
194 15G+1 0.00825 0.00060 0.00466 -0.00752 -0.00406
|
|
195 15G-1 -0.00549 0.00103 -0.00214 0.00466 0.00234
|
|
196 15G+2 -0.00343 -0.00171 0.00224 0.00507 0.00309
|
|
197 15G-2 0.00170 -0.00099 0.00507 -0.00361 -0.00535
|
|
198 15G+3 0.00027 0.00688 0.00134 0.00077 0.00000
|
|
199 15G-3 0.00197 0.00000 0.00202 -0.00351 -0.00171
|
|
200 15G+4 -0.00349 -0.00428 -0.01181 -0.00208 -0.00279
|
|
201 15G-4 -0.00986 0.00247 0.00208 0.00940 -0.00484
|
|
202 4 H 1S -0.00658 0.00000 -0.01200 -0.02079 -0.01346
|
|
203 2S 0.33160 0.00000 -0.11989 -0.20766 -0.01766
|
|
204 3S -5.32498 0.00000 1.28353 2.22314 -0.23507
|
|
205 4S -4.17252 0.00000 1.37602 2.38333 -0.10218
|
|
206 5S -0.01783 0.00000 0.12905 0.22352 0.09091
|
|
207 6PX -0.02444 0.00926 -0.02274 -0.00072 -0.01777
|
|
208 6PY -0.00679 -0.01603 0.02554 -0.02274 -0.01026
|
|
209 6PZ -0.01333 0.00000 -0.00237 -0.00411 -0.00466
|
|
210 7PX 0.21780 -0.03143 0.11780 -0.02831 0.11063
|
|
211 7PY 0.07662 0.05444 -0.16433 0.11780 0.06387
|
|
212 7PZ 0.08172 0.00000 -0.00783 -0.01356 -0.00007
|
|
213 8PX -2.85763 -0.11782 -0.10141 1.52365 -0.55019
|
|
214 8PY -1.02705 0.20407 1.64075 -0.10141 -0.31765
|
|
215 8PZ -0.39916 0.00000 0.50757 0.87914 0.49113
|
|
216 9PX -1.56922 0.61840 0.51697 2.32095 0.15476
|
|
217 9PY -1.10679 -1.07111 1.72400 0.51697 0.08935
|
|
218 9PZ -1.12970 0.00000 0.23731 0.41103 -0.43164
|
|
219 10D 0 -0.03762 0.00000 -0.01759 -0.03047 -0.00514
|
|
220 10D+1 -0.00745 -0.00231 -0.00818 -0.04162 -0.02723
|
|
221 10D-1 -0.01145 0.00401 -0.03218 -0.00818 -0.01572
|
|
222 10D+2 0.03123 0.05767 0.01629 -0.00883 0.00907
|
|
223 10D-2 0.00713 -0.03330 -0.00883 0.00609 0.01571
|
|
224 11D 0 0.28078 0.00000 0.07116 0.12325 0.04576
|
|
225 11D+1 0.04597 0.00267 0.07275 0.29059 0.19774
|
|
226 11D-1 0.07982 -0.00462 0.20659 0.07275 0.11416
|
|
227 11D+2 -0.23813 -0.36972 -0.06642 0.09555 -0.05112
|
|
228 11D-2 -0.09899 0.21346 0.09555 0.04391 -0.08854
|
|
229 12D 0 0.11255 0.00000 -0.60661 -1.05067 0.94618
|
|
230 12D+1 -0.89147 -0.11999 0.39704 0.01940 -0.46655
|
|
231 12D-1 -0.55996 0.20783 -0.43906 0.39704 -0.26936
|
|
232 12D+2 -0.48413 1.32488 -0.58926 1.09774 0.25729
|
|
233 12D-2 -1.24210 -0.76492 1.09774 0.67830 0.44564
|
|
234 13F 0 -0.00124 0.00000 0.00065 0.00112 -0.00873
|
|
235 13F+1 0.01341 0.00095 -0.00517 0.00118 -0.00065
|
|
236 13F-1 0.00472 -0.00164 0.00714 -0.00517 -0.00038
|
|
237 13F+2 -0.00191 0.00003 -0.00859 0.00368 0.00313
|
|
238 13F-2 0.00440 -0.00002 0.00368 -0.00434 0.00542
|
|
239 13F+3 -0.00411 -0.01608 0.00472 -0.00273 0.00000
|
|
240 13F-3 -0.00188 0.00000 -0.00034 -0.00060 -0.01776
|
|
241 14F 0 0.10893 0.00000 -0.07375 -0.12775 0.07391
|
|
242 14F+1 0.07856 0.00560 0.03162 -0.06205 0.16469
|
|
243 14F-1 0.04554 -0.00970 -0.09857 0.03162 0.09508
|
|
244 14F+2 -0.05178 -0.00496 0.05858 0.06440 0.00609
|
|
245 14F-2 -0.08448 0.00287 0.06440 0.13295 0.01054
|
|
246 14F+3 -0.04263 0.04754 -0.20118 0.11615 0.00000
|
|
247 14F-3 -0.19331 0.00000 0.08308 0.14391 0.13608
|
|
248 15G 0 0.00234 0.00000 0.00071 0.00123 -0.00853
|
|
249 15G+1 0.00825 0.00060 -0.00466 -0.00752 0.00406
|
|
250 15G-1 0.00549 -0.00103 -0.00214 -0.00466 0.00234
|
|
251 15G+2 0.00343 0.00171 0.00224 -0.00507 0.00309
|
|
252 15G-2 0.00170 -0.00099 -0.00507 -0.00361 0.00535
|
|
253 15G+3 0.00027 0.00688 -0.00134 0.00077 0.00000
|
|
254 15G-3 -0.00197 0.00000 0.00202 0.00351 -0.00171
|
|
255 15G+4 0.00349 0.00428 -0.01181 0.00208 -0.00279
|
|
256 15G-4 -0.00986 0.00247 -0.00208 0.00940 0.00484
|
|
61 62 63 64 65
|
|
(E)--V (E)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 2.71546 2.71546 2.77194 2.86596 2.86596
|
|
1 1 N 1S 0.00000 0.00000 0.07289 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 -0.22026 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 -0.13091 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 -6.47396 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 30.16146 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 10.24602 0.00000 0.00000
|
|
7 7PX 0.00000 0.09081 0.00000 -0.11559 0.00000
|
|
8 7PY 0.09081 0.00000 0.00000 0.00000 -0.11559
|
|
9 7PZ 0.00000 0.00000 -0.05271 0.00000 0.00000
|
|
10 8PX 0.00000 -0.33486 0.00000 -0.28619 0.00000
|
|
11 8PY -0.33486 0.00000 0.00000 0.00000 -0.28619
|
|
12 8PZ 0.00000 0.00000 0.64495 0.00000 0.00000
|
|
13 9PX 0.00000 1.42485 0.00000 -2.01071 0.00000
|
|
14 9PY 1.42485 0.00000 0.00000 0.00000 -2.01071
|
|
15 9PZ 0.00000 0.00000 -4.43732 0.00000 0.00000
|
|
16 10PX 0.00000 16.61629 0.00000 8.91585 0.00000
|
|
17 10PY 16.61629 0.00000 0.00000 0.00000 8.91585
|
|
18 10PZ 0.00000 0.00000 -8.12524 0.00000 0.00000
|
|
19 11PX 0.00000 0.33358 0.00000 1.63423 0.00000
|
|
20 11PY 0.33358 0.00000 0.00000 0.00000 1.63423
|
|
21 11PZ 0.00000 0.00000 -0.28485 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00069 0.00000 0.00000
|
|
23 12D+1 0.00000 -0.01537 0.00000 -0.00369 0.00000
|
|
24 12D-1 -0.01537 0.00000 0.00000 0.00000 -0.00369
|
|
25 12D+2 -0.00966 0.00000 0.00000 0.00000 -0.02322
|
|
26 12D-2 0.00000 -0.00966 0.00000 -0.02322 0.00000
|
|
27 13D 0 0.00000 0.00000 0.05872 0.00000 0.00000
|
|
28 13D+1 0.00000 0.06816 0.00000 0.07174 0.00000
|
|
29 13D-1 0.06816 0.00000 0.00000 0.00000 0.07174
|
|
30 13D+2 0.07946 0.00000 0.00000 0.00000 0.12737
|
|
31 13D-2 0.00000 0.07946 0.00000 0.12737 0.00000
|
|
32 14D 0 0.00000 0.00000 -1.70494 0.00000 0.00000
|
|
33 14D+1 0.00000 -0.69093 0.00000 -0.44533 0.00000
|
|
34 14D-1 -0.69093 0.00000 0.00000 0.00000 -0.44533
|
|
35 14D+2 -0.69436 0.00000 0.00000 0.00000 -1.05950
|
|
36 14D-2 0.00000 -0.69436 0.00000 -1.05950 0.00000
|
|
37 15D 0 0.00000 0.00000 -1.86451 0.00000 0.00000
|
|
38 15D+1 0.00000 -2.63132 0.00000 -4.26810 0.00000
|
|
39 15D-1 -2.63132 0.00000 0.00000 0.00000 -4.26810
|
|
40 15D+2 -3.13932 0.00000 0.00000 0.00000 -4.24229
|
|
41 15D-2 0.00000 -3.13932 0.00000 -4.24229 0.00000
|
|
42 16F 0 0.00000 0.00000 -0.04457 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00946 0.00000 -0.00458 0.00000
|
|
44 16F-1 0.00946 0.00000 0.00000 0.00000 -0.00458
|
|
45 16F+2 0.01893 0.00000 0.00000 0.00000 -0.01034
|
|
46 16F-2 0.00000 0.01893 0.00000 -0.01034 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.07343 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.51486 0.00000 0.00000
|
|
50 17F+1 0.00000 -0.08897 0.00000 0.04717 0.00000
|
|
51 17F-1 -0.08897 0.00000 0.00000 0.00000 0.04717
|
|
52 17F+2 -0.06957 0.00000 0.00000 0.00000 0.11107
|
|
53 17F-2 0.00000 -0.06957 0.00000 0.11107 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 -0.76457 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 2.03194 0.00000 0.00000
|
|
57 18F+1 0.00000 -2.26361 0.00000 0.90613 0.00000
|
|
58 18F-1 -2.26361 0.00000 0.00000 0.00000 0.90613
|
|
59 18F+2 0.32120 0.00000 0.00000 0.00000 2.31547
|
|
60 18F-2 0.00000 0.32120 0.00000 2.31547 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 -1.35168 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00071 0.00000 0.00000
|
|
64 19G+1 0.00000 -0.01314 0.00000 0.00220 0.00000
|
|
65 19G-1 -0.01314 0.00000 0.00000 0.00000 0.00220
|
|
66 19G+2 -0.01358 0.00000 0.00000 0.00000 0.01580
|
|
67 19G-2 0.00000 -0.01358 0.00000 0.01580 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.04540 0.00000 0.00000
|
|
70 19G+4 -0.01954 0.00000 0.00000 0.00000 0.00906
|
|
71 19G-4 0.00000 0.01954 0.00000 -0.00906 0.00000
|
|
72 20G 0 0.00000 0.00000 -0.17428 0.00000 0.00000
|
|
73 20G+1 0.00000 0.29858 0.00000 0.05626 0.00000
|
|
74 20G-1 0.29858 0.00000 0.00000 0.00000 0.05626
|
|
75 20G+2 0.23762 0.00000 0.00000 0.00000 -0.24785
|
|
76 20G-2 0.00000 0.23762 0.00000 -0.24785 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.39604 0.00000 0.00000
|
|
79 20G+4 0.45068 0.00000 0.00000 0.00000 -0.10851
|
|
80 20G-4 0.00000 -0.45068 0.00000 0.10851 0.00000
|
|
81 21H 0 0.00000 0.00000 -0.02237 0.00000 0.00000
|
|
82 21H+1 0.00000 0.01166 0.00000 -0.03703 0.00000
|
|
83 21H-1 0.01166 0.00000 0.00000 0.00000 -0.03703
|
|
84 21H+2 -0.03073 0.00000 0.00000 0.00000 -0.01316
|
|
85 21H-2 0.00000 -0.03073 0.00000 -0.01316 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 -0.02347 0.00000 0.00000
|
|
88 21H+4 -0.04669 0.00000 0.00000 0.00000 -0.00098
|
|
89 21H-4 0.00000 0.04669 0.00000 0.00098 0.00000
|
|
90 21H+5 0.00000 -0.00974 0.00000 -0.02766 0.00000
|
|
91 21H-5 0.00974 0.00000 0.00000 0.00000 0.02766
|
|
92 2 H 1S 0.01058 0.00000 0.03006 0.00000 0.03081
|
|
93 2S -0.05132 0.00000 1.13035 0.00000 0.53937
|
|
94 3S -9.13660 0.00000 -11.63688 0.00000 -8.23656
|
|
95 4S -6.39485 0.00000 -3.46525 0.00000 -3.07057
|
|
96 5S 0.77411 0.00000 -0.38994 0.00000 -0.79373
|
|
97 6PX 0.00000 -0.03841 0.00000 0.01343 0.00000
|
|
98 6PY -0.04371 0.00000 -0.04623 0.00000 -0.06993
|
|
99 6PZ -0.02215 0.00000 0.02636 0.00000 0.04142
|
|
100 7PX 0.00000 0.20951 0.00000 -0.10824 0.00000
|
|
101 7PY 0.28477 0.00000 0.10932 0.00000 0.35231
|
|
102 7PZ 0.12407 0.00000 -0.09155 0.00000 -0.24905
|
|
103 8PX 0.00000 -1.84745 0.00000 1.20425 0.00000
|
|
104 8PY 0.80739 0.00000 4.11698 0.00000 0.37538
|
|
105 8PZ -2.93449 0.00000 -1.32713 0.00000 1.36742
|
|
106 9PX 0.00000 -1.29973 0.00000 -0.25266 0.00000
|
|
107 9PY 1.48625 0.00000 2.19529 0.00000 0.93134
|
|
108 9PZ -2.16129 0.00000 -0.90496 0.00000 -0.37531
|
|
109 10D 0 0.00331 0.00000 -0.03001 0.00000 -0.03275
|
|
110 10D+1 0.00000 -0.00022 0.00000 0.00210 0.00000
|
|
111 10D-1 -0.01509 0.00000 -0.03586 0.00000 0.00816
|
|
112 10D+2 0.00304 0.00000 -0.05623 0.00000 -0.02449
|
|
113 10D-2 0.00000 0.01323 0.00000 0.03032 0.00000
|
|
114 11D 0 -0.01230 0.00000 0.29264 0.00000 0.29097
|
|
115 11D+1 0.00000 -0.03953 0.00000 0.00170 0.00000
|
|
116 11D-1 0.35684 0.00000 0.47099 0.00000 0.00725
|
|
117 11D+2 0.17238 0.00000 0.66359 0.00000 0.29884
|
|
118 11D-2 0.00000 0.02926 0.00000 -0.22944 0.00000
|
|
119 12D 0 -1.30129 0.00000 0.37387 0.00000 -0.33925
|
|
120 12D+1 0.00000 -0.73716 0.00000 0.60017 0.00000
|
|
121 12D-1 0.85971 0.00000 0.28385 0.00000 -1.15515
|
|
122 12D+2 -1.17420 0.00000 0.14860 0.00000 -0.74783
|
|
123 12D-2 0.00000 1.53549 0.00000 -0.17495 0.00000
|
|
124 13F 0 0.01868 0.00000 0.02881 0.00000 0.00095
|
|
125 13F+1 0.00000 0.00238 0.00000 -0.00753 0.00000
|
|
126 13F-1 0.01457 0.00000 -0.00111 0.00000 -0.01108
|
|
127 13F+2 0.01739 0.00000 0.02262 0.00000 0.00370
|
|
128 13F-2 0.00000 0.00275 0.00000 -0.00684 0.00000
|
|
129 13F+3 0.00000 0.02426 0.00000 -0.00973 0.00000
|
|
130 13F-3 -0.02241 0.00000 -0.04671 0.00000 -0.00812
|
|
131 14F 0 -0.01697 0.00000 0.05876 0.00000 -0.02283
|
|
132 14F+1 0.00000 -0.00302 0.00000 0.01053 0.00000
|
|
133 14F-1 0.20228 0.00000 -0.13931 0.00000 -0.12247
|
|
134 14F+2 0.11720 0.00000 0.18390 0.00000 -0.12936
|
|
135 14F-2 0.00000 0.19007 0.00000 -0.05445 0.00000
|
|
136 14F+3 0.00000 0.10531 0.00000 -0.14470 0.00000
|
|
137 14F-3 0.20164 0.00000 -0.01465 0.00000 -0.00939
|
|
138 15G 0 0.00902 0.00000 -0.00110 0.00000 -0.00364
|
|
139 15G+1 0.00000 0.00353 0.00000 -0.00183 0.00000
|
|
140 15G-1 0.00372 0.00000 -0.01069 0.00000 0.00052
|
|
141 15G+2 0.01725 0.00000 -0.00101 0.00000 -0.00764
|
|
142 15G-2 0.00000 -0.00200 0.00000 0.00138 0.00000
|
|
143 15G+3 0.00000 0.01753 0.00000 -0.00757 0.00000
|
|
144 15G-3 -0.00609 0.00000 -0.01226 0.00000 0.01129
|
|
145 15G+4 0.00807 0.00000 -0.00332 0.00000 -0.00026
|
|
146 15G-4 0.00000 -0.01448 0.00000 0.01206 0.00000
|
|
147 3 H 1S -0.00529 0.00916 0.03006 0.02668 -0.01541
|
|
148 2S 0.02566 -0.04444 1.13035 0.46711 -0.26969
|
|
149 3S 4.56830 -7.91253 -11.63688 -7.13307 4.11828
|
|
150 4S 3.19742 -5.53810 -3.46525 -2.65919 1.53528
|
|
151 5S -0.38705 0.67039 -0.38994 -0.68739 0.39687
|
|
152 6PX 0.00230 -0.04239 -0.04003 -0.04909 0.03610
|
|
153 6PY -0.03974 0.00230 0.02311 0.03610 -0.00741
|
|
154 6PZ 0.01108 -0.01918 0.02636 0.03587 -0.02071
|
|
155 7PX -0.03259 0.26596 0.09467 0.23717 -0.19942
|
|
156 7PY 0.22833 -0.03259 -0.05466 -0.19942 0.00689
|
|
157 7PZ -0.06204 0.10745 -0.09155 -0.21568 0.12452
|
|
158 8PX -1.14958 0.14368 3.56541 0.58260 0.35891
|
|
159 8PY -1.18374 -1.14958 -2.05849 0.35891 0.99703
|
|
160 8PZ 1.46724 -2.54134 -1.32713 1.18422 -0.68371
|
|
161 9PX -1.20637 0.78976 1.90118 0.63534 -0.51269
|
|
162 9PY -0.60324 -1.20637 -1.09765 -0.51269 0.04334
|
|
163 9PZ 1.08065 -1.87173 -0.90496 -0.32503 0.18766
|
|
164 10D 0 -0.00166 0.00287 -0.03001 -0.02837 0.01638
|
|
165 10D+1 0.00644 -0.01137 -0.03106 0.00664 -0.00262
|
|
166 10D-1 -0.00393 0.00644 0.01793 -0.00262 0.00362
|
|
167 10D+2 0.01069 0.00441 0.02811 0.02373 0.01661
|
|
168 10D-2 0.00441 0.00559 -0.04869 -0.01079 0.02373
|
|
169 11D 0 0.00615 -0.01065 0.29264 0.25199 -0.14549
|
|
170 11D+1 -0.17163 0.25775 0.40789 0.00586 -0.00240
|
|
171 11D-1 0.05956 -0.17163 -0.23549 -0.00240 0.00309
|
|
172 11D+2 0.06504 -0.06197 -0.33179 -0.22876 -0.09737
|
|
173 11D-2 -0.06197 0.13660 0.57468 0.16677 -0.22876
|
|
174 12D 0 0.65064 -1.12695 0.37387 -0.29380 0.16963
|
|
175 12D+1 -0.69147 0.46050 0.24582 -0.71632 0.76007
|
|
176 12D-1 -0.33794 -0.69147 -0.14193 0.76007 0.16134
|
|
177 12D+2 0.85807 1.17333 -0.07430 0.24806 -0.31817
|
|
178 12D-2 1.17333 -0.49678 0.12869 -0.60461 0.24806
|
|
179 13F 0 -0.00934 0.01618 0.02881 0.00082 -0.00048
|
|
180 13F+1 -0.00528 0.01153 -0.00096 -0.01019 0.00154
|
|
181 13F-1 0.00543 -0.00528 0.00055 0.00154 -0.00842
|
|
182 13F+2 0.00641 -0.00634 -0.01131 -0.00457 -0.00420
|
|
183 13F-2 -0.00634 0.01373 0.01959 0.00107 -0.00457
|
|
184 13F+3 -0.02101 -0.01213 0.00000 0.00487 0.00843
|
|
185 13F-3 0.01120 -0.01940 -0.04671 -0.00703 0.00406
|
|
186 14F 0 0.00848 -0.01470 0.05876 -0.01978 0.01142
|
|
187 14F+1 -0.08890 0.15095 -0.12064 -0.08922 0.05759
|
|
188 14F-1 0.04830 -0.08890 0.06965 0.05759 -0.02272
|
|
189 14F+2 0.17185 0.03156 -0.09195 0.03244 -0.07318
|
|
190 14F-2 0.03156 0.13541 0.15926 -0.11063 0.03244
|
|
191 14F+3 -0.09120 -0.05265 0.00000 0.07235 0.12531
|
|
192 14F-3 -0.10082 0.17462 -0.01465 -0.00813 0.00470
|
|
193 15G 0 -0.00451 0.00781 -0.00110 -0.00315 0.00182
|
|
194 15G+1 -0.00009 0.00367 -0.00926 -0.00007 -0.00102
|
|
195 15G-1 0.00358 -0.00009 0.00535 -0.00102 -0.00124
|
|
196 15G+2 0.00281 -0.00834 0.00050 0.00391 -0.00088
|
|
197 15G-2 -0.00834 0.01244 -0.00087 -0.00539 0.00391
|
|
198 15G+3 -0.01518 -0.00877 0.00000 0.00379 0.00656
|
|
199 15G-3 0.00305 -0.00528 -0.01226 0.00978 -0.00565
|
|
200 15G+4 0.01288 0.00278 0.00166 -0.00511 -0.00911
|
|
201 15G-4 -0.00278 -0.00967 0.00288 0.00321 0.00511
|
|
202 4 H 1S -0.00529 -0.00916 0.03006 -0.02668 -0.01541
|
|
203 2S 0.02566 0.04444 1.13035 -0.46711 -0.26969
|
|
204 3S 4.56830 7.91253 -11.63688 7.13307 4.11828
|
|
205 4S 3.19742 5.53810 -3.46525 2.65919 1.53528
|
|
206 5S -0.38705 -0.67039 -0.38994 0.68739 0.39687
|
|
207 6PX -0.00230 -0.04239 0.04003 -0.04909 -0.03610
|
|
208 6PY -0.03974 -0.00230 0.02311 -0.03610 -0.00741
|
|
209 6PZ 0.01108 0.01918 0.02636 -0.03587 -0.02071
|
|
210 7PX 0.03259 0.26596 -0.09467 0.23717 0.19942
|
|
211 7PY 0.22833 0.03259 -0.05466 0.19942 0.00689
|
|
212 7PZ -0.06204 -0.10745 -0.09155 0.21568 0.12452
|
|
213 8PX 1.14958 0.14368 -3.56541 0.58260 -0.35891
|
|
214 8PY -1.18374 1.14958 -2.05849 -0.35891 0.99703
|
|
215 8PZ 1.46724 2.54134 -1.32713 -1.18422 -0.68371
|
|
216 9PX 1.20637 0.78976 -1.90118 0.63534 0.51269
|
|
217 9PY -0.60324 1.20637 -1.09765 0.51269 0.04334
|
|
218 9PZ 1.08065 1.87173 -0.90496 0.32503 0.18766
|
|
219 10D 0 -0.00166 -0.00287 -0.03001 0.02837 0.01638
|
|
220 10D+1 -0.00644 -0.01137 0.03106 0.00664 0.00262
|
|
221 10D-1 -0.00393 -0.00644 0.01793 0.00262 0.00362
|
|
222 10D+2 0.01069 -0.00441 0.02811 -0.02373 0.01661
|
|
223 10D-2 -0.00441 0.00559 0.04869 -0.01079 -0.02373
|
|
224 11D 0 0.00615 0.01065 0.29264 -0.25199 -0.14549
|
|
225 11D+1 0.17163 0.25775 -0.40789 0.00586 0.00240
|
|
226 11D-1 0.05956 0.17163 -0.23549 0.00240 0.00309
|
|
227 11D+2 0.06504 0.06197 -0.33179 0.22876 -0.09737
|
|
228 11D-2 0.06197 0.13660 -0.57468 0.16677 0.22876
|
|
229 12D 0 0.65064 1.12695 0.37387 0.29380 0.16963
|
|
230 12D+1 0.69147 0.46050 -0.24582 -0.71632 -0.76007
|
|
231 12D-1 -0.33794 0.69147 -0.14193 -0.76007 0.16134
|
|
232 12D+2 0.85807 -1.17333 -0.07430 -0.24806 -0.31817
|
|
233 12D-2 -1.17333 -0.49678 -0.12869 -0.60461 -0.24806
|
|
234 13F 0 -0.00934 -0.01618 0.02881 -0.00082 -0.00048
|
|
235 13F+1 0.00528 0.01153 0.00096 -0.01019 -0.00154
|
|
236 13F-1 0.00543 0.00528 0.00055 -0.00154 -0.00842
|
|
237 13F+2 0.00641 0.00634 -0.01131 0.00457 -0.00420
|
|
238 13F-2 0.00634 0.01373 -0.01959 0.00107 0.00457
|
|
239 13F+3 0.02101 -0.01213 0.00000 0.00487 -0.00843
|
|
240 13F-3 0.01120 0.01940 -0.04671 0.00703 0.00406
|
|
241 14F 0 0.00848 0.01470 0.05876 0.01978 0.01142
|
|
242 14F+1 0.08890 0.15095 0.12064 -0.08922 -0.05759
|
|
243 14F-1 0.04830 0.08890 0.06965 -0.05759 -0.02272
|
|
244 14F+2 0.17185 -0.03156 -0.09195 -0.03244 -0.07318
|
|
245 14F-2 -0.03156 0.13541 -0.15926 -0.11063 -0.03244
|
|
246 14F+3 0.09120 -0.05265 0.00000 0.07235 -0.12531
|
|
247 14F-3 -0.10082 -0.17462 -0.01465 0.00813 0.00470
|
|
248 15G 0 -0.00451 -0.00781 -0.00110 0.00315 0.00182
|
|
249 15G+1 0.00009 0.00367 0.00926 -0.00007 0.00102
|
|
250 15G-1 0.00358 0.00009 0.00535 0.00102 -0.00124
|
|
251 15G+2 0.00281 0.00834 0.00050 -0.00391 -0.00088
|
|
252 15G-2 0.00834 0.01244 0.00087 -0.00539 -0.00391
|
|
253 15G+3 0.01518 -0.00877 0.00000 0.00379 -0.00656
|
|
254 15G-3 0.00305 0.00528 -0.01226 -0.00978 -0.00565
|
|
255 15G+4 0.01288 -0.00278 0.00166 0.00511 -0.00911
|
|
256 15G-4 0.00278 -0.00967 -0.00288 0.00321 -0.00511
|
|
66 67 68 69 70
|
|
(A1)--V (A2)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 2.90054 2.94825 3.33362 3.43457 3.43457
|
|
1 1 N 1S 0.01904 0.00000 0.04840 0.00000 0.00000
|
|
2 2S -0.03420 0.00000 -0.05322 0.00000 0.00000
|
|
3 3S 0.07758 0.00000 0.23548 0.00000 0.00000
|
|
4 4S -5.46239 0.00000 -3.74448 0.00000 0.00000
|
|
5 5S 34.10340 0.00000 13.41655 0.00000 0.00000
|
|
6 6S 20.19601 0.00000 6.14696 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 0.00000 0.00000 0.00306
|
|
8 7PY 0.00000 0.00000 0.00000 0.00306 0.00000
|
|
9 7PZ -0.15737 0.00000 -0.03508 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 0.00000 0.00000 -0.45207
|
|
11 8PY 0.00000 0.00000 0.00000 -0.45207 0.00000
|
|
12 8PZ 0.29931 0.00000 0.01275 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 0.00000 0.00000 3.30359
|
|
14 9PY 0.00000 0.00000 0.00000 3.30359 0.00000
|
|
15 9PZ -4.76242 0.00000 -1.27544 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 0.00000 0.00000 0.20590
|
|
17 10PY 0.00000 0.00000 0.00000 0.20590 0.00000
|
|
18 10PZ -14.07397 0.00000 -3.95575 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 0.00000 0.00000 0.41759
|
|
20 11PY 0.00000 0.00000 0.00000 0.41759 0.00000
|
|
21 11PZ -2.00717 0.00000 -0.54656 0.00000 0.00000
|
|
22 12D 0 0.02828 0.00000 -0.02987 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.06411
|
|
24 12D-1 0.00000 0.00000 0.00000 0.06411 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00065 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00065
|
|
27 13D 0 -0.05955 0.00000 0.09219 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 0.00000 -0.17882
|
|
29 13D-1 0.00000 0.00000 0.00000 -0.17882 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 0.05992 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.05992
|
|
32 14D 0 -0.09271 0.00000 -1.33070 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 0.00000 1.17137
|
|
34 14D-1 0.00000 0.00000 0.00000 1.17137 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 -1.78257 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 0.00000 -1.78257
|
|
37 15D 0 0.48840 0.00000 -0.98308 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 0.00000 1.75256
|
|
39 15D-1 0.00000 0.00000 0.00000 1.75256 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 -0.49586 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 -0.49586
|
|
42 16F 0 -0.03854 0.00000 -0.00995 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00658
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00658 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 -0.01673 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 -0.01673
|
|
47 16F+3 0.00000 -0.04262 0.00000 0.00000 0.00000
|
|
48 16F-3 0.01860 0.00000 0.01925 0.00000 0.00000
|
|
49 17F 0 0.35232 0.00000 0.13663 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 -0.09869
|
|
51 17F-1 0.00000 0.00000 0.00000 -0.09869 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.21580 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.21580
|
|
54 17F+3 0.00000 0.27106 0.00000 0.00000 0.00000
|
|
55 17F-3 -0.31465 0.00000 -0.16934 0.00000 0.00000
|
|
56 18F 0 1.30271 0.00000 0.79041 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 -1.36150
|
|
58 18F-1 0.00000 0.00000 0.00000 -1.36150 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.88743 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 -0.88743
|
|
61 18F+3 0.00000 5.58700 0.00000 0.00000 0.00000
|
|
62 18F-3 -1.36366 0.00000 -1.87059 0.00000 0.00000
|
|
63 19G 0 0.00633 0.00000 0.00402 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.01005
|
|
65 19G-1 0.00000 0.00000 0.00000 0.01005 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 -0.01370 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 -0.01370
|
|
68 19G+3 0.00000 0.05631 0.00000 0.00000 0.00000
|
|
69 19G-3 0.01255 0.00000 -0.01418 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00941 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 -0.00941
|
|
72 20G 0 -0.23546 0.00000 -0.04665 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.03130
|
|
74 20G-1 0.00000 0.00000 0.00000 0.03130 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.27537 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.27537
|
|
77 20G+3 0.00000 -0.86893 0.00000 0.00000 0.00000
|
|
78 20G-3 0.27812 0.00000 0.31128 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.04761 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 -0.04761
|
|
81 21H 0 0.00756 0.00000 -0.01282 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.02730
|
|
83 21H-1 0.00000 0.00000 0.00000 0.02730 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 -0.03000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 -0.03000
|
|
86 21H+3 0.00000 0.03276 0.00000 0.00000 0.00000
|
|
87 21H-3 -0.02629 0.00000 -0.02181 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00236 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 -0.00236
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 -0.03400
|
|
91 21H-5 0.00000 0.00000 0.00000 0.03400 0.00000
|
|
92 2 H 1S -0.00472 0.00000 0.02138 0.00037 0.00000
|
|
93 2S 0.25099 0.00000 -0.54094 1.01630 0.00000
|
|
94 3S -9.27757 0.00000 -4.56001 -2.10752 0.00000
|
|
95 4S -10.07280 0.00000 -2.46773 -1.52699 0.00000
|
|
96 5S 0.02708 0.00000 0.00190 -0.41387 0.00000
|
|
97 6PX 0.00000 0.03928 0.00000 0.00000 0.01325
|
|
98 6PY 0.03770 0.00000 -0.00660 -0.02879 0.00000
|
|
99 6PZ 0.01605 0.00000 -0.00452 -0.01874 0.00000
|
|
100 7PX 0.00000 -0.27436 0.00000 0.00000 -0.08477
|
|
101 7PY -0.29587 0.00000 0.04709 0.09910 0.00000
|
|
102 7PZ -0.06661 0.00000 0.03048 0.16213 0.00000
|
|
103 8PX 0.00000 4.02047 0.00000 0.00000 0.47006
|
|
104 8PY 4.96917 0.00000 1.89687 0.40207 0.00000
|
|
105 8PZ -0.68280 0.00000 -1.15242 -2.63818 0.00000
|
|
106 9PX 0.00000 1.48778 0.00000 0.00000 0.31129
|
|
107 9PY 4.51983 0.00000 0.64946 1.14369 0.00000
|
|
108 9PZ -0.17619 0.00000 -0.13969 -1.73796 0.00000
|
|
109 10D 0 -0.01820 0.00000 0.00979 -0.00589 0.00000
|
|
110 10D+1 0.00000 -0.01314 0.00000 0.00000 -0.02600
|
|
111 10D-1 -0.02765 0.00000 -0.01347 -0.01264 0.00000
|
|
112 10D+2 -0.01314 0.00000 -0.02879 -0.01844 0.00000
|
|
113 10D-2 0.00000 0.04242 0.00000 0.00000 -0.02265
|
|
114 11D 0 0.19384 0.00000 0.01561 0.01131 0.00000
|
|
115 11D+1 0.00000 0.13679 0.00000 0.00000 0.14728
|
|
116 11D-1 0.28461 0.00000 0.18443 0.24725 0.00000
|
|
117 11D+2 0.28337 0.00000 0.28804 0.17201 0.00000
|
|
118 11D-2 0.00000 -0.46350 0.00000 0.00000 0.09875
|
|
119 12D 0 0.98349 0.00000 -0.13664 -0.75883 0.00000
|
|
120 12D+1 0.00000 1.45087 0.00000 0.00000 -0.04013
|
|
121 12D-1 -0.17993 0.00000 0.04159 1.86324 0.00000
|
|
122 12D+2 1.70661 0.00000 -0.03534 0.14238 0.00000
|
|
123 12D-2 0.00000 -2.04954 0.00000 0.00000 -0.43374
|
|
124 13F 0 0.01449 0.00000 -0.02071 0.02523 0.00000
|
|
125 13F+1 0.00000 -0.00953 0.00000 0.00000 0.02675
|
|
126 13F-1 -0.01039 0.00000 -0.01366 0.01127 0.00000
|
|
127 13F+2 0.00552 0.00000 0.02666 0.03099 0.00000
|
|
128 13F-2 0.00000 0.00168 0.00000 0.00000 0.03453
|
|
129 13F+3 0.00000 -0.03760 0.00000 0.00000 -0.03934
|
|
130 13F-3 -0.03202 0.00000 0.03667 0.00126 0.00000
|
|
131 14F 0 0.02057 0.00000 0.19258 0.00022 0.00000
|
|
132 14F+1 0.00000 -0.00899 0.00000 0.00000 -0.13938
|
|
133 14F-1 -0.19083 0.00000 0.09504 0.21698 0.00000
|
|
134 14F+2 0.10404 0.00000 -0.07834 0.14905 0.00000
|
|
135 14F-2 0.00000 -0.32004 0.00000 0.00000 -0.39841
|
|
136 14F+3 0.00000 -0.27358 0.00000 0.00000 0.18124
|
|
137 14F-3 -0.06885 0.00000 -0.38902 -0.08397 0.00000
|
|
138 15G 0 -0.01056 0.00000 0.00350 0.01629 0.00000
|
|
139 15G+1 0.00000 -0.00982 0.00000 0.00000 -0.00535
|
|
140 15G-1 -0.00587 0.00000 -0.00129 0.00043 0.00000
|
|
141 15G+2 -0.01299 0.00000 -0.00091 0.01929 0.00000
|
|
142 15G-2 0.00000 0.00791 0.00000 0.00000 -0.00649
|
|
143 15G+3 0.00000 -0.01239 0.00000 0.00000 -0.01694
|
|
144 15G-3 -0.00585 0.00000 0.00015 -0.01939 0.00000
|
|
145 15G+4 -0.00782 0.00000 -0.00768 -0.00226 0.00000
|
|
146 15G-4 0.00000 0.02522 0.00000 0.00000 0.00527
|
|
147 3 H 1S -0.00472 0.00000 0.02138 -0.00018 0.00032
|
|
148 2S 0.25099 0.00000 -0.54094 -0.50815 0.88014
|
|
149 3S -9.27757 0.00000 -4.56001 1.05376 -1.82516
|
|
150 4S -10.07280 0.00000 -2.46773 0.76350 -1.32242
|
|
151 5S 0.02708 0.00000 0.00190 0.20694 -0.35843
|
|
152 6PX 0.03265 -0.01964 -0.00572 0.01821 -0.01828
|
|
153 6PY -0.01885 -0.03402 0.00330 0.00274 0.01821
|
|
154 6PZ 0.01605 0.00000 -0.00452 0.00937 -0.01623
|
|
155 7PX -0.25623 0.13718 0.04078 -0.07962 0.05314
|
|
156 7PY 0.14793 0.23760 -0.02355 -0.03880 -0.07962
|
|
157 7PZ -0.06661 0.00000 0.03048 -0.08106 0.14041
|
|
158 8PX 4.30342 -2.01024 1.64274 0.02944 0.41907
|
|
159 8PY -2.48458 -3.48183 -0.94844 0.45306 0.02944
|
|
160 8PZ -0.68280 0.00000 -1.15242 1.31909 -2.28473
|
|
161 9PX 3.91429 -0.74389 0.56245 -0.36044 0.93559
|
|
162 9PY -2.25991 -1.28845 -0.32473 0.51939 -0.36044
|
|
163 9PZ -0.17619 0.00000 -0.13969 0.86898 -1.50511
|
|
164 10D 0 -0.01820 0.00000 0.00979 0.00295 -0.00510
|
|
165 10D+1 -0.02394 0.00657 -0.01167 -0.00578 -0.01598
|
|
166 10D-1 0.01382 0.01138 0.00674 -0.02266 -0.00578
|
|
167 10D+2 0.00657 -0.03674 0.01439 -0.02160 -0.00183
|
|
168 10D-2 -0.01138 -0.02121 -0.02493 -0.00183 -0.01949
|
|
169 11D 0 0.19384 0.00000 0.01561 -0.00566 0.00980
|
|
170 11D+1 0.24648 -0.06839 0.15972 -0.04329 0.22226
|
|
171 11D-1 -0.14230 -0.11846 -0.09221 0.17227 -0.04329
|
|
172 11D+2 -0.14168 0.40140 -0.14402 0.11707 -0.03172
|
|
173 11D-2 0.24540 0.23175 0.24945 -0.03172 0.15369
|
|
174 12D 0 0.98349 0.00000 -0.13664 0.37942 -0.65717
|
|
175 12D+1 -0.15582 -0.72543 0.03602 -0.82418 1.38740
|
|
176 12D-1 0.08997 -1.25649 -0.02080 0.43571 -0.82418
|
|
177 12D+2 -0.85330 1.77495 0.01767 -0.28971 -0.24946
|
|
178 12D-2 1.47796 1.02477 -0.03061 -0.24946 -0.00165
|
|
179 13F 0 0.01449 0.00000 -0.02071 -0.01262 0.02185
|
|
180 13F+1 -0.00899 0.00476 -0.01183 0.00670 0.01514
|
|
181 13F-1 0.00519 0.00825 0.00683 0.02288 0.00670
|
|
182 13F+2 -0.00276 -0.00146 -0.01333 0.03365 0.00153
|
|
183 13F-2 0.00478 -0.00084 0.02309 0.00153 0.03188
|
|
184 13F+3 0.00000 -0.03760 0.00000 0.03407 0.01967
|
|
185 13F-3 -0.03202 0.00000 0.03667 -0.00063 0.00109
|
|
186 14F 0 0.02057 0.00000 0.19258 -0.00011 0.00019
|
|
187 14F+1 -0.16527 0.00449 0.08230 -0.15431 0.12789
|
|
188 14F-1 0.09542 0.00778 -0.04752 -0.05029 -0.15431
|
|
189 14F+2 -0.05202 0.27716 0.03917 -0.26154 -0.23706
|
|
190 14F-2 0.09010 0.16002 -0.06784 -0.23706 0.01219
|
|
191 14F+3 0.00000 -0.27358 0.00000 -0.15696 -0.09062
|
|
192 14F-3 -0.06885 0.00000 -0.38902 0.04198 -0.07272
|
|
193 15G 0 -0.01056 0.00000 0.00350 -0.00815 0.01411
|
|
194 15G+1 -0.00508 0.00491 -0.00111 -0.00250 -0.00102
|
|
195 15G-1 0.00293 0.00851 0.00064 -0.00391 -0.00250
|
|
196 15G+2 0.00650 -0.00685 0.00045 -0.00004 -0.01116
|
|
197 15G-2 -0.01125 -0.00395 -0.00078 -0.01116 0.01284
|
|
198 15G+3 0.00000 -0.01239 0.00000 0.01467 0.00847
|
|
199 15G-3 -0.00585 0.00000 0.00015 0.00970 -0.01679
|
|
200 15G+4 0.00391 0.02184 0.00384 -0.00452 -0.00130
|
|
201 15G-4 0.00678 -0.01261 0.00665 0.00130 0.00301
|
|
202 4 H 1S -0.00472 0.00000 0.02138 -0.00018 -0.00032
|
|
203 2S 0.25099 0.00000 -0.54094 -0.50815 -0.88014
|
|
204 3S -9.27757 0.00000 -4.56001 1.05376 1.82516
|
|
205 4S -10.07280 0.00000 -2.46773 0.76350 1.32242
|
|
206 5S 0.02708 0.00000 0.00190 0.20694 0.35843
|
|
207 6PX -0.03265 -0.01964 0.00572 -0.01821 -0.01828
|
|
208 6PY -0.01885 0.03402 0.00330 0.00274 -0.01821
|
|
209 6PZ 0.01605 0.00000 -0.00452 0.00937 0.01623
|
|
210 7PX 0.25623 0.13718 -0.04078 0.07962 0.05314
|
|
211 7PY 0.14793 -0.23760 -0.02355 -0.03880 0.07962
|
|
212 7PZ -0.06661 0.00000 0.03048 -0.08106 -0.14041
|
|
213 8PX -4.30342 -2.01024 -1.64274 -0.02944 0.41907
|
|
214 8PY -2.48458 3.48183 -0.94844 0.45306 -0.02944
|
|
215 8PZ -0.68280 0.00000 -1.15242 1.31909 2.28473
|
|
216 9PX -3.91429 -0.74389 -0.56245 0.36044 0.93559
|
|
217 9PY -2.25991 1.28845 -0.32473 0.51939 0.36044
|
|
218 9PZ -0.17619 0.00000 -0.13969 0.86898 1.50511
|
|
219 10D 0 -0.01820 0.00000 0.00979 0.00295 0.00510
|
|
220 10D+1 0.02394 0.00657 0.01167 0.00578 -0.01598
|
|
221 10D-1 0.01382 -0.01138 0.00674 -0.02266 0.00578
|
|
222 10D+2 0.00657 0.03674 0.01439 -0.02160 0.00183
|
|
223 10D-2 0.01138 -0.02121 0.02493 0.00183 -0.01949
|
|
224 11D 0 0.19384 0.00000 0.01561 -0.00566 -0.00980
|
|
225 11D+1 -0.24648 -0.06839 -0.15972 0.04329 0.22226
|
|
226 11D-1 -0.14230 0.11846 -0.09221 0.17227 0.04329
|
|
227 11D+2 -0.14168 -0.40140 -0.14402 0.11707 0.03172
|
|
228 11D-2 -0.24540 0.23175 -0.24945 0.03172 0.15369
|
|
229 12D 0 0.98349 0.00000 -0.13664 0.37942 0.65717
|
|
230 12D+1 0.15582 -0.72543 -0.03602 0.82418 1.38740
|
|
231 12D-1 0.08997 1.25649 -0.02080 0.43571 0.82418
|
|
232 12D+2 -0.85330 -1.77495 0.01767 -0.28971 0.24946
|
|
233 12D-2 -1.47796 1.02477 0.03061 0.24946 -0.00165
|
|
234 13F 0 0.01449 0.00000 -0.02071 -0.01262 -0.02185
|
|
235 13F+1 0.00899 0.00476 0.01183 -0.00670 0.01514
|
|
236 13F-1 0.00519 -0.00825 0.00683 0.02288 -0.00670
|
|
237 13F+2 -0.00276 0.00146 -0.01333 0.03365 -0.00153
|
|
238 13F-2 -0.00478 -0.00084 -0.02309 -0.00153 0.03188
|
|
239 13F+3 0.00000 -0.03760 0.00000 -0.03407 0.01967
|
|
240 13F-3 -0.03202 0.00000 0.03667 -0.00063 -0.00109
|
|
241 14F 0 0.02057 0.00000 0.19258 -0.00011 -0.00019
|
|
242 14F+1 0.16527 0.00449 -0.08230 0.15431 0.12789
|
|
243 14F-1 0.09542 -0.00778 -0.04752 -0.05029 0.15431
|
|
244 14F+2 -0.05202 -0.27716 0.03917 -0.26154 0.23706
|
|
245 14F-2 -0.09010 0.16002 0.06784 0.23706 0.01219
|
|
246 14F+3 0.00000 -0.27358 0.00000 0.15696 -0.09062
|
|
247 14F-3 -0.06885 0.00000 -0.38902 0.04198 0.07272
|
|
248 15G 0 -0.01056 0.00000 0.00350 -0.00815 -0.01411
|
|
249 15G+1 0.00508 0.00491 0.00111 0.00250 -0.00102
|
|
250 15G-1 0.00293 -0.00851 0.00064 -0.00391 0.00250
|
|
251 15G+2 0.00650 0.00685 0.00045 -0.00004 0.01116
|
|
252 15G-2 0.01125 -0.00395 0.00078 0.01116 0.01284
|
|
253 15G+3 0.00000 -0.01239 0.00000 -0.01467 0.00847
|
|
254 15G-3 -0.00585 0.00000 0.00015 0.00970 0.01679
|
|
255 15G+4 0.00391 -0.02184 0.00384 -0.00452 0.00130
|
|
256 15G-4 -0.00678 -0.01261 -0.00665 -0.00130 0.00301
|
|
71 72 73 74 75
|
|
(E)--V (E)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 3.56972 3.56972 3.64796 3.73081 3.73081
|
|
1 1 N 1S 0.00000 0.00000 -0.03978 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.00424 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 -0.21166 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 -4.13762 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 33.74911 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 14.18836 0.00000 0.00000
|
|
7 7PX 0.00000 -0.18480 0.00000 0.00000 0.04559
|
|
8 7PY -0.18480 0.00000 0.00000 -0.04559 0.00000
|
|
9 7PZ 0.00000 0.00000 -0.14256 0.00000 0.00000
|
|
10 8PX 0.00000 1.07862 0.00000 0.00000 -0.63478
|
|
11 8PY 1.07862 0.00000 0.00000 0.63478 0.00000
|
|
12 8PZ 0.00000 0.00000 -0.05978 0.00000 0.00000
|
|
13 9PX 0.00000 -13.57972 0.00000 0.00000 5.56450
|
|
14 9PY -13.57972 0.00000 0.00000 -5.56450 0.00000
|
|
15 9PZ 0.00000 0.00000 -3.51130 0.00000 0.00000
|
|
16 10PX 0.00000 -20.38074 0.00000 0.00000 11.93697
|
|
17 10PY -20.38074 0.00000 0.00000 -11.93697 0.00000
|
|
18 10PZ 0.00000 0.00000 -6.01652 0.00000 0.00000
|
|
19 11PX 0.00000 -1.43337 0.00000 0.00000 1.26845
|
|
20 11PY -1.43337 0.00000 0.00000 -1.26845 0.00000
|
|
21 11PZ 0.00000 0.00000 -1.00187 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 -0.04995 0.00000 0.00000
|
|
23 12D+1 0.00000 0.01011 0.00000 0.00000 -0.03312
|
|
24 12D-1 0.01011 0.00000 0.00000 0.03312 0.00000
|
|
25 12D+2 0.03202 0.00000 0.00000 -0.03886 0.00000
|
|
26 12D-2 0.00000 0.03202 0.00000 0.00000 0.03886
|
|
27 13D 0 0.00000 0.00000 0.18933 0.00000 0.00000
|
|
28 13D+1 0.00000 -0.19926 0.00000 0.00000 0.19809
|
|
29 13D-1 -0.19926 0.00000 0.00000 -0.19809 0.00000
|
|
30 13D+2 -0.26046 0.00000 0.00000 0.07107 0.00000
|
|
31 13D-2 0.00000 -0.26046 0.00000 0.00000 -0.07107
|
|
32 14D 0 0.00000 0.00000 -2.76068 0.00000 0.00000
|
|
33 14D+1 0.00000 5.74134 0.00000 0.00000 -4.18129
|
|
34 14D-1 5.74134 0.00000 0.00000 4.18129 0.00000
|
|
35 14D+2 7.27540 0.00000 0.00000 0.72900 0.00000
|
|
36 14D-2 0.00000 7.27540 0.00000 0.00000 -0.72900
|
|
37 15D 0 0.00000 0.00000 -2.16396 0.00000 0.00000
|
|
38 15D+1 0.00000 4.17506 0.00000 0.00000 -5.20099
|
|
39 15D-1 4.17506 0.00000 0.00000 5.20099 0.00000
|
|
40 15D+2 5.92851 0.00000 0.00000 0.89176 0.00000
|
|
41 15D-2 0.00000 5.92851 0.00000 0.00000 -0.89176
|
|
42 16F 0 0.00000 0.00000 -0.05019 0.00000 0.00000
|
|
43 16F+1 0.00000 -0.02646 0.00000 0.00000 -0.00112
|
|
44 16F-1 -0.02646 0.00000 0.00000 0.00112 0.00000
|
|
45 16F+2 0.07540 0.00000 0.00000 0.03553 0.00000
|
|
46 16F-2 0.00000 0.07540 0.00000 0.00000 -0.03553
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.03924 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.42286 0.00000 0.00000
|
|
50 17F+1 0.00000 0.23961 0.00000 0.00000 0.01763
|
|
51 17F-1 0.23961 0.00000 0.00000 -0.01763 0.00000
|
|
52 17F+2 -0.84700 0.00000 0.00000 -0.39492 0.00000
|
|
53 17F-2 0.00000 -0.84700 0.00000 0.00000 0.39492
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 -0.41054 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.66504 0.00000 0.00000
|
|
57 18F+1 0.00000 0.28456 0.00000 0.00000 2.15707
|
|
58 18F-1 0.28456 0.00000 0.00000 -2.15707 0.00000
|
|
59 18F+2 -2.37434 0.00000 0.00000 -0.78129 0.00000
|
|
60 18F-2 0.00000 -2.37434 0.00000 0.00000 0.78129
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 -1.84959 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00983 0.00000 0.00000
|
|
64 19G+1 0.00000 -0.02958 0.00000 0.00000 0.02005
|
|
65 19G-1 -0.02958 0.00000 0.00000 -0.02005 0.00000
|
|
66 19G+2 0.00496 0.00000 0.00000 0.00500 0.00000
|
|
67 19G-2 0.00000 0.00496 0.00000 0.00000 -0.00500
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.01406 0.00000 0.00000
|
|
70 19G+4 -0.02755 0.00000 0.00000 -0.01043 0.00000
|
|
71 19G-4 0.00000 0.02755 0.00000 0.00000 -0.01043
|
|
72 20G 0 0.00000 0.00000 -0.15927 0.00000 0.00000
|
|
73 20G+1 0.00000 -0.41515 0.00000 0.00000 0.08571
|
|
74 20G-1 -0.41515 0.00000 0.00000 -0.08571 0.00000
|
|
75 20G+2 -0.03998 0.00000 0.00000 0.16157 0.00000
|
|
76 20G-2 0.00000 -0.03998 0.00000 0.00000 -0.16157
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.28596 0.00000 0.00000
|
|
79 20G+4 -0.41833 0.00000 0.00000 -0.30296 0.00000
|
|
80 20G-4 0.00000 0.41833 0.00000 0.00000 -0.30296
|
|
81 21H 0 0.00000 0.00000 0.00590 0.00000 0.00000
|
|
82 21H+1 0.00000 0.02311 0.00000 0.00000 -0.02797
|
|
83 21H-1 0.02311 0.00000 0.00000 0.02797 0.00000
|
|
84 21H+2 0.04086 0.00000 0.00000 -0.00800 0.00000
|
|
85 21H-2 0.00000 0.04086 0.00000 0.00000 0.00800
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 -0.00760 0.00000 0.00000
|
|
88 21H+4 0.06153 0.00000 0.00000 0.05722 0.00000
|
|
89 21H-4 0.00000 -0.06153 0.00000 0.00000 0.05722
|
|
90 21H+5 0.00000 0.03838 0.00000 0.00000 0.00419
|
|
91 21H-5 -0.03838 0.00000 0.00000 0.00419 0.00000
|
|
92 2 H 1S -0.03167 0.00000 -0.00604 -0.00917 0.00000
|
|
93 2S -2.12545 0.00000 0.83655 -1.35330 0.00000
|
|
94 3S 25.80362 0.00000 -9.82592 12.51321 0.00000
|
|
95 4S 15.07844 0.00000 -7.33772 6.40488 0.00000
|
|
96 5S -0.42809 0.00000 -0.10391 0.07074 0.00000
|
|
97 6PX 0.00000 -0.02049 0.00000 0.00000 -0.02121
|
|
98 6PY 0.03175 0.00000 0.00777 0.00999 0.00000
|
|
99 6PZ -0.01324 0.00000 -0.02175 -0.04599 0.00000
|
|
100 7PX 0.00000 0.10831 0.00000 0.00000 0.15510
|
|
101 7PY 0.07545 0.00000 -0.13329 0.08448 0.00000
|
|
102 7PZ -0.04076 0.00000 0.14398 0.25646 0.00000
|
|
103 8PX 0.00000 -0.74341 0.00000 0.00000 -1.60944
|
|
104 8PY -11.14811 0.00000 4.19068 -5.58050 0.00000
|
|
105 8PZ 4.80698 0.00000 -2.62704 -0.60368 0.00000
|
|
106 9PX 0.00000 -0.45922 0.00000 0.00000 -1.49349
|
|
107 9PY -8.04613 0.00000 3.50359 -3.48682 0.00000
|
|
108 9PZ 3.47114 0.00000 -1.90947 0.37021 0.00000
|
|
109 10D 0 0.02777 0.00000 -0.02362 0.01777 0.00000
|
|
110 10D+1 0.00000 -0.00402 0.00000 0.00000 0.01044
|
|
111 10D-1 0.07067 0.00000 0.01608 0.01714 0.00000
|
|
112 10D+2 0.07116 0.00000 -0.02080 0.04440 0.00000
|
|
113 10D-2 0.00000 0.03715 0.00000 0.00000 -0.00377
|
|
114 11D 0 -0.42531 0.00000 0.21475 -0.25816 0.00000
|
|
115 11D+1 0.00000 0.04291 0.00000 0.00000 -0.10573
|
|
116 11D-1 -1.08520 0.00000 0.08583 -0.35250 0.00000
|
|
117 11D+2 -1.17069 0.00000 0.33831 -0.60603 0.00000
|
|
118 11D-2 0.00000 -0.21292 0.00000 0.00000 0.06745
|
|
119 12D 0 -0.96866 0.00000 -0.05960 -1.20144 0.00000
|
|
120 12D+1 0.00000 -0.35113 0.00000 0.00000 0.04275
|
|
121 12D-1 -2.29811 0.00000 1.54798 0.39025 0.00000
|
|
122 12D+2 -2.83244 0.00000 1.02666 -1.45890 0.00000
|
|
123 12D-2 0.00000 0.58769 0.00000 0.00000 1.40944
|
|
124 13F 0 -0.02320 0.00000 0.03233 -0.04842 0.00000
|
|
125 13F+1 0.00000 0.01496 0.00000 0.00000 0.06261
|
|
126 13F-1 0.01561 0.00000 0.00506 0.02413 0.00000
|
|
127 13F+2 -0.07575 0.00000 0.03645 -0.02691 0.00000
|
|
128 13F-2 0.00000 0.01549 0.00000 0.00000 0.05030
|
|
129 13F+3 0.00000 0.01509 0.00000 0.00000 -0.01993
|
|
130 13F-3 0.05590 0.00000 -0.03141 0.00693 0.00000
|
|
131 14F 0 -0.46559 0.00000 -0.06999 0.18876 0.00000
|
|
132 14F+1 0.00000 -0.12976 0.00000 0.00000 -0.41975
|
|
133 14F-1 0.01031 0.00000 -0.08003 0.20769 0.00000
|
|
134 14F+2 -0.41340 0.00000 0.00339 -0.04680 0.00000
|
|
135 14F-2 0.00000 -0.06515 0.00000 0.00000 -0.19102
|
|
136 14F+3 0.00000 -0.12052 0.00000 0.00000 0.45637
|
|
137 14F-3 0.45865 0.00000 0.00278 0.51349 0.00000
|
|
138 15G 0 -0.00500 0.00000 0.00205 0.01327 0.00000
|
|
139 15G+1 0.00000 0.00183 0.00000 0.00000 -0.00023
|
|
140 15G-1 0.02102 0.00000 -0.00563 0.00565 0.00000
|
|
141 15G+2 -0.00490 0.00000 0.00518 0.01871 0.00000
|
|
142 15G-2 0.00000 0.00704 0.00000 0.00000 0.00192
|
|
143 15G+3 0.00000 0.00874 0.00000 0.00000 0.00955
|
|
144 15G-3 0.02778 0.00000 -0.00978 0.00958 0.00000
|
|
145 15G+4 0.02076 0.00000 0.00032 0.02574 0.00000
|
|
146 15G-4 0.00000 -0.00129 0.00000 0.00000 -0.02478
|
|
147 3 H 1S 0.01583 -0.02743 -0.00604 0.00458 0.00794
|
|
148 2S 1.06272 -1.84069 0.83655 0.67665 1.17199
|
|
149 3S -12.90181 22.34659 -9.82592 -6.25660 -10.83676
|
|
150 4S -7.53922 13.05831 -7.33772 -3.20244 -5.54679
|
|
151 5S 0.21404 -0.37074 -0.10391 -0.03537 -0.06126
|
|
152 6PX -0.02262 0.01869 0.00673 0.00486 -0.01279
|
|
153 6PY -0.00743 -0.02262 -0.00389 0.01841 -0.00486
|
|
154 6PZ 0.00662 -0.01146 -0.02175 0.02299 0.03982
|
|
155 7PX 0.01423 0.08367 -0.11543 -0.10374 -0.02458
|
|
156 7PY 0.10009 0.01423 0.06664 -0.09520 0.10374
|
|
157 7PZ 0.02038 -0.03530 0.14398 -0.12823 -0.22210
|
|
158 8PX 4.50537 -8.54694 3.62924 3.11334 3.78302
|
|
159 8PY -3.34459 4.50537 -2.09534 -0.18805 -3.11334
|
|
160 8PZ -2.40349 4.16297 -2.62704 0.30184 0.52280
|
|
161 9PX 3.28523 -6.14940 3.03419 2.15654 2.24174
|
|
162 9PY -2.35595 3.28523 -1.75179 0.24841 -2.15654
|
|
163 9PZ -1.73557 3.00610 -1.90947 -0.18510 -0.32061
|
|
164 10D 0 -0.01388 0.02405 -0.02362 -0.00888 -0.01539
|
|
165 10D+1 -0.03234 0.05200 0.01393 -0.01194 -0.01024
|
|
166 10D-1 0.01465 -0.03234 -0.00804 -0.00354 0.01194
|
|
167 10D+2 0.04566 -0.01473 0.01040 0.01393 0.01759
|
|
168 10D-2 -0.01473 0.06266 -0.01801 -0.01759 -0.03425
|
|
169 11D 0 0.21266 -0.36833 0.21475 0.12908 0.22358
|
|
170 11D+1 0.48849 -0.80318 0.07433 0.19842 0.23794
|
|
171 11D-1 -0.23912 0.48849 -0.04292 -0.00883 -0.19842
|
|
172 11D+2 -0.45236 0.41473 -0.16915 -0.20210 -0.23321
|
|
173 11D-2 0.41473 -0.93125 0.29298 0.23321 0.47138
|
|
174 12D 0 0.48433 -0.83888 -0.05960 0.60072 1.04048
|
|
175 12D+1 0.84307 -1.81137 1.34059 -0.18749 -0.28200
|
|
176 12D-1 -0.83787 0.84307 -0.77399 0.06550 0.18749
|
|
177 12D+2 -0.26734 1.48096 -0.51333 -1.42181 -0.02141
|
|
178 12D-2 1.48096 -1.97741 0.88911 0.02141 1.44653
|
|
179 13F 0 0.01160 -0.02009 0.03233 0.02421 0.04193
|
|
180 13F+1 -0.00028 0.01545 0.00438 -0.03756 -0.00244
|
|
181 13F-1 0.01513 -0.00028 -0.00253 -0.04093 0.03756
|
|
182 13F+2 -0.00732 0.03951 -0.01822 -0.04445 0.01013
|
|
183 13F-2 0.03951 -0.05294 0.03157 -0.01013 0.03276
|
|
184 13F+3 -0.01307 -0.00754 0.00000 -0.01726 0.00996
|
|
185 13F-3 -0.02795 0.04841 -0.03141 -0.00347 -0.00600
|
|
186 14F 0 0.23280 -0.40321 -0.06999 -0.09438 -0.16347
|
|
187 14F+1 -0.06065 -0.02471 -0.06931 0.09182 -0.26071
|
|
188 14F-1 -0.09475 -0.06065 0.04001 0.36674 -0.09182
|
|
189 14F+2 -0.15221 0.15080 -0.00169 0.13156 -0.10298
|
|
190 14F-2 0.15080 -0.32634 0.00293 0.10298 -0.01266
|
|
191 14F+3 0.10437 0.06026 0.00000 0.39523 -0.22819
|
|
192 14F-3 -0.22932 0.39720 0.00278 -0.25674 -0.44469
|
|
193 15G 0 0.00250 -0.00433 0.00205 -0.00663 -0.01149
|
|
194 15G+1 -0.00831 0.01622 -0.00488 -0.00235 -0.00429
|
|
195 15G-1 0.00663 -0.00831 0.00281 0.00159 0.00235
|
|
196 15G+2 0.00405 0.00517 -0.00259 0.00324 0.00893
|
|
197 15G-2 0.00517 -0.00192 0.00448 -0.00893 -0.01356
|
|
198 15G+3 -0.00757 -0.00437 0.00000 0.00827 -0.00478
|
|
199 15G-3 -0.01389 0.02405 -0.00978 -0.00479 -0.00829
|
|
200 15G+4 0.00615 -0.00843 -0.00016 -0.01215 0.02188
|
|
201 15G-4 0.00843 -0.01589 -0.00027 0.02188 0.01311
|
|
202 4 H 1S 0.01583 0.02743 -0.00604 0.00458 -0.00794
|
|
203 2S 1.06272 1.84069 0.83655 0.67665 -1.17199
|
|
204 3S -12.90181 -22.34659 -9.82592 -6.25660 10.83676
|
|
205 4S -7.53922 -13.05831 -7.33772 -3.20244 5.54679
|
|
206 5S 0.21404 0.37074 -0.10391 -0.03537 0.06126
|
|
207 6PX 0.02262 0.01869 -0.00673 -0.00486 -0.01279
|
|
208 6PY -0.00743 0.02262 -0.00389 0.01841 0.00486
|
|
209 6PZ 0.00662 0.01146 -0.02175 0.02299 -0.03982
|
|
210 7PX -0.01423 0.08367 0.11543 0.10374 -0.02458
|
|
211 7PY 0.10009 -0.01423 0.06664 -0.09520 -0.10374
|
|
212 7PZ 0.02038 0.03530 0.14398 -0.12823 0.22210
|
|
213 8PX -4.50537 -8.54694 -3.62924 -3.11334 3.78302
|
|
214 8PY -3.34459 -4.50537 -2.09534 -0.18805 3.11334
|
|
215 8PZ -2.40349 -4.16297 -2.62704 0.30184 -0.52280
|
|
216 9PX -3.28523 -6.14940 -3.03419 -2.15654 2.24174
|
|
217 9PY -2.35595 -3.28523 -1.75179 0.24841 2.15654
|
|
218 9PZ -1.73557 -3.00610 -1.90947 -0.18510 0.32061
|
|
219 10D 0 -0.01388 -0.02405 -0.02362 -0.00888 0.01539
|
|
220 10D+1 0.03234 0.05200 -0.01393 0.01194 -0.01024
|
|
221 10D-1 0.01465 0.03234 -0.00804 -0.00354 -0.01194
|
|
222 10D+2 0.04566 0.01473 0.01040 0.01393 -0.01759
|
|
223 10D-2 0.01473 0.06266 0.01801 0.01759 -0.03425
|
|
224 11D 0 0.21266 0.36833 0.21475 0.12908 -0.22358
|
|
225 11D+1 -0.48849 -0.80318 -0.07433 -0.19842 0.23794
|
|
226 11D-1 -0.23912 -0.48849 -0.04292 -0.00883 0.19842
|
|
227 11D+2 -0.45236 -0.41473 -0.16915 -0.20210 0.23321
|
|
228 11D-2 -0.41473 -0.93125 -0.29298 -0.23321 0.47138
|
|
229 12D 0 0.48433 0.83888 -0.05960 0.60072 -1.04048
|
|
230 12D+1 -0.84307 -1.81137 -1.34059 0.18749 -0.28200
|
|
231 12D-1 -0.83787 -0.84307 -0.77399 0.06550 -0.18749
|
|
232 12D+2 -0.26734 -1.48096 -0.51333 -1.42181 0.02141
|
|
233 12D-2 -1.48096 -1.97741 -0.88911 -0.02141 1.44653
|
|
234 13F 0 0.01160 0.02009 0.03233 0.02421 -0.04193
|
|
235 13F+1 0.00028 0.01545 -0.00438 0.03756 -0.00244
|
|
236 13F-1 0.01513 0.00028 -0.00253 -0.04093 -0.03756
|
|
237 13F+2 -0.00732 -0.03951 -0.01822 -0.04445 -0.01013
|
|
238 13F-2 -0.03951 -0.05294 -0.03157 0.01013 0.03276
|
|
239 13F+3 0.01307 -0.00754 0.00000 0.01726 0.00996
|
|
240 13F-3 -0.02795 -0.04841 -0.03141 -0.00347 0.00600
|
|
241 14F 0 0.23280 0.40321 -0.06999 -0.09438 0.16347
|
|
242 14F+1 0.06065 -0.02471 0.06931 -0.09182 -0.26071
|
|
243 14F-1 -0.09475 0.06065 0.04001 0.36674 0.09182
|
|
244 14F+2 -0.15221 -0.15080 -0.00169 0.13156 0.10298
|
|
245 14F-2 -0.15080 -0.32634 -0.00293 -0.10298 -0.01266
|
|
246 14F+3 -0.10437 0.06026 0.00000 -0.39523 -0.22819
|
|
247 14F-3 -0.22932 -0.39720 0.00278 -0.25674 0.44469
|
|
248 15G 0 0.00250 0.00433 0.00205 -0.00663 0.01149
|
|
249 15G+1 0.00831 0.01622 0.00488 0.00235 -0.00429
|
|
250 15G-1 0.00663 0.00831 0.00281 0.00159 -0.00235
|
|
251 15G+2 0.00405 -0.00517 -0.00259 0.00324 -0.00893
|
|
252 15G-2 -0.00517 -0.00192 -0.00448 0.00893 -0.01356
|
|
253 15G+3 0.00757 -0.00437 0.00000 -0.00827 -0.00478
|
|
254 15G-3 -0.01389 -0.02405 -0.00978 -0.00479 0.00829
|
|
255 15G+4 0.00615 0.00843 -0.00016 -0.01215 -0.02188
|
|
256 15G-4 -0.00843 -0.01589 0.00027 -0.02188 0.01311
|
|
76 77 78 79 80
|
|
(E)--V (E)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 3.93093 3.93093 4.08230 4.08230 4.24663
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 -0.04503
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 -0.01257
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 -0.52165
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 2.76144
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 -1.59167
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 4.29120
|
|
7 7PX 0.00000 0.02256 0.00000 0.00743 0.00000
|
|
8 7PY -0.02256 0.00000 0.00743 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.03618
|
|
10 8PX 0.00000 -0.98228 0.00000 -0.32501 0.00000
|
|
11 8PY 0.98228 0.00000 -0.32501 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.07075
|
|
13 9PX 0.00000 8.69331 0.00000 4.54713 0.00000
|
|
14 9PY -8.69331 0.00000 4.54713 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 -1.62593
|
|
16 10PX 0.00000 7.48593 0.00000 -1.50812 0.00000
|
|
17 10PY -7.48593 0.00000 -1.50812 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 -4.23697
|
|
19 11PX 0.00000 0.76696 0.00000 -0.22829 0.00000
|
|
20 11PY -0.76696 0.00000 -0.22829 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.90770
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.03950
|
|
23 12D+1 0.00000 0.02545 0.00000 0.01045 0.00000
|
|
24 12D-1 -0.02545 0.00000 0.01045 0.00000 0.00000
|
|
25 12D+2 -0.07051 0.00000 -0.00118 0.00000 0.00000
|
|
26 12D-2 0.00000 0.07051 0.00000 -0.00118 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.09615
|
|
28 13D+1 0.00000 0.00176 0.00000 -0.02850 0.00000
|
|
29 13D-1 -0.00176 0.00000 -0.02850 0.00000 0.00000
|
|
30 13D+2 0.14467 0.00000 0.00799 0.00000 0.00000
|
|
31 13D-2 0.00000 -0.14467 0.00000 0.00799 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 2.21111
|
|
33 14D+1 0.00000 -2.48303 0.00000 -1.23503 0.00000
|
|
34 14D-1 2.48303 0.00000 -1.23503 0.00000 0.00000
|
|
35 14D+2 0.55737 0.00000 -2.17000 0.00000 0.00000
|
|
36 14D-2 0.00000 -0.55737 0.00000 -2.17000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 2.66957
|
|
38 15D+1 0.00000 -1.55558 0.00000 0.88952 0.00000
|
|
39 15D-1 1.55558 0.00000 0.88952 0.00000 0.00000
|
|
40 15D+2 -1.06760 0.00000 -0.71889 0.00000 0.00000
|
|
41 15D-2 0.00000 1.06760 0.00000 -0.71889 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 -0.03425
|
|
43 16F+1 0.00000 0.01532 0.00000 0.00711 0.00000
|
|
44 16F-1 -0.01532 0.00000 0.00711 0.00000 0.00000
|
|
45 16F+2 0.03599 0.00000 -0.00266 0.00000 0.00000
|
|
46 16F-2 0.00000 -0.03599 0.00000 -0.00266 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00846
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.25239
|
|
50 17F+1 0.00000 -0.14864 0.00000 -0.07896 0.00000
|
|
51 17F-1 0.14864 0.00000 -0.07896 0.00000 0.00000
|
|
52 17F+2 -0.44211 0.00000 0.15996 0.00000 0.00000
|
|
53 17F-2 0.00000 0.44211 0.00000 0.15996 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 -0.08393
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 -0.85517
|
|
57 18F+1 0.00000 -0.45516 0.00000 0.32428 0.00000
|
|
58 18F-1 0.45516 0.00000 0.32428 0.00000 0.00000
|
|
59 18F+2 1.72566 0.00000 0.18195 0.00000 0.00000
|
|
60 18F-2 0.00000 -1.72566 0.00000 0.18195 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 2.23191
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.01333
|
|
64 19G+1 0.00000 0.02303 0.00000 0.01206 0.00000
|
|
65 19G-1 -0.02303 0.00000 0.01206 0.00000 0.00000
|
|
66 19G+2 0.01129 0.00000 -0.00273 0.00000 0.00000
|
|
67 19G-2 0.00000 -0.01129 0.00000 -0.00273 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00361
|
|
70 19G+4 -0.03099 0.00000 0.01197 0.00000 0.00000
|
|
71 19G-4 0.00000 -0.03099 0.00000 -0.01197 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 -0.35248
|
|
73 20G+1 0.00000 0.24424 0.00000 0.03788 0.00000
|
|
74 20G-1 -0.24424 0.00000 0.03788 0.00000 0.00000
|
|
75 20G+2 -0.15561 0.00000 0.06013 0.00000 0.00000
|
|
76 20G-2 0.00000 0.15561 0.00000 0.06013 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.18445
|
|
79 20G+4 -0.24510 0.00000 0.05967 0.00000 0.00000
|
|
80 20G-4 0.00000 -0.24510 0.00000 -0.05967 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.01665
|
|
82 21H+1 0.00000 -0.01789 0.00000 -0.01519 0.00000
|
|
83 21H-1 0.01789 0.00000 -0.01519 0.00000 0.00000
|
|
84 21H+2 0.01456 0.00000 -0.00845 0.00000 0.00000
|
|
85 21H-2 0.00000 -0.01456 0.00000 -0.00845 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 -0.05088
|
|
88 21H+4 0.04775 0.00000 -0.00862 0.00000 0.00000
|
|
89 21H-4 0.00000 0.04775 0.00000 0.00862 0.00000
|
|
90 21H+5 0.00000 -0.00122 0.00000 -0.02720 0.00000
|
|
91 21H-5 -0.00122 0.00000 0.02720 0.00000 0.00000
|
|
92 2 H 1S 0.00574 0.00000 -0.00176 0.00000 -0.00886
|
|
93 2S -2.24368 0.00000 0.48705 0.00000 0.94811
|
|
94 3S 9.44517 0.00000 -3.59397 0.00000 0.82932
|
|
95 4S 4.35476 0.00000 -1.46301 0.00000 -2.24371
|
|
96 5S 0.34283 0.00000 -0.01341 0.00000 -0.03801
|
|
97 6PX 0.00000 -0.03666 0.00000 -0.00249 0.00000
|
|
98 6PY 0.03675 0.00000 0.00256 0.00000 -0.00756
|
|
99 6PZ -0.01504 0.00000 -0.00051 0.00000 0.01738
|
|
100 7PX 0.00000 0.26391 0.00000 0.03466 0.00000
|
|
101 7PY -0.05230 0.00000 -0.10463 0.00000 0.03117
|
|
102 7PZ 0.01086 0.00000 0.05262 0.00000 -0.13783
|
|
103 8PX 0.00000 -2.50385 0.00000 0.62511 0.00000
|
|
104 8PY -4.26417 0.00000 2.90208 0.00000 0.36981
|
|
105 8PZ 2.47413 0.00000 -1.26155 0.00000 1.65454
|
|
106 9PX 0.00000 -1.37734 0.00000 1.23293 0.00000
|
|
107 9PY -3.19054 0.00000 1.61105 0.00000 1.56134
|
|
108 9PZ 1.44303 0.00000 -0.43059 0.00000 0.92686
|
|
109 10D 0 0.01018 0.00000 -0.01579 0.00000 0.01780
|
|
110 10D+1 0.00000 0.00266 0.00000 0.01468 0.00000
|
|
111 10D-1 0.05413 0.00000 -0.02787 0.00000 0.01600
|
|
112 10D+2 0.04414 0.00000 -0.01912 0.00000 -0.00283
|
|
113 10D-2 0.00000 -0.01698 0.00000 -0.02067 0.00000
|
|
114 11D 0 -0.14126 0.00000 0.13012 0.00000 -0.03580
|
|
115 11D+1 0.00000 -0.02898 0.00000 -0.08556 0.00000
|
|
116 11D-1 -0.60681 0.00000 0.29623 0.00000 -0.10415
|
|
117 11D+2 -0.56250 0.00000 0.24827 0.00000 0.06501
|
|
118 11D-2 0.00000 0.12850 0.00000 0.11837 0.00000
|
|
119 12D 0 -0.44204 0.00000 0.44313 0.00000 0.94956
|
|
120 12D+1 0.00000 -0.43037 0.00000 0.37127 0.00000
|
|
121 12D-1 -1.55236 0.00000 0.83611 0.00000 -0.72774
|
|
122 12D+2 -1.28607 0.00000 1.25168 0.00000 0.79346
|
|
123 12D-2 0.00000 1.62020 0.00000 -0.86741 0.00000
|
|
124 13F 0 -0.00453 0.00000 0.07868 0.00000 -0.03182
|
|
125 13F+1 0.00000 -0.06462 0.00000 -0.00619 0.00000
|
|
126 13F-1 -0.00219 0.00000 0.03663 0.00000 -0.02268
|
|
127 13F+2 -0.01545 0.00000 -0.07779 0.00000 0.05234
|
|
128 13F-2 0.00000 -0.01113 0.00000 0.00622 0.00000
|
|
129 13F+3 0.00000 0.01869 0.00000 0.00031 0.00000
|
|
130 13F-3 0.03905 0.00000 -0.02904 0.00000 0.00403
|
|
131 14F 0 -0.37779 0.00000 -0.39819 0.00000 0.28416
|
|
132 14F+1 0.00000 0.57203 0.00000 0.08218 0.00000
|
|
133 14F-1 0.06490 0.00000 -0.27311 0.00000 -0.17527
|
|
134 14F+2 -0.49786 0.00000 0.92545 0.00000 -0.44530
|
|
135 14F-2 0.00000 0.23256 0.00000 -0.11811 0.00000
|
|
136 14F+3 0.00000 0.24366 0.00000 0.00060 0.00000
|
|
137 14F-3 0.17571 0.00000 -0.06883 0.00000 -0.24694
|
|
138 15G 0 -0.00318 0.00000 0.00513 0.00000 -0.01363
|
|
139 15G+1 0.00000 0.00482 0.00000 -0.00434 0.00000
|
|
140 15G-1 0.02877 0.00000 -0.00893 0.00000 -0.01260
|
|
141 15G+2 -0.00391 0.00000 0.00561 0.00000 -0.01846
|
|
142 15G-2 0.00000 -0.01101 0.00000 -0.00795 0.00000
|
|
143 15G+3 0.00000 0.01591 0.00000 -0.00791 0.00000
|
|
144 15G-3 0.02899 0.00000 -0.01460 0.00000 -0.00430
|
|
145 15G+4 0.01465 0.00000 -0.01415 0.00000 -0.01665
|
|
146 15G-4 0.00000 -0.02181 0.00000 0.00255 0.00000
|
|
147 3 H 1S -0.00287 -0.00497 0.00088 -0.00152 -0.00886
|
|
148 2S 1.12184 1.94309 -0.24353 0.42180 0.94811
|
|
149 3S -4.72259 -8.17976 1.79699 -3.11247 0.82932
|
|
150 4S -2.17738 -3.77134 0.73150 -1.26700 -2.24371
|
|
151 5S -0.17142 -0.29690 0.00671 -0.01162 -0.03801
|
|
152 6PX -0.00004 -0.03673 -0.00219 0.00130 -0.00655
|
|
153 6PY 0.03669 0.00004 -0.00123 -0.00219 0.00378
|
|
154 6PZ 0.00752 0.01302 0.00026 -0.00045 0.01738
|
|
155 7PX -0.09163 0.10520 0.06031 -0.06981 0.02700
|
|
156 7PY -0.21101 0.09163 -0.00017 0.06031 -0.01559
|
|
157 7PZ -0.00543 -0.00941 -0.02631 0.04557 -0.13783
|
|
158 8PX 2.93064 2.57216 -0.98596 2.33284 0.32026
|
|
159 8PY 0.81185 -2.93064 1.19435 -0.98596 -0.18490
|
|
160 8PZ -1.23706 -2.14266 0.63078 -1.09254 1.65454
|
|
161 9PX 1.97795 2.04857 -0.16373 1.51652 1.35216
|
|
162 9PY 0.23537 -1.97795 1.32746 -0.16373 -0.78067
|
|
163 9PZ -0.72151 -1.24970 0.21530 -0.37290 0.92686
|
|
164 10D 0 -0.00509 -0.00882 0.00789 -0.01367 0.01780
|
|
165 10D+1 -0.02459 -0.03993 0.01843 -0.01723 0.01385
|
|
166 10D-1 0.01154 0.02459 0.00404 0.01843 -0.00800
|
|
167 10D+2 0.02377 0.01176 -0.02028 -0.00067 0.00142
|
|
168 10D-2 -0.01176 -0.03735 -0.00067 -0.01950 -0.00245
|
|
169 11D 0 0.07063 0.12234 -0.06506 0.11268 -0.03580
|
|
170 11D+1 0.27531 0.44786 -0.16532 0.20078 -0.09020
|
|
171 11D-1 -0.12996 -0.27531 0.00988 -0.16532 0.05207
|
|
172 11D+2 -0.23700 -0.18793 0.15085 -0.05625 -0.03251
|
|
173 11D-2 0.18793 0.45400 -0.05625 0.21580 0.05630
|
|
174 12D 0 0.22102 0.38282 -0.22157 0.38376 0.94956
|
|
175 12D+1 0.85855 1.05667 -0.20128 0.71990 -0.63024
|
|
176 12D-1 -0.06531 -0.85855 0.48748 -0.20128 0.36387
|
|
177 12D+2 -1.53667 0.14468 -0.33763 -0.91759 -0.39673
|
|
178 12D-2 -0.14468 1.36960 -0.91759 0.72191 0.68715
|
|
179 13F 0 0.00226 0.00392 -0.03934 0.06814 -0.03182
|
|
180 13F+1 0.02893 -0.01451 -0.01854 0.02593 -0.01965
|
|
181 13F-1 0.04791 -0.02893 0.00452 -0.01854 0.01134
|
|
182 13F+2 0.00448 -0.01151 -0.01478 0.03638 -0.02617
|
|
183 13F-2 0.01151 0.00880 0.03638 -0.05679 0.04533
|
|
184 13F+3 0.01619 -0.00935 -0.00027 -0.00016 0.00000
|
|
185 13F-3 -0.01953 -0.03382 0.01452 -0.02515 0.00403
|
|
186 14F 0 0.18889 0.32717 0.19909 -0.34484 0.28416
|
|
187 14F+1 -0.27580 0.09434 0.15384 -0.18429 -0.15179
|
|
188 14F-1 -0.41280 0.27580 -0.00664 0.15384 0.08764
|
|
189 14F+2 -0.29888 -0.11488 0.14278 -0.45188 0.22265
|
|
190 14F-2 0.11488 0.43154 -0.45188 0.66456 -0.38564
|
|
191 14F+3 0.21102 -0.12183 -0.00052 -0.00030 0.00000
|
|
192 14F-3 -0.08786 -0.15217 0.03441 -0.05961 -0.24694
|
|
193 15G 0 0.00159 0.00275 -0.00256 0.00444 -0.01363
|
|
194 15G+1 -0.01454 -0.02038 0.00199 -0.00778 -0.01091
|
|
195 15G-1 0.00358 0.01454 -0.00549 0.00199 0.00630
|
|
196 15G+2 0.00728 -0.00646 -0.00456 -0.00587 0.00923
|
|
197 15G-2 0.00646 0.00018 -0.00587 0.00222 -0.01599
|
|
198 15G+3 0.01378 -0.00795 0.00685 0.00396 0.00000
|
|
199 15G-3 -0.01449 -0.02510 0.00730 -0.01265 -0.00430
|
|
200 15G+4 -0.01269 0.01579 -0.00545 0.00502 0.00832
|
|
201 15G-4 0.01579 0.00554 -0.00502 0.01125 0.01442
|
|
202 4 H 1S -0.00287 0.00497 0.00088 0.00152 -0.00886
|
|
203 2S 1.12184 -1.94309 -0.24353 -0.42180 0.94811
|
|
204 3S -4.72259 8.17976 1.79699 3.11247 0.82932
|
|
205 4S -2.17738 3.77134 0.73150 1.26700 -2.24371
|
|
206 5S -0.17142 0.29690 0.00671 0.01162 -0.03801
|
|
207 6PX 0.00004 -0.03673 0.00219 0.00130 0.00655
|
|
208 6PY 0.03669 -0.00004 -0.00123 0.00219 0.00378
|
|
209 6PZ 0.00752 -0.01302 0.00026 0.00045 0.01738
|
|
210 7PX 0.09163 0.10520 -0.06031 -0.06981 -0.02700
|
|
211 7PY -0.21101 -0.09163 -0.00017 -0.06031 -0.01559
|
|
212 7PZ -0.00543 0.00941 -0.02631 -0.04557 -0.13783
|
|
213 8PX -2.93064 2.57216 0.98596 2.33284 -0.32026
|
|
214 8PY 0.81185 2.93064 1.19435 0.98596 -0.18490
|
|
215 8PZ -1.23706 2.14266 0.63078 1.09254 1.65454
|
|
216 9PX -1.97795 2.04857 0.16373 1.51652 -1.35216
|
|
217 9PY 0.23537 1.97795 1.32746 0.16373 -0.78067
|
|
218 9PZ -0.72151 1.24970 0.21530 0.37290 0.92686
|
|
219 10D 0 -0.00509 0.00882 0.00789 0.01367 0.01780
|
|
220 10D+1 0.02459 -0.03993 -0.01843 -0.01723 -0.01385
|
|
221 10D-1 0.01154 -0.02459 0.00404 -0.01843 -0.00800
|
|
222 10D+2 0.02377 -0.01176 -0.02028 0.00067 0.00142
|
|
223 10D-2 0.01176 -0.03735 0.00067 -0.01950 0.00245
|
|
224 11D 0 0.07063 -0.12234 -0.06506 -0.11268 -0.03580
|
|
225 11D+1 -0.27531 0.44786 0.16532 0.20078 0.09020
|
|
226 11D-1 -0.12996 0.27531 0.00988 0.16532 0.05207
|
|
227 11D+2 -0.23700 0.18793 0.15085 0.05625 -0.03251
|
|
228 11D-2 -0.18793 0.45400 0.05625 0.21580 -0.05630
|
|
229 12D 0 0.22102 -0.38282 -0.22157 -0.38376 0.94956
|
|
230 12D+1 -0.85855 1.05667 0.20128 0.71990 0.63024
|
|
231 12D-1 -0.06531 0.85855 0.48748 0.20128 0.36387
|
|
232 12D+2 -1.53667 -0.14468 -0.33763 0.91759 -0.39673
|
|
233 12D-2 0.14468 1.36960 0.91759 0.72191 -0.68715
|
|
234 13F 0 0.00226 -0.00392 -0.03934 -0.06814 -0.03182
|
|
235 13F+1 -0.02893 -0.01451 0.01854 0.02593 0.01965
|
|
236 13F-1 0.04791 0.02893 0.00452 0.01854 0.01134
|
|
237 13F+2 0.00448 0.01151 -0.01478 -0.03638 -0.02617
|
|
238 13F-2 -0.01151 0.00880 -0.03638 -0.05679 -0.04533
|
|
239 13F+3 -0.01619 -0.00935 0.00027 -0.00016 0.00000
|
|
240 13F-3 -0.01953 0.03382 0.01452 0.02515 0.00403
|
|
241 14F 0 0.18889 -0.32717 0.19909 0.34484 0.28416
|
|
242 14F+1 0.27580 0.09434 -0.15384 -0.18429 0.15179
|
|
243 14F-1 -0.41280 -0.27580 -0.00664 -0.15384 0.08764
|
|
244 14F+2 -0.29888 0.11488 0.14278 0.45188 0.22265
|
|
245 14F-2 -0.11488 0.43154 0.45188 0.66456 0.38564
|
|
246 14F+3 -0.21102 -0.12183 0.00052 -0.00030 0.00000
|
|
247 14F-3 -0.08786 0.15217 0.03441 0.05961 -0.24694
|
|
248 15G 0 0.00159 -0.00275 -0.00256 -0.00444 -0.01363
|
|
249 15G+1 0.01454 -0.02038 -0.00199 -0.00778 0.01091
|
|
250 15G-1 0.00358 -0.01454 -0.00549 -0.00199 0.00630
|
|
251 15G+2 0.00728 0.00646 -0.00456 0.00587 0.00923
|
|
252 15G-2 -0.00646 0.00018 0.00587 0.00222 0.01599
|
|
253 15G+3 -0.01378 -0.00795 -0.00685 0.00396 0.00000
|
|
254 15G-3 -0.01449 0.02510 0.00730 0.01265 -0.00430
|
|
255 15G+4 -0.01269 -0.01579 -0.00545 -0.00502 0.00832
|
|
256 15G-4 -0.01579 0.00554 0.00502 0.01125 -0.01442
|
|
81 82 83 84 85
|
|
(A2)--V (E)--V (E)--V (A1)--V (E)--V
|
|
Eigenvalues -- 4.29768 4.37414 4.37414 4.43331 4.52388
|
|
1 1 N 1S 0.00000 0.00000 0.00000 -0.09389 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 -0.09130 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 -1.55505 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 1.64415 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 39.50429 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 11.84647 0.00000
|
|
7 7PX 0.00000 0.00000 0.02490 0.00000 0.00000
|
|
8 7PY 0.00000 0.02490 0.00000 0.00000 0.05747
|
|
9 7PZ 0.00000 0.00000 0.00000 0.07159 0.00000
|
|
10 8PX 0.00000 0.00000 0.71292 0.00000 0.00000
|
|
11 8PY 0.00000 0.71292 0.00000 0.00000 0.57070
|
|
12 8PZ 0.00000 0.00000 0.00000 0.64062 0.00000
|
|
13 9PX 0.00000 0.00000 -8.98427 0.00000 0.00000
|
|
14 9PY 0.00000 -8.98427 0.00000 0.00000 -6.57308
|
|
15 9PZ 0.00000 0.00000 0.00000 -6.00279 0.00000
|
|
16 10PX 0.00000 0.00000 -4.68829 0.00000 0.00000
|
|
17 10PY 0.00000 -4.68829 0.00000 0.00000 -3.25703
|
|
18 10PZ 0.00000 0.00000 0.00000 -5.05705 0.00000
|
|
19 11PX 0.00000 0.00000 -0.40909 0.00000 0.00000
|
|
20 11PY 0.00000 -0.40909 0.00000 0.00000 -0.45957
|
|
21 11PZ 0.00000 0.00000 0.00000 -0.72442 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 -0.00717 0.00000
|
|
23 12D+1 0.00000 0.00000 -0.04942 0.00000 0.00000
|
|
24 12D-1 0.00000 -0.04942 0.00000 0.00000 -0.01855
|
|
25 12D+2 0.00000 -0.00930 0.00000 0.00000 -0.00650
|
|
26 12D-2 0.00000 0.00000 -0.00930 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.10913 0.00000
|
|
28 13D+1 0.00000 0.00000 0.17460 0.00000 0.00000
|
|
29 13D-1 0.00000 0.17460 0.00000 0.00000 0.15272
|
|
30 13D+2 0.00000 -0.01820 0.00000 0.00000 -0.06065
|
|
31 13D-2 0.00000 0.00000 -0.01820 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 -4.00964 0.00000
|
|
33 14D+1 0.00000 0.00000 0.97815 0.00000 0.00000
|
|
34 14D-1 0.00000 0.97815 0.00000 0.00000 2.32315
|
|
35 14D+2 0.00000 4.79485 0.00000 0.00000 4.67902
|
|
36 14D-2 0.00000 0.00000 4.79485 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 -2.04784 0.00000
|
|
38 15D+1 0.00000 0.00000 -0.61639 0.00000 0.00000
|
|
39 15D-1 0.00000 -0.61639 0.00000 0.00000 0.79423
|
|
40 15D+2 0.00000 2.73254 0.00000 0.00000 1.65127
|
|
41 15D-2 0.00000 0.00000 2.73254 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00264 0.00000
|
|
43 16F+1 0.00000 0.00000 -0.01596 0.00000 0.00000
|
|
44 16F-1 0.00000 -0.01596 0.00000 0.00000 0.02589
|
|
45 16F+2 0.00000 0.04121 0.00000 0.00000 0.03872
|
|
46 16F-2 0.00000 0.00000 0.04121 0.00000 0.00000
|
|
47 16F+3 -0.01930 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.03995 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.35369 0.00000
|
|
50 17F+1 0.00000 0.00000 0.17664 0.00000 0.00000
|
|
51 17F-1 0.00000 0.17664 0.00000 0.00000 -0.16588
|
|
52 17F+2 0.00000 -0.49356 0.00000 0.00000 -0.56655
|
|
53 17F-2 0.00000 0.00000 -0.49356 0.00000 0.00000
|
|
54 17F+3 0.19472 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 -0.75714 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.77386 0.00000
|
|
57 18F+1 0.00000 0.00000 1.46449 0.00000 0.00000
|
|
58 18F-1 0.00000 1.46449 0.00000 0.00000 -0.06655
|
|
59 18F+2 0.00000 -1.79755 0.00000 0.00000 -1.13556
|
|
60 18F-2 0.00000 0.00000 -1.79755 0.00000 0.00000
|
|
61 18F+3 1.82599 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 -2.40630 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 -0.02505 0.00000
|
|
64 19G+1 0.00000 0.00000 -0.01818 0.00000 0.00000
|
|
65 19G-1 0.00000 -0.01818 0.00000 0.00000 -0.03134
|
|
66 19G+2 0.00000 -0.01625 0.00000 0.00000 0.01119
|
|
67 19G-2 0.00000 0.00000 -0.01625 0.00000 0.00000
|
|
68 19G+3 -0.00787 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.04266 0.00000
|
|
70 19G+4 0.00000 -0.01401 0.00000 0.00000 -0.02732
|
|
71 19G-4 0.00000 0.00000 0.01401 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.45690 0.00000
|
|
73 20G+1 0.00000 0.00000 -0.08369 0.00000 0.00000
|
|
74 20G-1 0.00000 -0.08369 0.00000 0.00000 0.05592
|
|
75 20G+2 0.00000 0.16362 0.00000 0.00000 -0.07627
|
|
76 20G-2 0.00000 0.00000 0.16362 0.00000 0.00000
|
|
77 20G+3 -0.09252 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.06523 0.00000
|
|
79 20G+4 0.00000 -0.06884 0.00000 0.00000 0.44236
|
|
80 20G-4 0.00000 0.00000 0.06884 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 -0.03061 0.00000
|
|
82 21H+1 0.00000 0.00000 -0.02386 0.00000 0.00000
|
|
83 21H-1 0.00000 -0.02386 0.00000 0.00000 0.01229
|
|
84 21H+2 0.00000 0.00108 0.00000 0.00000 0.05884
|
|
85 21H-2 0.00000 0.00000 0.00108 0.00000 0.00000
|
|
86 21H+3 -0.00074 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.07096 0.00000
|
|
88 21H+4 0.00000 -0.02506 0.00000 0.00000 -0.05878
|
|
89 21H-4 0.00000 0.00000 0.02506 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.02199 0.00000 0.00000
|
|
91 21H-5 0.00000 -0.02199 0.00000 0.00000 -0.02543
|
|
92 2 H 1S 0.00000 0.00923 0.00000 -0.03355 0.02512
|
|
93 2S 0.00000 -1.31683 0.00000 1.65007 -1.14305
|
|
94 3S 0.00000 11.77926 0.00000 -13.09841 10.21471
|
|
95 4S 0.00000 5.01360 0.00000 -6.52283 3.97240
|
|
96 5S 0.00000 0.18961 0.00000 -0.18291 0.13605
|
|
97 6PX 0.00978 0.00000 -0.01493 0.00000 0.00000
|
|
98 6PY 0.00000 0.01737 0.00000 0.01518 -0.03002
|
|
99 6PZ 0.00000 0.01692 0.00000 0.00294 -0.01696
|
|
100 7PX -0.07226 0.00000 0.16376 0.00000 0.00000
|
|
101 7PY 0.00000 0.07795 0.00000 -0.29237 0.44719
|
|
102 7PZ 0.00000 -0.21851 0.00000 0.13421 0.00671
|
|
103 8PX 1.26038 0.00000 -1.58599 0.00000 0.00000
|
|
104 8PY 0.00000 -5.75236 0.00000 5.99589 -6.02855
|
|
105 8PZ 0.00000 3.92177 0.00000 -3.77028 2.06141
|
|
106 9PX 0.55055 0.00000 -0.98305 0.00000 0.00000
|
|
107 9PY 0.00000 -3.46469 0.00000 3.95126 -2.82725
|
|
108 9PZ 0.00000 2.28602 0.00000 -2.27861 1.12879
|
|
109 10D 0 0.00000 -0.00003 0.00000 0.01609 0.05639
|
|
110 10D+1 0.02119 0.00000 -0.02022 0.00000 0.00000
|
|
111 10D-1 0.00000 0.03936 0.00000 -0.06287 0.08237
|
|
112 10D+2 0.00000 0.07646 0.00000 -0.03478 0.01580
|
|
113 10D-2 0.00521 0.00000 -0.06907 0.00000 0.00000
|
|
114 11D 0 0.00000 -0.12182 0.00000 -0.11170 -0.38746
|
|
115 11D+1 -0.12031 0.00000 0.07652 0.00000 0.00000
|
|
116 11D-1 0.00000 -0.41341 0.00000 0.57870 -0.66046
|
|
117 11D+2 0.00000 -0.70258 0.00000 0.30818 -0.27481
|
|
118 11D-2 -0.03612 0.00000 0.40932 0.00000 0.00000
|
|
119 12D 0 0.00000 -0.24015 0.00000 0.23164 -0.92684
|
|
120 12D+1 0.57500 0.00000 0.23341 0.00000 0.00000
|
|
121 12D-1 0.00000 -2.63124 0.00000 2.29193 -1.43055
|
|
122 12D+2 0.00000 -1.86882 0.00000 1.96312 -1.90846
|
|
123 12D-2 -0.77987 0.00000 1.00617 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00975 0.00000 0.01693 0.05077
|
|
125 13F+1 -0.07209 0.00000 -0.05697 0.00000 0.00000
|
|
126 13F-1 0.00000 0.01483 0.00000 -0.00604 -0.02506
|
|
127 13F+2 0.00000 0.01125 0.00000 -0.01003 -0.00280
|
|
128 13F-2 -0.02419 0.00000 0.05752 0.00000 0.00000
|
|
129 13F+3 0.04394 0.00000 -0.03987 0.00000 0.00000
|
|
130 13F-3 0.00000 -0.02706 0.00000 0.00761 0.03309
|
|
131 14F 0 0.00000 -0.52780 0.00000 0.30192 -0.87284
|
|
132 14F+1 0.57851 0.00000 0.60549 0.00000 0.00000
|
|
133 14F-1 0.00000 -0.19840 0.00000 0.36231 0.43281
|
|
134 14F+2 0.00000 -0.77266 0.00000 0.83271 -0.48720
|
|
135 14F-2 0.06766 0.00000 -0.40775 0.00000 0.00000
|
|
136 14F+3 -0.48266 0.00000 0.74549 0.00000 0.00000
|
|
137 14F-3 0.00000 0.79280 0.00000 -0.46849 0.20767
|
|
138 15G 0 0.00000 -0.01613 0.00000 0.02307 -0.00267
|
|
139 15G+1 -0.00582 0.00000 0.00092 0.00000 0.00000
|
|
140 15G-1 0.00000 0.02316 0.00000 -0.02495 0.02701
|
|
141 15G+2 0.00000 -0.01806 0.00000 0.02243 0.01091
|
|
142 15G-2 0.00000 0.00000 -0.01817 0.00000 0.00000
|
|
143 15G+3 -0.01601 0.00000 0.00236 0.00000 0.00000
|
|
144 15G-3 0.00000 0.02956 0.00000 -0.04039 0.01774
|
|
145 15G+4 0.00000 0.02670 0.00000 -0.02029 0.01346
|
|
146 15G-4 0.00550 0.00000 -0.02700 0.00000 0.00000
|
|
147 3 H 1S 0.00000 -0.00461 0.00799 -0.03355 -0.01256
|
|
148 2S 0.00000 0.65841 -1.14040 1.65007 0.57152
|
|
149 3S 0.00000 -5.88963 10.20114 -13.09841 -5.10736
|
|
150 4S 0.00000 -2.50680 4.34191 -6.52283 -1.98620
|
|
151 5S 0.00000 -0.09480 0.16421 -0.18291 -0.06802
|
|
152 6PX -0.00489 -0.01398 0.00929 0.01315 0.02362
|
|
153 6PY -0.00847 -0.00685 -0.01398 -0.00759 0.01089
|
|
154 6PZ 0.00000 -0.00846 0.01466 0.00294 0.00848
|
|
155 7PX 0.03613 0.03716 0.09940 -0.25320 -0.22902
|
|
156 7PY 0.06258 0.14231 0.03716 0.14618 0.05052
|
|
157 7PZ 0.00000 0.10925 -0.18923 0.13421 -0.00335
|
|
158 8PX -0.63019 1.80409 -4.71077 5.19260 1.98056
|
|
159 8PY -1.09152 -2.62758 1.80409 -2.99795 -2.59811
|
|
160 8PZ 0.00000 -1.96088 3.39635 -3.77028 -1.03071
|
|
161 9PX -0.27528 1.07458 -2.84428 3.42189 0.86454
|
|
162 9PY -0.47679 -1.60346 1.07458 -1.97563 -1.32983
|
|
163 9PZ 0.00000 -1.14301 1.97975 -2.27861 -0.56440
|
|
164 10D 0 0.00000 0.00002 -0.00003 0.01609 -0.02819
|
|
165 10D+1 -0.01059 -0.02580 0.02447 -0.05444 -0.03621
|
|
166 10D-1 -0.01835 -0.00533 -0.02580 0.03143 0.01965
|
|
167 10D+2 -0.00452 -0.03268 -0.06301 0.01739 -0.02206
|
|
168 10D-2 -0.00261 -0.06301 0.04008 -0.03012 -0.02186
|
|
169 11D 0 0.00000 0.06091 -0.10550 -0.11170 0.19373
|
|
170 11D+1 0.06015 0.21215 -0.29093 0.50117 0.26191
|
|
171 11D-1 0.10419 -0.04596 0.21215 -0.28935 -0.20681
|
|
172 11D+2 0.03128 0.13135 0.48147 -0.15409 0.19411
|
|
173 11D-2 0.01806 0.48147 -0.42461 0.26689 0.27073
|
|
174 12D 0 0.00000 0.12008 -0.20798 0.23164 0.46342
|
|
175 12D+1 -0.28750 1.24043 -1.91508 1.98487 0.30437
|
|
176 12D-1 -0.49796 -0.48275 1.24043 -1.14597 -0.90337
|
|
177 12D+2 0.67539 0.28742 1.24491 -0.98156 0.35962
|
|
178 12D-2 0.38994 1.24491 -1.15007 1.70011 1.30948
|
|
179 13F 0 0.00000 -0.00488 0.00844 0.01693 -0.02539
|
|
180 13F+1 0.03605 -0.03109 -0.00312 -0.00523 0.00833
|
|
181 13F-1 0.06243 -0.03902 -0.03109 0.00302 -0.01063
|
|
182 13F+2 0.02095 0.04595 0.02004 0.00501 -0.03659
|
|
183 13F-2 0.01210 0.02004 0.02281 -0.00868 -0.01951
|
|
184 13F+3 0.04394 0.03453 0.01994 0.00000 -0.00596
|
|
185 13F-3 0.00000 0.01353 -0.02344 0.00761 -0.01655
|
|
186 14F 0 0.00000 0.26390 -0.45708 0.30192 0.43642
|
|
187 14F+1 -0.28925 0.34809 0.00257 0.31377 -0.18251
|
|
188 14F-1 -0.50100 0.40452 0.34809 -0.18115 0.11669
|
|
189 14F+2 -0.05860 -0.49898 0.15801 -0.41635 0.54872
|
|
190 14F-2 -0.03383 0.15801 -0.68143 0.72115 0.59809
|
|
191 14F+3 -0.48266 -0.64561 -0.37274 0.00000 -0.40419
|
|
192 14F-3 0.00000 -0.39640 0.68658 -0.46849 -0.10384
|
|
193 15G 0 0.00000 0.00806 -0.01397 0.02307 0.00133
|
|
194 15G+1 0.00291 -0.00963 0.01760 -0.02161 -0.00780
|
|
195 15G-1 0.00504 0.00648 -0.00963 0.01247 0.01350
|
|
196 15G+2 0.00000 -0.01814 -0.00004 -0.01122 0.01571
|
|
197 15G-2 0.00000 -0.00004 -0.01809 0.01943 0.00277
|
|
198 15G+3 -0.01601 -0.00205 -0.00118 0.00000 -0.03297
|
|
199 15G-3 0.00000 -0.01478 0.02560 -0.04039 -0.00887
|
|
200 15G+4 0.00476 0.02693 0.00013 0.01015 0.02723
|
|
201 15G-4 -0.00275 -0.00013 -0.02678 0.01758 -0.00794
|
|
202 4 H 1S 0.00000 -0.00461 -0.00799 -0.03355 -0.01256
|
|
203 2S 0.00000 0.65841 1.14040 1.65007 0.57152
|
|
204 3S 0.00000 -5.88963 -10.20114 -13.09841 -5.10736
|
|
205 4S 0.00000 -2.50680 -4.34191 -6.52283 -1.98620
|
|
206 5S 0.00000 -0.09480 -0.16421 -0.18291 -0.06802
|
|
207 6PX -0.00489 0.01398 0.00929 -0.01315 -0.02362
|
|
208 6PY 0.00847 -0.00685 0.01398 -0.00759 0.01089
|
|
209 6PZ 0.00000 -0.00846 -0.01466 0.00294 0.00848
|
|
210 7PX 0.03613 -0.03716 0.09940 0.25320 0.22902
|
|
211 7PY -0.06258 0.14231 -0.03716 0.14618 0.05052
|
|
212 7PZ 0.00000 0.10925 0.18923 0.13421 -0.00335
|
|
213 8PX -0.63019 -1.80409 -4.71077 -5.19260 -1.98056
|
|
214 8PY 1.09152 -2.62758 -1.80409 -2.99795 -2.59811
|
|
215 8PZ 0.00000 -1.96088 -3.39635 -3.77028 -1.03071
|
|
216 9PX -0.27528 -1.07458 -2.84428 -3.42189 -0.86454
|
|
217 9PY 0.47679 -1.60346 -1.07458 -1.97563 -1.32983
|
|
218 9PZ 0.00000 -1.14301 -1.97975 -2.27861 -0.56440
|
|
219 10D 0 0.00000 0.00002 0.00003 0.01609 -0.02819
|
|
220 10D+1 -0.01059 0.02580 0.02447 0.05444 0.03621
|
|
221 10D-1 0.01835 -0.00533 0.02580 0.03143 0.01965
|
|
222 10D+2 0.00452 -0.03268 0.06301 0.01739 -0.02206
|
|
223 10D-2 -0.00261 0.06301 0.04008 0.03012 0.02186
|
|
224 11D 0 0.00000 0.06091 0.10550 -0.11170 0.19373
|
|
225 11D+1 0.06015 -0.21215 -0.29093 -0.50117 -0.26191
|
|
226 11D-1 -0.10419 -0.04596 -0.21215 -0.28935 -0.20681
|
|
227 11D+2 -0.03128 0.13135 -0.48147 -0.15409 0.19411
|
|
228 11D-2 0.01806 -0.48147 -0.42461 -0.26689 -0.27073
|
|
229 12D 0 0.00000 0.12008 0.20798 0.23164 0.46342
|
|
230 12D+1 -0.28750 -1.24043 -1.91508 -1.98487 -0.30437
|
|
231 12D-1 0.49796 -0.48275 -1.24043 -1.14597 -0.90337
|
|
232 12D+2 -0.67539 0.28742 -1.24491 -0.98156 0.35962
|
|
233 12D-2 0.38994 -1.24491 -1.15007 -1.70011 -1.30948
|
|
234 13F 0 0.00000 -0.00488 -0.00844 0.01693 -0.02539
|
|
235 13F+1 0.03605 0.03109 -0.00312 0.00523 -0.00833
|
|
236 13F-1 -0.06243 -0.03902 0.03109 0.00302 -0.01063
|
|
237 13F+2 -0.02095 0.04595 -0.02004 0.00501 -0.03659
|
|
238 13F-2 0.01210 -0.02004 0.02281 0.00868 0.01951
|
|
239 13F+3 0.04394 -0.03453 0.01994 0.00000 0.00596
|
|
240 13F-3 0.00000 0.01353 0.02344 0.00761 -0.01655
|
|
241 14F 0 0.00000 0.26390 0.45708 0.30192 0.43642
|
|
242 14F+1 -0.28925 -0.34809 0.00257 -0.31377 0.18251
|
|
243 14F-1 0.50100 0.40452 -0.34809 -0.18115 0.11669
|
|
244 14F+2 0.05860 -0.49898 -0.15801 -0.41635 0.54872
|
|
245 14F-2 -0.03383 -0.15801 -0.68143 -0.72115 -0.59809
|
|
246 14F+3 -0.48266 0.64561 -0.37274 0.00000 0.40419
|
|
247 14F-3 0.00000 -0.39640 -0.68658 -0.46849 -0.10384
|
|
248 15G 0 0.00000 0.00806 0.01397 0.02307 0.00133
|
|
249 15G+1 0.00291 0.00963 0.01760 0.02161 0.00780
|
|
250 15G-1 -0.00504 0.00648 0.00963 0.01247 0.01350
|
|
251 15G+2 0.00000 -0.01814 0.00004 -0.01122 0.01571
|
|
252 15G-2 0.00000 0.00004 -0.01809 -0.01943 -0.00277
|
|
253 15G+3 -0.01601 0.00205 -0.00118 0.00000 0.03297
|
|
254 15G-3 0.00000 -0.01478 -0.02560 -0.04039 -0.00887
|
|
255 15G+4 -0.00476 0.02693 -0.00013 0.01015 0.02723
|
|
256 15G-4 -0.00275 0.00013 -0.02678 -0.01758 0.00794
|
|
86 87 88 89 90
|
|
(E)--V (A2)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 4.52388 4.55113 4.64205 4.64205 4.74389
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
7 7PX 0.05747 0.00000 0.00000 0.03818 0.03310
|
|
8 7PY 0.00000 0.00000 0.03818 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX 0.57070 0.00000 0.00000 0.17826 0.04406
|
|
11 8PY 0.00000 0.00000 0.17826 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX -6.57308 0.00000 0.00000 -2.50877 0.53199
|
|
14 9PY 0.00000 0.00000 -2.50877 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX -3.25703 0.00000 0.00000 -1.32779 -1.77486
|
|
17 10PY 0.00000 0.00000 -1.32779 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX -0.45957 0.00000 0.00000 0.09972 -0.35272
|
|
20 11PY 0.00000 0.00000 0.09972 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 -0.01855 0.00000 0.00000 0.01846 -0.01338
|
|
24 12D-1 0.00000 0.00000 0.01846 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 -0.00769 0.00000 0.00000
|
|
26 12D-2 -0.00650 0.00000 0.00000 -0.00769 0.02288
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.15272 0.00000 0.00000 -0.16449 0.19373
|
|
29 13D-1 0.00000 0.00000 -0.16449 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.06508 0.00000 0.00000
|
|
31 13D-2 -0.06065 0.00000 0.00000 0.06508 -0.22473
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 2.32315 0.00000 0.00000 4.03064 -1.53701
|
|
34 14D-1 0.00000 0.00000 4.03064 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 1.45462 0.00000 0.00000
|
|
36 14D-2 4.67902 0.00000 0.00000 1.45462 4.09138
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.79423 0.00000 0.00000 1.36766 0.87169
|
|
39 15D-1 0.00000 0.00000 1.36766 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.42039 0.00000 0.00000
|
|
41 15D-2 1.65127 0.00000 0.00000 0.42039 1.60668
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.02589 0.00000 0.00000 0.07183 -0.02317
|
|
44 16F-1 0.00000 0.00000 0.07183 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.06557 0.00000 0.00000
|
|
46 16F-2 0.03872 0.00000 0.00000 0.06557 0.02724
|
|
47 16F+3 0.00000 -0.10529 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 -0.16588 0.00000 0.00000 -0.46703 0.19460
|
|
51 17F-1 0.00000 0.00000 -0.46703 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 -0.58960 0.00000 0.00000
|
|
53 17F-2 -0.56655 0.00000 0.00000 -0.58960 -0.29213
|
|
54 17F+3 0.00000 0.72686 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 -0.06655 0.00000 0.00000 -1.67263 -0.17540
|
|
58 18F-1 0.00000 0.00000 -1.67263 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 -1.13171 0.00000 0.00000
|
|
60 18F-2 -1.13556 0.00000 0.00000 -1.13171 0.23981
|
|
61 18F+3 0.00000 2.16112 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 -0.03134 0.00000 0.00000 -0.00754 0.00626
|
|
65 19G-1 0.00000 0.00000 -0.00754 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 -0.00871 0.00000 0.00000
|
|
67 19G-2 0.01119 0.00000 0.00000 -0.00871 0.01320
|
|
68 19G+3 0.00000 0.01378 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 -0.02391 0.00000 0.00000
|
|
71 19G-4 0.02732 0.00000 0.00000 0.02391 0.02191
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.05592 0.00000 0.00000 0.07446 0.01816
|
|
74 20G-1 0.00000 0.00000 0.07446 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.67991 0.00000 0.00000
|
|
76 20G-2 -0.07627 0.00000 0.00000 0.67991 -0.47087
|
|
77 20G+3 0.00000 -0.90375 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.47119 0.00000 0.00000
|
|
80 20G-4 -0.44236 0.00000 0.00000 -0.47119 -0.49144
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.01229 0.00000 0.00000 0.07014 -0.04468
|
|
83 21H-1 0.00000 0.00000 0.07014 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 -0.03656 0.00000 0.00000
|
|
85 21H-2 0.05884 0.00000 0.00000 -0.03656 0.02666
|
|
86 21H+3 0.00000 0.03275 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 -0.01060 0.00000 0.00000
|
|
89 21H-4 0.05878 0.00000 0.00000 0.01060 0.05361
|
|
90 21H+5 0.02543 0.00000 0.00000 0.00667 0.10183
|
|
91 21H-5 0.00000 0.00000 -0.00667 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.01097 0.00000 0.00000
|
|
93 2S 0.00000 0.00000 -0.60891 0.00000 0.00000
|
|
94 3S 0.00000 0.00000 5.87995 0.00000 0.00000
|
|
95 4S 0.00000 0.00000 2.57520 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 -0.08031 0.00000 0.00000
|
|
97 6PX 0.02453 -0.03078 0.00000 0.00525 0.00194
|
|
98 6PY 0.00000 0.00000 0.00417 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.04049 0.00000 0.00000
|
|
100 7PX -0.08171 0.12627 0.00000 -0.00924 0.11025
|
|
101 7PY 0.00000 0.00000 0.16798 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 -0.21289 0.00000 0.00000
|
|
103 8PX -1.45463 1.93209 0.00000 -0.69769 -1.66151
|
|
104 8PY 0.00000 0.00000 -4.43416 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 -1.02350 0.00000 0.00000
|
|
106 9PX -0.83068 1.30624 0.00000 -0.61979 -0.58311
|
|
107 9PY 0.00000 0.00000 -2.50748 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 -0.85079 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.02859 0.00000 0.00000
|
|
110 10D+1 -0.00126 -0.06905 0.00000 0.02824 -0.05189
|
|
111 10D-1 0.00000 0.00000 -0.05340 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.08939 0.00000 0.00000
|
|
113 10D-2 -0.03468 0.04564 0.00000 -0.01379 -0.04856
|
|
114 11D 0 0.00000 0.00000 -0.35439 0.00000 0.00000
|
|
115 11D+1 -0.05560 0.46917 0.00000 -0.19062 0.26576
|
|
116 11D-1 0.00000 0.00000 0.34898 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 -0.74316 0.00000 0.00000
|
|
118 11D-2 0.35042 -0.41930 0.00000 0.17160 0.43475
|
|
119 12D 0 0.00000 0.00000 -1.99855 0.00000 0.00000
|
|
120 12D+1 -0.72764 0.51268 0.00000 -0.29712 -1.58881
|
|
121 12D-1 0.00000 0.00000 0.80117 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 -1.85232 0.00000 0.00000
|
|
123 12D-2 1.11565 -1.71309 0.00000 0.56411 1.12680
|
|
124 13F 0 0.00000 0.00000 -0.02600 0.00000 0.00000
|
|
125 13F+1 -0.00582 0.00530 0.00000 0.02940 0.05053
|
|
126 13F-1 0.00000 0.00000 -0.03254 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 -0.03371 0.00000 0.00000
|
|
128 13F-2 -0.04785 0.02884 0.00000 -0.01213 -0.04252
|
|
129 13F+3 0.00689 0.03067 0.00000 -0.00327 -0.00037
|
|
130 13F-3 0.00000 0.00000 -0.01984 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.13392 0.00000 0.00000
|
|
132 14F+1 0.01131 -0.12553 0.00000 -0.21725 -0.50715
|
|
133 14F-1 0.00000 0.00000 1.34013 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.44199 0.00000 0.00000
|
|
135 14F-2 0.89402 -0.67114 0.00000 0.31041 1.08561
|
|
136 14F+3 0.46671 -0.94385 0.00000 0.29742 0.72974
|
|
137 14F-3 0.00000 0.00000 0.83780 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.04157 0.00000 0.00000
|
|
139 15G+1 0.00900 -0.01226 0.00000 0.00286 0.01550
|
|
140 15G-1 0.00000 0.00000 0.02225 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.06103 0.00000 0.00000
|
|
142 15G-2 0.01731 0.00945 0.00000 -0.00134 0.02222
|
|
143 15G+3 0.03807 -0.03143 0.00000 0.01546 0.06364
|
|
144 15G-3 0.00000 0.00000 -0.01169 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.02592 0.00000 0.00000
|
|
146 15G-4 -0.03181 0.04688 0.00000 -0.01564 -0.03719
|
|
147 3 H 1S 0.02176 0.00000 -0.00548 0.00950 0.00687
|
|
148 2S -0.98991 0.00000 0.30445 -0.52733 -0.34772
|
|
149 3S 8.84620 0.00000 -2.93997 5.09218 2.88194
|
|
150 4S 3.44020 0.00000 -1.28760 2.23019 0.88092
|
|
151 5S 0.11782 0.00000 0.04016 -0.06955 0.00774
|
|
152 6PX -0.01638 0.01539 0.00047 0.00444 -0.01949
|
|
153 6PY 0.02362 0.02666 0.00498 0.00047 0.01237
|
|
154 6PZ -0.01468 0.00000 -0.02025 0.03507 -0.01448
|
|
155 7PX 0.31496 -0.06313 -0.07674 0.12368 0.21079
|
|
156 7PY -0.22902 -0.10935 0.03507 -0.07674 -0.05804
|
|
157 7PZ 0.00581 0.00000 0.10645 -0.18437 0.01428
|
|
158 8PX -4.88507 -0.96605 1.61794 -3.50004 -1.19220
|
|
159 8PY 1.98056 -1.67324 -1.63181 1.61794 -0.27096
|
|
160 8PZ 1.78524 0.00000 0.51175 -0.88638 1.18419
|
|
161 9PX -2.32811 -0.65312 0.81739 -2.03556 -0.10787
|
|
162 9PY 0.86454 -1.13124 -1.09171 0.81739 -0.27438
|
|
163 9PZ 0.97756 0.00000 0.42539 -0.73680 0.65306
|
|
164 10D 0 0.04883 0.00000 -0.01430 0.02476 -0.04433
|
|
165 10D+1 0.06146 0.03453 0.03535 -0.03299 -0.00398
|
|
166 10D-1 -0.03621 0.05980 0.00783 0.03535 -0.02766
|
|
167 10D+2 -0.02186 -0.03953 0.01200 -0.04468 -0.02995
|
|
168 10D-2 0.00318 -0.02282 -0.04468 0.06359 0.00332
|
|
169 11D 0 -0.33555 0.00000 0.17720 -0.30691 0.29037
|
|
170 11D+1 -0.50924 -0.23459 -0.23365 0.21408 -0.08355
|
|
171 11D-1 0.26191 -0.40632 -0.05572 -0.23365 0.20167
|
|
172 11D+2 0.27073 0.36312 -0.05709 0.39610 0.24941
|
|
173 11D-2 -0.11850 0.20965 0.39610 -0.51447 0.00276
|
|
174 12D 0 -0.80267 0.00000 0.99928 -1.73080 0.66414
|
|
175 12D+1 -1.25483 -0.25634 -0.47557 0.52659 -1.02543
|
|
176 12D-1 0.30437 -0.44399 -0.02255 -0.47557 -0.32527
|
|
177 12D+2 1.30948 1.48358 -0.04000 1.04635 0.35422
|
|
178 12D-2 -1.15243 0.85654 1.04635 -1.24821 0.51327
|
|
179 13F 0 0.04397 0.00000 0.01300 -0.02252 -0.03681
|
|
180 13F+1 -0.02025 -0.00265 0.02682 -0.01705 0.05031
|
|
181 13F-1 0.00833 -0.00459 0.01392 0.02682 0.00013
|
|
182 13F+2 -0.01951 -0.02498 -0.01752 0.00934 -0.00829
|
|
183 13F-2 -0.01406 -0.01442 0.00934 -0.02831 -0.02816
|
|
184 13F+3 -0.00344 0.03067 0.00283 0.00164 0.00018
|
|
185 13F-3 0.02866 0.00000 0.00992 -0.01718 -0.01142
|
|
186 14F 0 -0.75590 0.00000 -0.06696 0.11598 0.17908
|
|
187 14F+1 0.32743 0.06277 -0.67436 0.95079 -0.81510
|
|
188 14F-1 -0.18251 0.10871 0.17210 -0.67436 0.17779
|
|
189 14F+2 0.59809 0.58123 0.34330 -0.05698 0.52532
|
|
190 14F-2 -0.14189 0.33557 -0.05698 0.40910 0.17573
|
|
191 14F+3 -0.23336 -0.94385 -0.25757 -0.14871 -0.36487
|
|
192 14F-3 0.17985 0.00000 -0.41890 0.72555 0.01310
|
|
193 15G 0 -0.00231 0.00000 -0.02078 0.03600 -0.02136
|
|
194 15G+1 0.02251 0.00613 -0.00840 0.01740 -0.00038
|
|
195 15G-1 -0.00780 0.01061 0.00771 -0.00840 0.00917
|
|
196 15G+2 0.00277 -0.00819 0.01425 -0.02701 0.02275
|
|
197 15G-2 0.01251 -0.00473 -0.02701 0.04544 -0.01717
|
|
198 15G+3 -0.01903 -0.03143 -0.01339 -0.00773 -0.03182
|
|
199 15G-3 0.01537 0.00000 0.00585 -0.01013 0.00871
|
|
200 15G+4 0.00794 0.04060 0.01821 -0.00445 0.02276
|
|
201 15G-4 -0.01805 -0.02344 0.00445 -0.02335 0.00223
|
|
202 4 H 1S -0.02176 0.00000 -0.00548 -0.00950 -0.00687
|
|
203 2S 0.98991 0.00000 0.30445 0.52733 0.34772
|
|
204 3S -8.84620 0.00000 -2.93997 -5.09218 -2.88194
|
|
205 4S -3.44020 0.00000 -1.28760 -2.23019 -0.88092
|
|
206 5S -0.11782 0.00000 0.04016 0.06955 -0.00774
|
|
207 6PX -0.01638 0.01539 -0.00047 0.00444 -0.01949
|
|
208 6PY -0.02362 -0.02666 0.00498 -0.00047 -0.01237
|
|
209 6PZ 0.01468 0.00000 -0.02025 -0.03507 0.01448
|
|
210 7PX 0.31496 -0.06313 0.07674 0.12368 0.21079
|
|
211 7PY 0.22902 0.10935 0.03507 0.07674 0.05804
|
|
212 7PZ -0.00581 0.00000 0.10645 0.18437 -0.01428
|
|
213 8PX -4.88507 -0.96605 -1.61794 -3.50004 -1.19220
|
|
214 8PY -1.98056 1.67324 -1.63181 -1.61794 0.27096
|
|
215 8PZ -1.78524 0.00000 0.51175 0.88638 -1.18419
|
|
216 9PX -2.32811 -0.65312 -0.81739 -2.03556 -0.10787
|
|
217 9PY -0.86454 1.13124 -1.09171 -0.81739 0.27438
|
|
218 9PZ -0.97756 0.00000 0.42539 0.73680 -0.65306
|
|
219 10D 0 -0.04883 0.00000 -0.01430 -0.02476 0.04433
|
|
220 10D+1 0.06146 0.03453 -0.03535 -0.03299 -0.00398
|
|
221 10D-1 0.03621 -0.05980 0.00783 -0.03535 0.02766
|
|
222 10D+2 0.02186 0.03953 0.01200 0.04468 0.02995
|
|
223 10D-2 0.00318 -0.02282 0.04468 0.06359 0.00332
|
|
224 11D 0 0.33555 0.00000 0.17720 0.30691 -0.29037
|
|
225 11D+1 -0.50924 -0.23459 0.23365 0.21408 -0.08355
|
|
226 11D-1 -0.26191 0.40632 -0.05572 0.23365 -0.20167
|
|
227 11D+2 -0.27073 -0.36312 -0.05709 -0.39610 -0.24941
|
|
228 11D-2 -0.11850 0.20965 -0.39610 -0.51447 0.00276
|
|
229 12D 0 0.80267 0.00000 0.99928 1.73080 -0.66414
|
|
230 12D+1 -1.25483 -0.25634 0.47557 0.52659 -1.02543
|
|
231 12D-1 -0.30437 0.44399 -0.02255 0.47557 0.32527
|
|
232 12D+2 -1.30948 -1.48358 -0.04000 -1.04635 -0.35422
|
|
233 12D-2 -1.15243 0.85654 -1.04635 -1.24821 0.51327
|
|
234 13F 0 -0.04397 0.00000 0.01300 0.02252 0.03681
|
|
235 13F+1 -0.02025 -0.00265 -0.02682 -0.01705 0.05031
|
|
236 13F-1 -0.00833 0.00459 0.01392 -0.02682 -0.00013
|
|
237 13F+2 0.01951 0.02498 -0.01752 -0.00934 0.00829
|
|
238 13F-2 -0.01406 -0.01442 -0.00934 -0.02831 -0.02816
|
|
239 13F+3 -0.00344 0.03067 -0.00283 0.00164 0.00018
|
|
240 13F-3 -0.02866 0.00000 0.00992 0.01718 0.01142
|
|
241 14F 0 0.75590 0.00000 -0.06696 -0.11598 -0.17908
|
|
242 14F+1 0.32743 0.06277 0.67436 0.95079 -0.81510
|
|
243 14F-1 0.18251 -0.10871 0.17210 0.67436 -0.17779
|
|
244 14F+2 -0.59809 -0.58123 0.34330 0.05698 -0.52532
|
|
245 14F-2 -0.14189 0.33557 0.05698 0.40910 0.17573
|
|
246 14F+3 -0.23336 -0.94385 0.25757 -0.14871 -0.36487
|
|
247 14F-3 -0.17985 0.00000 -0.41890 -0.72555 -0.01310
|
|
248 15G 0 0.00231 0.00000 -0.02078 -0.03600 0.02136
|
|
249 15G+1 0.02251 0.00613 0.00840 0.01740 -0.00038
|
|
250 15G-1 0.00780 -0.01061 0.00771 0.00840 -0.00917
|
|
251 15G+2 -0.00277 0.00819 0.01425 0.02701 -0.02275
|
|
252 15G-2 0.01251 -0.00473 0.02701 0.04544 -0.01717
|
|
253 15G+3 -0.01903 -0.03143 0.01339 -0.00773 -0.03182
|
|
254 15G-3 -0.01537 0.00000 0.00585 0.01013 -0.00871
|
|
255 15G+4 -0.00794 -0.04060 0.01821 0.00445 -0.02276
|
|
256 15G-4 -0.01805 -0.02344 -0.00445 -0.02335 0.00223
|
|
91 92 93 94 95
|
|
(E)--V (A1)--V (A1)--V (A1)--V (E)--V
|
|
Eigenvalues -- 4.74389 4.80641 4.94321 4.95522 4.98375
|
|
1 1 N 1S 0.00000 -0.01648 -0.02670 -0.03272 0.00000
|
|
2 2S 0.00000 -0.00864 -0.02465 -0.04035 0.00000
|
|
3 3S 0.00000 -0.30700 -0.59068 -0.68742 0.00000
|
|
4 4S 0.00000 1.97697 2.30398 2.20176 0.00000
|
|
5 5S 0.00000 0.67530 7.93286 9.25924 0.00000
|
|
6 6S 0.00000 6.37523 4.85146 5.12369 0.00000
|
|
7 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
8 7PY 0.03310 0.00000 0.00000 0.00000 -0.08642
|
|
9 7PZ 0.00000 -0.04598 0.00058 0.00221 0.00000
|
|
10 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
11 8PY 0.04406 0.00000 0.00000 0.00000 -1.19895
|
|
12 8PZ 0.00000 0.21721 0.94437 0.20244 0.00000
|
|
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
14 9PY 0.53199 0.00000 0.00000 0.00000 10.99901
|
|
15 9PZ 0.00000 -2.80265 -6.82824 -2.77750 0.00000
|
|
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
17 10PY -1.77486 0.00000 0.00000 0.00000 3.29539
|
|
18 10PZ 0.00000 -3.89473 -3.91015 -1.35644 0.00000
|
|
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
20 11PY -0.35272 0.00000 0.00000 0.00000 0.99438
|
|
21 11PZ 0.00000 -1.33755 -0.74232 -0.47692 0.00000
|
|
22 12D 0 0.00000 0.03250 0.02314 0.00764 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
24 12D-1 -0.01338 0.00000 0.00000 0.00000 0.02261
|
|
25 12D+2 0.02288 0.00000 0.00000 0.00000 0.04102
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 -0.22341 -0.25354 -0.14411 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
29 13D-1 0.19373 0.00000 0.00000 0.00000 -0.20698
|
|
30 13D+2 -0.22473 0.00000 0.00000 0.00000 -0.34629
|
|
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 2.81113 2.73788 -0.84280 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
34 14D-1 -1.53701 0.00000 0.00000 0.00000 -2.72726
|
|
35 14D+2 4.09138 0.00000 0.00000 0.00000 -1.03941
|
|
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 2.18493 0.58419 -1.50637 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
39 15D-1 0.87169 0.00000 0.00000 0.00000 -0.63578
|
|
40 15D+2 1.60668 0.00000 0.00000 0.00000 0.54776
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.03557 -0.02133 0.03113 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 -0.02317 0.00000 0.00000 0.00000 0.01547
|
|
45 16F+2 0.02724 0.00000 0.00000 0.00000 0.03540
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 -0.00001 -0.08293 0.01767 0.00000
|
|
49 17F 0 0.00000 -0.19072 0.31841 -0.10926 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.19460 0.00000 0.00000 0.00000 -0.24880
|
|
52 17F+2 -0.29213 0.00000 0.00000 0.00000 0.02315
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 -0.00723 0.39112 -0.43971 0.00000
|
|
56 18F 0 0.00000 -0.77548 0.61083 2.10904 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 -0.17540 0.00000 0.00000 0.00000 0.57957
|
|
59 18F+2 0.23981 0.00000 0.00000 0.00000 -0.15509
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 -0.09875 0.31971 1.98237 0.00000
|
|
63 19G 0 0.00000 -0.01110 0.00942 -0.02664 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00626 0.00000 0.00000 0.00000 0.02087
|
|
66 19G+2 0.01320 0.00000 0.00000 0.00000 0.02296
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 -0.00812 0.04954 0.00961 0.00000
|
|
70 19G+4 -0.02191 0.00000 0.00000 0.00000 0.03325
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 -0.29148 -0.66760 0.13021 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.01816 0.00000 0.00000 0.00000 -0.00729
|
|
75 20G+2 -0.47087 0.00000 0.00000 0.00000 -0.15882
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.22983 -0.14560 0.05966 0.00000
|
|
79 20G+4 0.49144 0.00000 0.00000 0.00000 0.10852
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.05570 0.04095 -0.03830 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 -0.04468 0.00000 0.00000 0.00000 -0.01089
|
|
84 21H+2 0.02666 0.00000 0.00000 0.00000 0.03609
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 -0.06510 -0.05894 -0.01223 0.00000
|
|
88 21H+4 -0.05361 0.00000 0.00000 0.00000 -0.00041
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 -0.10183 0.00000 0.00000 0.00000 -0.01456
|
|
92 2 H 1S 0.00794 -0.00252 -0.01969 -0.01305 -0.03925
|
|
93 2S -0.40151 0.12613 0.38903 0.49470 0.77673
|
|
94 3S 3.32778 0.44232 -2.26061 -2.74124 -7.45366
|
|
95 4S 1.01720 -3.12378 -2.75006 -2.91756 -3.37845
|
|
96 5S 0.00894 -0.02558 -0.00614 0.00375 -0.22582
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY -0.02664 -0.00701 0.01493 0.00664 0.06526
|
|
99 6PZ -0.01672 -0.00997 -0.01232 -0.02797 -0.00734
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.24430 0.03745 -0.23928 -0.14622 -0.73820
|
|
102 7PZ 0.01649 0.01411 0.03619 0.22734 0.14395
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY -1.03577 0.39994 2.05550 1.78572 5.71288
|
|
105 8PZ 1.36739 1.05790 0.85957 -0.58182 -2.01465
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.05055 1.67013 1.78890 1.37091 2.13724
|
|
108 9PZ 0.75409 0.83960 0.38882 -0.74091 -1.48442
|
|
109 10D 0 -0.05119 -0.09094 0.02976 -0.05736 -0.05952
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.01199 -0.01589 0.00564 -0.00421 -0.01589
|
|
112 10D+2 0.02061 0.04733 -0.05796 -0.00390 -0.06126
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.33530 0.58967 -0.15315 0.34500 0.44224
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 -0.19998 0.03924 -0.14321 0.02102 0.08251
|
|
117 11D+2 -0.14124 -0.31434 0.30563 0.07218 0.45931
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.76688 0.24880 1.66083 1.09947 0.11135
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 -0.83763 -0.96003 -0.53078 1.00470 2.19918
|
|
122 12D+2 0.30876 1.39384 1.26250 0.11202 2.08272
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 -0.04251 0.03432 0.00057 -0.06613 -0.00704
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.05023 0.00218 0.04994 0.04386 -0.05809
|
|
127 13F+2 -0.02337 -0.00030 -0.01658 0.00501 -0.01749
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 -0.01318 0.05757 0.01308 -0.04031 0.02749
|
|
131 14F 0 0.20678 -0.40336 -0.01441 0.85024 0.41143
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 -0.91775 -0.41669 -1.20059 -0.50574 0.39624
|
|
134 14F+2 -0.12756 -0.17043 -0.01762 0.20471 0.73433
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.01513 -0.77708 -0.46570 0.26280 -0.79365
|
|
138 15G 0 -0.02466 -0.01616 -0.03390 -0.00151 0.01316
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 -0.00568 0.00322 -0.02096 -0.02300 -0.01916
|
|
141 15G+2 -0.03031 -0.02630 -0.04534 0.00653 0.01520
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.01006 -0.00131 -0.00008 -0.01438 -0.03359
|
|
145 15G+4 -0.01537 -0.02989 -0.02356 -0.00129 -0.02006
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00397 -0.00252 -0.01969 -0.01305 0.01962
|
|
148 2S 0.20075 0.12613 0.38903 0.49470 -0.38837
|
|
149 3S -1.66389 0.44232 -2.26061 -2.74124 3.72683
|
|
150 4S -0.50860 -3.12378 -2.75006 -2.91756 1.68923
|
|
151 5S -0.00447 -0.02558 -0.00614 0.00375 0.11291
|
|
152 6PX 0.01237 -0.00607 0.01293 0.00575 -0.02117
|
|
153 6PY -0.00521 0.00350 -0.00746 -0.00332 0.02859
|
|
154 6PZ 0.00836 -0.00997 -0.01232 -0.02797 0.00367
|
|
155 7PX -0.05804 0.03244 -0.20723 -0.12663 0.29083
|
|
156 7PY 0.14376 -0.01873 0.11964 0.07311 -0.23447
|
|
157 7PZ -0.00825 0.01411 0.03619 0.22734 -0.07197
|
|
158 8PX -0.27096 0.34636 1.78012 1.54648 -2.90895
|
|
159 8PY -1.50507 -0.19997 -1.02775 -0.89286 0.67443
|
|
160 8PZ -0.68369 1.05790 0.85957 -0.58182 1.00733
|
|
161 9PX -0.27438 1.44638 1.54923 1.18724 -1.49157
|
|
162 9PY -0.42469 -0.83507 -0.89445 -0.68545 -0.44624
|
|
163 9PZ -0.37704 0.83960 0.38882 -0.74091 0.74221
|
|
164 10D 0 0.02559 -0.09094 0.02976 -0.05736 0.02976
|
|
165 10D+1 -0.02766 -0.01376 0.00489 -0.00365 -0.02154
|
|
166 10D-1 -0.03592 0.00795 -0.00282 0.00211 -0.05321
|
|
167 10D+2 -0.03127 -0.02366 0.02898 0.00195 -0.02274
|
|
168 10D-2 -0.02995 0.04099 -0.05020 -0.00338 0.02224
|
|
169 11D 0 -0.16765 0.58967 -0.15315 0.34500 -0.22112
|
|
170 11D+1 0.20167 0.03398 -0.12402 0.01820 0.14042
|
|
171 11D-1 0.14932 -0.01962 0.07160 -0.01051 0.32572
|
|
172 11D+2 0.29076 0.15717 -0.15282 -0.03609 0.13894
|
|
173 11D-2 0.24941 -0.27223 0.26469 0.06251 -0.18496
|
|
174 12D 0 -0.38344 0.24880 1.66083 1.09947 -0.05567
|
|
175 12D+1 -0.32527 -0.83141 -0.45967 0.87010 -1.22841
|
|
176 12D-1 -1.40102 0.48002 0.26539 -0.50235 0.07152
|
|
177 12D+2 0.92229 -0.69692 -0.63125 -0.05601 1.73941
|
|
178 12D-2 0.35422 1.20710 1.09336 0.09701 -0.19821
|
|
179 13F 0 0.02125 0.03432 0.00057 -0.06613 0.00352
|
|
180 13F+1 0.00013 0.00189 0.04325 0.03798 0.01436
|
|
181 13F-1 0.05045 -0.00109 -0.02497 -0.02193 -0.03322
|
|
182 13F+2 -0.03773 0.00015 0.00829 -0.00251 -0.00168
|
|
183 13F-2 -0.00829 -0.00026 -0.01436 0.00434 0.00913
|
|
184 13F+3 0.00032 0.00000 0.00000 0.00000 0.05220
|
|
185 13F-3 0.00659 0.05757 0.01308 -0.04031 -0.01374
|
|
186 14F 0 -0.10339 -0.40336 -0.01441 0.85024 -0.20571
|
|
187 14F+1 0.17779 -0.36087 -1.03974 -0.43799 -0.06610
|
|
188 14F-1 -0.60980 0.20835 0.60030 0.25287 0.28175
|
|
189 14F+2 0.78232 0.08522 0.00881 -0.10235 0.36682
|
|
190 14F-2 0.52532 -0.14760 -0.01526 0.17728 -0.21218
|
|
191 14F+3 -0.63197 0.00000 0.00000 0.00000 -0.80507
|
|
192 14F-3 -0.00756 -0.77708 -0.46570 0.26280 0.39682
|
|
193 15G 0 0.01233 -0.01616 -0.03390 -0.00151 -0.00658
|
|
194 15G+1 0.00917 0.00279 -0.01815 -0.01992 0.01216
|
|
195 15G-1 0.01020 -0.00161 0.01048 0.01150 0.00189
|
|
196 15G+2 0.00909 0.01315 0.02267 -0.00326 0.00977
|
|
197 15G-2 0.02275 -0.02277 -0.03927 0.00565 -0.00313
|
|
198 15G+3 -0.05511 0.00000 0.00000 0.00000 -0.02568
|
|
199 15G-3 -0.00503 -0.00131 -0.00008 -0.01438 0.01680
|
|
200 15G+4 0.02405 0.01495 0.01178 0.00064 0.01970
|
|
201 15G-4 -0.02276 0.02589 0.02040 0.00112 -0.02295
|
|
202 4 H 1S -0.00397 -0.00252 -0.01969 -0.01305 0.01962
|
|
203 2S 0.20075 0.12613 0.38903 0.49470 -0.38837
|
|
204 3S -1.66389 0.44232 -2.26061 -2.74124 3.72683
|
|
205 4S -0.50860 -3.12378 -2.75006 -2.91756 1.68923
|
|
206 5S -0.00447 -0.02558 -0.00614 0.00375 0.11291
|
|
207 6PX -0.01237 0.00607 -0.01293 -0.00575 0.02117
|
|
208 6PY -0.00521 0.00350 -0.00746 -0.00332 0.02859
|
|
209 6PZ 0.00836 -0.00997 -0.01232 -0.02797 0.00367
|
|
210 7PX 0.05804 -0.03244 0.20723 0.12663 -0.29083
|
|
211 7PY 0.14376 -0.01873 0.11964 0.07311 -0.23447
|
|
212 7PZ -0.00825 0.01411 0.03619 0.22734 -0.07197
|
|
213 8PX 0.27096 -0.34636 -1.78012 -1.54648 2.90895
|
|
214 8PY -1.50507 -0.19997 -1.02775 -0.89286 0.67443
|
|
215 8PZ -0.68369 1.05790 0.85957 -0.58182 1.00733
|
|
216 9PX 0.27438 -1.44638 -1.54923 -1.18724 1.49157
|
|
217 9PY -0.42469 -0.83507 -0.89445 -0.68545 -0.44624
|
|
218 9PZ -0.37704 0.83960 0.38882 -0.74091 0.74221
|
|
219 10D 0 0.02559 -0.09094 0.02976 -0.05736 0.02976
|
|
220 10D+1 0.02766 0.01376 -0.00489 0.00365 0.02154
|
|
221 10D-1 -0.03592 0.00795 -0.00282 0.00211 -0.05321
|
|
222 10D+2 -0.03127 -0.02366 0.02898 0.00195 -0.02274
|
|
223 10D-2 0.02995 -0.04099 0.05020 0.00338 -0.02224
|
|
224 11D 0 -0.16765 0.58967 -0.15315 0.34500 -0.22112
|
|
225 11D+1 -0.20167 -0.03398 0.12402 -0.01820 -0.14042
|
|
226 11D-1 0.14932 -0.01962 0.07160 -0.01051 0.32572
|
|
227 11D+2 0.29076 0.15717 -0.15282 -0.03609 0.13894
|
|
228 11D-2 -0.24941 0.27223 -0.26469 -0.06251 0.18496
|
|
229 12D 0 -0.38344 0.24880 1.66083 1.09947 -0.05567
|
|
230 12D+1 0.32527 0.83141 0.45967 -0.87010 1.22841
|
|
231 12D-1 -1.40102 0.48002 0.26539 -0.50235 0.07152
|
|
232 12D+2 0.92229 -0.69692 -0.63125 -0.05601 1.73941
|
|
233 12D-2 -0.35422 -1.20710 -1.09336 -0.09701 0.19821
|
|
234 13F 0 0.02125 0.03432 0.00057 -0.06613 0.00352
|
|
235 13F+1 -0.00013 -0.00189 -0.04325 -0.03798 -0.01436
|
|
236 13F-1 0.05045 -0.00109 -0.02497 -0.02193 -0.03322
|
|
237 13F+2 -0.03773 0.00015 0.00829 -0.00251 -0.00168
|
|
238 13F-2 0.00829 0.00026 0.01436 -0.00434 -0.00913
|
|
239 13F+3 -0.00032 0.00000 0.00000 0.00000 -0.05220
|
|
240 13F-3 0.00659 0.05757 0.01308 -0.04031 -0.01374
|
|
241 14F 0 -0.10339 -0.40336 -0.01441 0.85024 -0.20571
|
|
242 14F+1 -0.17779 0.36087 1.03974 0.43799 0.06610
|
|
243 14F-1 -0.60980 0.20835 0.60030 0.25287 0.28175
|
|
244 14F+2 0.78232 0.08522 0.00881 -0.10235 0.36682
|
|
245 14F-2 -0.52532 0.14760 0.01526 -0.17728 0.21218
|
|
246 14F+3 0.63197 0.00000 0.00000 0.00000 0.80507
|
|
247 14F-3 -0.00756 -0.77708 -0.46570 0.26280 0.39682
|
|
248 15G 0 0.01233 -0.01616 -0.03390 -0.00151 -0.00658
|
|
249 15G+1 -0.00917 -0.00279 0.01815 0.01992 -0.01216
|
|
250 15G-1 0.01020 -0.00161 0.01048 0.01150 0.00189
|
|
251 15G+2 0.00909 0.01315 0.02267 -0.00326 0.00977
|
|
252 15G-2 -0.02275 0.02277 0.03927 -0.00565 0.00313
|
|
253 15G+3 0.05511 0.00000 0.00000 0.00000 0.02568
|
|
254 15G-3 -0.00503 -0.00131 -0.00008 -0.01438 0.01680
|
|
255 15G+4 0.02405 0.01495 0.01178 0.00064 0.01970
|
|
256 15G-4 0.02276 -0.02589 -0.02040 -0.00112 0.02295
|
|
96 97 98 99 100
|
|
(E)--V (A2)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 4.98375 4.99356 5.05134 5.05134 5.17672
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
7 7PX -0.08642 0.00000 -0.00830 0.00000 -0.02223
|
|
8 7PY 0.00000 0.00000 0.00000 -0.00830 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX -1.19895 0.00000 -0.24303 0.00000 -0.22008
|
|
11 8PY 0.00000 0.00000 0.00000 -0.24303 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX 10.99901 0.00000 2.06642 0.00000 1.90095
|
|
14 9PY 0.00000 0.00000 0.00000 2.06642 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX 3.29539 0.00000 -0.55371 0.00000 -1.44008
|
|
17 10PY 0.00000 0.00000 0.00000 -0.55371 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX 0.99438 0.00000 0.12761 0.00000 -0.08076
|
|
20 11PY 0.00000 0.00000 0.00000 0.12761 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.02261 0.00000 -0.00293 0.00000 0.00205
|
|
24 12D-1 0.00000 0.00000 0.00000 -0.00293 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.01646 0.00000
|
|
26 12D-2 0.04102 0.00000 0.01646 0.00000 0.02086
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 -0.20698 0.00000 0.03658 0.00000 0.07426
|
|
29 13D-1 0.00000 0.00000 0.00000 0.03658 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 -0.17055 0.00000
|
|
31 13D-2 -0.34629 0.00000 -0.17055 0.00000 -0.25663
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 -2.72726 0.00000 -0.64720 0.00000 -0.73950
|
|
34 14D-1 0.00000 0.00000 0.00000 -0.64720 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 1.19292 0.00000
|
|
36 14D-2 -1.03941 0.00000 1.19292 0.00000 1.72967
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 -0.63578 0.00000 -0.04547 0.00000 0.90916
|
|
39 15D-1 0.00000 0.00000 0.00000 -0.04547 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.60407 0.00000
|
|
41 15D-2 0.54776 0.00000 0.60407 0.00000 -0.55755
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.01547 0.00000 0.00630 0.00000 -0.03862
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00630 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.03304 0.00000
|
|
46 16F-2 0.03540 0.00000 0.03304 0.00000 0.03217
|
|
47 16F+3 0.00000 0.06658 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 -0.24880 0.00000 -0.03600 0.00000 0.29145
|
|
51 17F-1 0.00000 0.00000 0.00000 -0.03600 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 -0.19168 0.00000
|
|
53 17F-2 0.02315 0.00000 -0.19168 0.00000 -0.12806
|
|
54 17F+3 0.00000 -0.70080 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.57957 0.00000 -0.26653 0.00000 -0.19882
|
|
58 18F-1 0.00000 0.00000 0.00000 -0.26653 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.24218 0.00000
|
|
60 18F-2 -0.15509 0.00000 -0.24218 0.00000 -0.51137
|
|
61 18F+3 0.00000 0.46302 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.02087 0.00000 -0.02958 0.00000 0.04587
|
|
65 19G-1 0.00000 0.00000 0.00000 -0.02958 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 -0.03400 0.00000
|
|
67 19G-2 0.02296 0.00000 -0.03400 0.00000 -0.05050
|
|
68 19G+3 0.00000 0.03451 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.04566 0.00000
|
|
71 19G-4 -0.03325 0.00000 -0.04566 0.00000 -0.00974
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 -0.00729 0.00000 0.37836 0.00000 -0.46471
|
|
74 20G-1 0.00000 0.00000 0.00000 0.37836 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.37262 0.00000
|
|
76 20G-2 -0.15882 0.00000 0.37262 0.00000 0.38461
|
|
77 20G+3 0.00000 -0.17248 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 -0.32216 0.00000
|
|
80 20G-4 -0.10852 0.00000 0.32216 0.00000 -0.06959
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 -0.01089 0.00000 -0.01322 0.00000 0.02164
|
|
83 21H-1 0.00000 0.00000 0.00000 -0.01322 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 -0.02686 0.00000
|
|
85 21H-2 0.03609 0.00000 -0.02686 0.00000 0.02829
|
|
86 21H+3 0.00000 0.03096 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00808 0.00000
|
|
89 21H-4 0.00041 0.00000 -0.00808 0.00000 0.00803
|
|
90 21H+5 0.01456 0.00000 0.03464 0.00000 0.01709
|
|
91 21H-5 0.00000 0.00000 0.00000 -0.03464 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 -0.00895 0.00000
|
|
93 2S 0.00000 0.00000 0.00000 0.02101 0.00000
|
|
94 3S 0.00000 0.00000 0.00000 0.21033 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.20817 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 -0.07558 0.00000
|
|
97 6PX 0.01637 -0.01832 0.01293 0.00000 0.03747
|
|
98 6PY 0.00000 0.00000 0.00000 0.01274 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 -0.00450 0.00000
|
|
100 7PX -0.06655 0.12433 -0.04403 0.00000 -0.20760
|
|
101 7PY 0.00000 0.00000 0.00000 -0.11911 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.04955 0.00000
|
|
103 8PX -1.00506 -0.20851 -0.53511 0.00000 -0.34060
|
|
104 8PY 0.00000 0.00000 0.00000 0.26453 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 -0.30648 0.00000
|
|
106 9PX -1.30740 -0.65258 -0.38361 0.00000 -0.12460
|
|
107 9PY 0.00000 0.00000 0.00000 -0.02523 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 -0.07003 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.10322 0.00000
|
|
110 10D+1 -0.06565 -0.10548 0.06076 0.00000 0.11826
|
|
111 10D-1 0.00000 0.00000 0.00000 0.04704 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 -0.08897 0.00000
|
|
113 10D-2 -0.00990 0.04971 0.00628 0.00000 0.03354
|
|
114 11D 0 0.00000 0.00000 0.00000 -0.69205 0.00000
|
|
115 11D+1 0.40679 0.68018 -0.35306 0.00000 -0.75382
|
|
116 11D-1 0.00000 0.00000 0.00000 -0.29277 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.48231 0.00000
|
|
118 11D-2 0.03216 -0.43234 -0.06631 0.00000 -0.17124
|
|
119 12D 0 0.00000 0.00000 0.00000 0.86445 0.00000
|
|
120 12D+1 -0.63770 -0.68700 0.02877 0.00000 0.18902
|
|
121 12D-1 0.00000 0.00000 0.00000 0.73284 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 -0.44315 0.00000
|
|
123 12D-2 1.62498 1.01914 0.80981 0.00000 1.06335
|
|
124 13F 0 0.00000 0.00000 0.00000 -0.04123 0.00000
|
|
125 13F+1 -0.02493 -0.01756 0.01199 0.00000 -0.00801
|
|
126 13F-1 0.00000 0.00000 0.00000 0.03121 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 -0.01083 0.00000
|
|
128 13F-2 0.00359 -0.04417 -0.01219 0.00000 -0.02686
|
|
129 13F+3 -0.06027 -0.02193 -0.04215 0.00000 -0.03133
|
|
130 13F-3 0.00000 0.00000 0.00000 -0.02610 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.58832 0.00000
|
|
132 14F+1 0.24359 0.13456 0.02635 0.00000 0.20370
|
|
133 14F-1 0.00000 0.00000 0.00000 -0.31490 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.21328 0.00000
|
|
135 14F-2 0.24432 0.55284 0.11766 0.00000 0.35097
|
|
136 14F+3 0.92961 0.30891 0.69586 0.00000 0.71280
|
|
137 14F-3 0.00000 0.00000 0.00000 0.45069 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00788 0.00000
|
|
139 15G+1 0.00891 0.00057 0.00945 0.00000 0.00464
|
|
140 15G-1 0.00000 0.00000 0.00000 -0.03107 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 -0.00190 0.00000
|
|
142 15G-2 0.00796 0.01173 -0.02166 0.00000 -0.00817
|
|
143 15G+3 0.02966 0.02758 0.01021 0.00000 0.00570
|
|
144 15G-3 0.00000 0.00000 0.00000 -0.00114 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.02278 0.00000
|
|
146 15G-4 -0.03295 -0.02458 -0.02072 0.00000 -0.03739
|
|
147 3 H 1S -0.03399 0.00000 -0.00775 0.00448 -0.02275
|
|
148 2S 0.67267 0.00000 0.01820 -0.01051 0.30653
|
|
149 3S -6.45506 0.00000 0.18215 -0.10516 0.32752
|
|
150 4S -2.92583 0.00000 0.18028 -0.10409 0.79869
|
|
151 5S -0.19557 0.00000 -0.06545 0.03779 -0.06016
|
|
152 6PX 0.05304 0.00916 0.01279 0.00008 0.02347
|
|
153 6PY -0.02117 0.01587 0.00008 0.01288 0.00808
|
|
154 6PZ -0.00636 0.00000 -0.00390 0.00225 -0.02025
|
|
155 7PX -0.57029 -0.06216 -0.10034 0.03251 -0.20928
|
|
156 7PY 0.29083 -0.10767 0.03251 -0.06280 0.00097
|
|
157 7PZ 0.12466 0.00000 0.04291 -0.02477 0.15316
|
|
158 8PX 4.03340 0.10426 0.06462 -0.34625 -0.00016
|
|
159 8PY -2.90895 0.18058 -0.34625 -0.33520 -0.19655
|
|
160 8PZ -1.74474 0.00000 -0.26542 0.15324 -0.28900
|
|
161 9PX 1.27608 0.32629 -0.11483 -0.15518 -0.27633
|
|
162 9PY -1.49157 0.56515 -0.15518 -0.29402 0.08760
|
|
163 9PZ -1.28554 0.00000 -0.06065 0.03502 -0.06151
|
|
164 10D 0 -0.05155 0.00000 0.08939 -0.05161 -0.04377
|
|
165 10D+1 -0.02833 0.05274 0.05047 0.00594 -0.00998
|
|
166 10D-1 -0.02154 0.09135 0.00594 0.05733 0.07404
|
|
167 10D+2 0.02224 -0.04305 0.04124 -0.01754 -0.00570
|
|
168 10D-2 -0.04842 -0.02485 -0.06516 0.04124 0.04341
|
|
169 11D 0 0.38299 0.00000 -0.59933 0.34602 0.20523
|
|
170 11D+1 0.16358 -0.34009 -0.30784 -0.02610 -0.00452
|
|
171 11D-1 0.14042 -0.58905 -0.02610 -0.33798 -0.43261
|
|
172 11D+2 -0.18496 0.37442 -0.23756 0.07084 0.12703
|
|
173 11D-2 0.35252 0.21617 0.34516 -0.23756 -0.39126
|
|
174 12D 0 0.09643 0.00000 0.74864 -0.43223 -0.21267
|
|
175 12D+1 1.48996 0.34350 0.55682 -0.30487 -0.14592
|
|
176 12D-1 -1.22841 0.59496 -0.30487 0.20479 0.19338
|
|
177 12D+2 -0.19821 -0.88261 0.54255 0.49657 0.07633
|
|
178 12D-2 1.96829 -0.50957 -0.12991 0.54255 0.93115
|
|
179 13F 0 -0.00610 0.00000 -0.03570 0.02061 0.00943
|
|
180 13F+1 -0.04980 0.00878 0.02641 -0.00832 0.01254
|
|
181 13F-1 0.01436 0.01521 -0.00832 0.01680 -0.01187
|
|
182 13F+2 0.00913 0.03825 -0.00059 -0.01185 -0.02051
|
|
183 13F-2 -0.01222 0.02209 -0.01117 -0.00059 0.00866
|
|
184 13F+3 0.03014 -0.02193 0.02108 0.03651 0.01567
|
|
185 13F-3 0.02380 0.00000 -0.02260 0.01305 0.04608
|
|
186 14F 0 0.35631 0.00000 0.50950 -0.29416 -0.18189
|
|
187 14F+1 0.35808 -0.06728 -0.22959 0.14776 -0.11917
|
|
188 14F-1 -0.06610 -0.11653 0.14776 -0.05896 0.18641
|
|
189 14F+2 -0.21218 -0.47878 -0.04140 0.14156 0.25183
|
|
190 14F-2 0.61183 -0.27642 0.18937 -0.04140 -0.08520
|
|
191 14F+3 -0.46481 0.30891 -0.34793 -0.60263 -0.35640
|
|
192 14F-3 -0.68732 0.00000 0.39031 -0.22535 -0.50484
|
|
193 15G 0 0.01140 0.00000 0.00682 -0.00394 -0.00948
|
|
194 15G+1 -0.01214 -0.00028 -0.02094 0.01754 0.00577
|
|
195 15G-1 0.01216 -0.00049 0.01754 -0.00068 -0.00065
|
|
196 15G+2 -0.00313 -0.01015 -0.00856 -0.01672 -0.00004
|
|
197 15G-2 0.01339 -0.00586 -0.00684 -0.00856 -0.00810
|
|
198 15G+3 -0.01483 0.02758 -0.00510 -0.00884 -0.00285
|
|
199 15G-3 -0.02909 0.00000 -0.00099 0.00057 -0.00117
|
|
200 15G+4 0.02295 -0.02129 -0.00089 0.02124 0.02478
|
|
201 15G-4 0.00680 0.01229 -0.02227 0.00089 0.00553
|
|
202 4 H 1S 0.03399 0.00000 0.00775 0.00448 0.02275
|
|
203 2S -0.67267 0.00000 -0.01820 -0.01051 -0.30653
|
|
204 3S 6.45506 0.00000 -0.18215 -0.10516 -0.32752
|
|
205 4S 2.92583 0.00000 -0.18028 -0.10409 -0.79869
|
|
206 5S 0.19557 0.00000 0.06545 0.03779 0.06016
|
|
207 6PX 0.05304 0.00916 0.01279 -0.00008 0.02347
|
|
208 6PY 0.02117 -0.01587 -0.00008 0.01288 -0.00808
|
|
209 6PZ 0.00636 0.00000 0.00390 0.00225 0.02025
|
|
210 7PX -0.57029 -0.06216 -0.10034 -0.03251 -0.20928
|
|
211 7PY -0.29083 0.10767 -0.03251 -0.06280 -0.00097
|
|
212 7PZ -0.12466 0.00000 -0.04291 -0.02477 -0.15316
|
|
213 8PX 4.03340 0.10426 0.06462 0.34625 -0.00016
|
|
214 8PY 2.90895 -0.18058 0.34625 -0.33520 0.19655
|
|
215 8PZ 1.74474 0.00000 0.26542 0.15324 0.28900
|
|
216 9PX 1.27608 0.32629 -0.11483 0.15518 -0.27633
|
|
217 9PY 1.49157 -0.56515 0.15518 -0.29402 -0.08760
|
|
218 9PZ 1.28554 0.00000 0.06065 0.03502 0.06151
|
|
219 10D 0 0.05155 0.00000 -0.08939 -0.05161 0.04377
|
|
220 10D+1 -0.02833 0.05274 0.05047 -0.00594 -0.00998
|
|
221 10D-1 0.02154 -0.09135 -0.00594 0.05733 -0.07404
|
|
222 10D+2 -0.02224 0.04305 -0.04124 -0.01754 0.00570
|
|
223 10D-2 -0.04842 -0.02485 -0.06516 -0.04124 0.04341
|
|
224 11D 0 -0.38299 0.00000 0.59933 0.34602 -0.20523
|
|
225 11D+1 0.16358 -0.34009 -0.30784 0.02610 -0.00452
|
|
226 11D-1 -0.14042 0.58905 0.02610 -0.33798 0.43261
|
|
227 11D+2 0.18496 -0.37442 0.23756 0.07084 -0.12703
|
|
228 11D-2 0.35252 0.21617 0.34516 0.23756 -0.39126
|
|
229 12D 0 -0.09643 0.00000 -0.74864 -0.43223 0.21267
|
|
230 12D+1 1.48996 0.34350 0.55682 0.30487 -0.14592
|
|
231 12D-1 1.22841 -0.59496 0.30487 0.20479 -0.19338
|
|
232 12D+2 0.19821 0.88261 -0.54255 0.49657 -0.07633
|
|
233 12D-2 1.96829 -0.50957 -0.12991 -0.54255 0.93115
|
|
234 13F 0 0.00610 0.00000 0.03570 0.02061 -0.00943
|
|
235 13F+1 -0.04980 0.00878 0.02641 0.00832 0.01254
|
|
236 13F-1 -0.01436 -0.01521 0.00832 0.01680 0.01187
|
|
237 13F+2 -0.00913 -0.03825 0.00059 -0.01185 0.02051
|
|
238 13F-2 -0.01222 0.02209 -0.01117 0.00059 0.00866
|
|
239 13F+3 0.03014 -0.02193 0.02108 -0.03651 0.01567
|
|
240 13F-3 -0.02380 0.00000 0.02260 0.01305 -0.04608
|
|
241 14F 0 -0.35631 0.00000 -0.50950 -0.29416 0.18189
|
|
242 14F+1 0.35808 -0.06728 -0.22959 -0.14776 -0.11917
|
|
243 14F-1 0.06610 0.11653 -0.14776 -0.05896 -0.18641
|
|
244 14F+2 0.21218 0.47878 0.04140 0.14156 -0.25183
|
|
245 14F-2 0.61183 -0.27642 0.18937 0.04140 -0.08520
|
|
246 14F+3 -0.46481 0.30891 -0.34793 0.60263 -0.35640
|
|
247 14F-3 0.68732 0.00000 -0.39031 -0.22535 0.50484
|
|
248 15G 0 -0.01140 0.00000 -0.00682 -0.00394 0.00948
|
|
249 15G+1 -0.01214 -0.00028 -0.02094 -0.01754 0.00577
|
|
250 15G-1 -0.01216 0.00049 -0.01754 -0.00068 0.00065
|
|
251 15G+2 0.00313 0.01015 0.00856 -0.01672 0.00004
|
|
252 15G-2 0.01339 -0.00586 -0.00684 0.00856 -0.00810
|
|
253 15G+3 -0.01483 0.02758 -0.00510 0.00884 -0.00285
|
|
254 15G-3 0.02909 0.00000 0.00099 0.00057 0.00117
|
|
255 15G+4 -0.02295 0.02129 0.00089 0.02124 -0.02478
|
|
256 15G-4 0.00680 0.01229 -0.02227 -0.00089 0.00553
|
|
101 102 103 104 105
|
|
(E)--V (A2)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 5.17672 5.24800 5.27143 5.27143 5.30127
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.03815
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 0.03632
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 1.03686
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 -9.04499
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 17.81218
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 6.01263
|
|
7 7PX 0.00000 0.00000 -0.05116 0.00000 0.00000
|
|
8 7PY -0.02223 0.00000 0.00000 -0.05116 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.04980
|
|
10 8PX 0.00000 0.00000 -0.50258 0.00000 0.00000
|
|
11 8PY -0.22008 0.00000 0.00000 -0.50258 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 1.46185
|
|
13 9PX 0.00000 0.00000 -2.66902 0.00000 0.00000
|
|
14 9PY 1.90095 0.00000 0.00000 -2.66902 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 -3.14726
|
|
16 10PX 0.00000 0.00000 6.87022 0.00000 0.00000
|
|
17 10PY -1.44008 0.00000 0.00000 6.87022 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 -5.34063
|
|
19 11PX 0.00000 0.00000 0.33891 0.00000 0.00000
|
|
20 11PY -0.08076 0.00000 0.00000 0.33891 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.54334
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.03225
|
|
23 12D+1 0.00000 0.00000 -0.02405 0.00000 0.00000
|
|
24 12D-1 0.00205 0.00000 0.00000 -0.02405 0.00000
|
|
25 12D+2 0.02086 0.00000 0.00000 -0.02821 0.00000
|
|
26 12D-2 0.00000 0.00000 -0.02821 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.11191
|
|
28 13D+1 0.00000 0.00000 0.04242 0.00000 0.00000
|
|
29 13D-1 0.07426 0.00000 0.00000 0.04242 0.00000
|
|
30 13D+2 -0.25663 0.00000 0.00000 0.14257 0.00000
|
|
31 13D-2 0.00000 0.00000 0.14257 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 -1.36507
|
|
33 14D+1 0.00000 0.00000 0.95664 0.00000 0.00000
|
|
34 14D-1 -0.73950 0.00000 0.00000 0.95664 0.00000
|
|
35 14D+2 1.72967 0.00000 0.00000 -0.16246 0.00000
|
|
36 14D-2 0.00000 0.00000 -0.16246 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 -0.87990
|
|
38 15D+1 0.00000 0.00000 -2.05000 0.00000 0.00000
|
|
39 15D-1 0.90916 0.00000 0.00000 -2.05000 0.00000
|
|
40 15D+2 -0.55755 0.00000 0.00000 -1.86669 0.00000
|
|
41 15D-2 0.00000 0.00000 -1.86669 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 -0.00604
|
|
43 16F+1 0.00000 0.00000 0.03713 0.00000 0.00000
|
|
44 16F-1 -0.03862 0.00000 0.00000 0.03713 0.00000
|
|
45 16F+2 0.03217 0.00000 0.00000 0.01672 0.00000
|
|
46 16F-2 0.00000 0.00000 0.01672 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00278 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.02767
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 -0.14838
|
|
50 17F+1 0.00000 0.00000 -0.36779 0.00000 0.00000
|
|
51 17F-1 0.29145 0.00000 0.00000 -0.36779 0.00000
|
|
52 17F+2 -0.12806 0.00000 0.00000 -0.38367 0.00000
|
|
53 17F-2 0.00000 0.00000 -0.38367 0.00000 0.00000
|
|
54 17F+3 0.00000 -0.19011 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.14994
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 1.30473
|
|
57 18F+1 0.00000 0.00000 0.01825 0.00000 0.00000
|
|
58 18F-1 -0.19882 0.00000 0.00000 0.01825 0.00000
|
|
59 18F+2 -0.51137 0.00000 0.00000 0.46879 0.00000
|
|
60 18F-2 0.00000 0.00000 0.46879 0.00000 0.00000
|
|
61 18F+3 0.00000 -0.30648 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 -1.97984
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 -0.03921
|
|
64 19G+1 0.00000 0.00000 0.00175 0.00000 0.00000
|
|
65 19G-1 0.04587 0.00000 0.00000 0.00175 0.00000
|
|
66 19G+2 -0.05050 0.00000 0.00000 0.01049 0.00000
|
|
67 19G-2 0.00000 0.00000 0.01049 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00592 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 -0.03455
|
|
70 19G+4 0.00974 0.00000 0.00000 0.01304 0.00000
|
|
71 19G-4 0.00000 0.00000 -0.01304 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.40559
|
|
73 20G+1 0.00000 0.00000 -0.06046 0.00000 0.00000
|
|
74 20G-1 -0.46471 0.00000 0.00000 -0.06046 0.00000
|
|
75 20G+2 0.38461 0.00000 0.00000 0.01870 0.00000
|
|
76 20G-2 0.00000 0.00000 0.01870 0.00000 0.00000
|
|
77 20G+3 0.00000 -0.05456 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.51739
|
|
79 20G+4 0.06959 0.00000 0.00000 -0.27095 0.00000
|
|
80 20G-4 0.00000 0.00000 0.27095 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 -0.05572
|
|
82 21H+1 0.00000 0.00000 -0.02160 0.00000 0.00000
|
|
83 21H-1 0.02164 0.00000 0.00000 -0.02160 0.00000
|
|
84 21H+2 0.02829 0.00000 0.00000 -0.00376 0.00000
|
|
85 21H-2 0.00000 0.00000 -0.00376 0.00000 0.00000
|
|
86 21H+3 0.00000 0.02822 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.03449
|
|
88 21H+4 -0.00803 0.00000 0.00000 0.05281 0.00000
|
|
89 21H-4 0.00000 0.00000 -0.05281 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 -0.01173 0.00000 0.00000
|
|
91 21H-5 -0.01709 0.00000 0.00000 0.01173 0.00000
|
|
92 2 H 1S -0.02626 0.00000 0.00000 0.02138 0.01567
|
|
93 2S 0.35395 0.00000 0.00000 0.06101 -0.43059
|
|
94 3S 0.37818 0.00000 0.00000 -2.51771 -5.94512
|
|
95 4S 0.92224 0.00000 0.00000 -1.11804 -1.90967
|
|
96 5S -0.06947 0.00000 0.00000 0.26889 -0.14254
|
|
97 6PX 0.00000 -0.03884 -0.02580 0.00000 0.00000
|
|
98 6PY 0.01881 0.00000 0.00000 -0.01075 -0.04379
|
|
99 6PZ -0.02338 0.00000 0.00000 -0.04703 -0.00200
|
|
100 7PX 0.00000 0.25043 0.14036 0.00000 0.00000
|
|
101 7PY -0.20984 0.00000 0.00000 0.11242 0.38816
|
|
102 7PZ 0.17686 0.00000 0.00000 0.32502 0.00366
|
|
103 8PX 0.00000 -0.49215 -0.04787 0.00000 0.00000
|
|
104 8PY 0.11332 0.00000 0.00000 -1.13130 1.62934
|
|
105 8PZ -0.33371 0.00000 0.00000 -0.13290 -0.99461
|
|
106 9PX 0.00000 -0.85433 -0.72889 0.00000 0.00000
|
|
107 9PY -0.32690 0.00000 0.00000 -0.92971 0.81444
|
|
108 9PZ -0.07103 0.00000 0.00000 -0.57035 0.21952
|
|
109 10D 0 -0.05054 0.00000 0.00000 -0.07875 0.02962
|
|
110 10D+1 0.00000 0.09119 0.01403 0.00000 0.00000
|
|
111 10D-1 -0.05273 0.00000 0.00000 0.07794 -0.03626
|
|
112 10D+2 0.04670 0.00000 0.00000 0.01413 0.03534
|
|
113 10D-2 0.00000 0.11943 0.08489 0.00000 0.00000
|
|
114 11D 0 0.23698 0.00000 0.00000 0.60016 -0.17126
|
|
115 11D+1 0.00000 -0.55534 -0.05994 0.00000 0.00000
|
|
116 11D-1 0.24525 0.00000 0.00000 -0.60275 0.49131
|
|
117 11D+2 -0.46461 0.00000 0.00000 -0.06387 -0.01973
|
|
118 11D-2 0.00000 -0.89001 -0.70578 0.00000 0.00000
|
|
119 12D 0 -0.24557 0.00000 0.00000 -1.43073 0.14171
|
|
120 12D+1 0.00000 0.26351 0.25547 0.00000 0.00000
|
|
121 12D-1 -0.25756 0.00000 0.00000 -0.04881 -0.66323
|
|
122 12D+2 0.88708 0.00000 0.00000 -1.65746 -0.12262
|
|
123 12D-2 0.00000 1.27614 0.65742 0.00000 0.00000
|
|
124 13F 0 0.01089 0.00000 0.00000 0.01667 0.01592
|
|
125 13F+1 0.00000 -0.00185 0.00609 0.00000 0.00000
|
|
126 13F-1 0.01939 0.00000 0.00000 -0.01966 0.01073
|
|
127 13F+2 0.02050 0.00000 0.00000 0.03184 0.05936
|
|
128 13F-2 0.00000 0.00796 0.00140 0.00000 0.00000
|
|
129 13F+3 0.00000 -0.01107 -0.00697 0.00000 0.00000
|
|
130 13F-3 0.05321 0.00000 0.00000 -0.05753 -0.02774
|
|
131 14F 0 -0.21003 0.00000 0.00000 -0.25492 -0.20179
|
|
132 14F+1 0.00000 -0.00821 -0.08235 0.00000 0.00000
|
|
133 14F-1 -0.22679 0.00000 0.00000 0.41247 0.01274
|
|
134 14F+2 -0.23060 0.00000 0.00000 -0.47948 -0.54450
|
|
135 14F-2 0.00000 -0.03659 -0.14209 0.00000 0.00000
|
|
136 14F+3 0.00000 0.08478 -0.11792 0.00000 0.00000
|
|
137 14F-3 -0.58294 0.00000 0.00000 0.90454 0.30675
|
|
138 15G 0 -0.01095 0.00000 0.00000 0.02134 -0.00318
|
|
139 15G+1 0.00000 0.00204 -0.00354 0.00000 0.00000
|
|
140 15G-1 0.00614 0.00000 0.00000 0.01317 0.01211
|
|
141 15G+2 -0.00807 0.00000 0.00000 0.02412 -0.00490
|
|
142 15G-2 0.00000 -0.00130 -0.00687 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00800 -0.00025 0.00000 0.00000
|
|
144 15G-3 -0.00135 0.00000 0.00000 0.01640 0.01435
|
|
145 15G+4 -0.01983 0.00000 0.00000 0.02199 0.00855
|
|
146 15G-4 0.00000 -0.01014 0.00135 0.00000 0.00000
|
|
147 3 H 1S 0.01313 0.00000 0.01851 -0.01069 0.01567
|
|
148 2S -0.17698 0.00000 0.05283 -0.03050 -0.43059
|
|
149 3S -0.18909 0.00000 -2.18040 1.25886 -5.94512
|
|
150 4S -0.46112 0.00000 -0.96825 0.55902 -1.90967
|
|
151 5S 0.03473 0.00000 0.23286 -0.13444 -0.14254
|
|
152 6PX 0.00808 0.01942 -0.01451 -0.00652 -0.03792
|
|
153 6PY 0.03280 0.03364 -0.00652 -0.02204 0.02189
|
|
154 6PZ 0.01169 0.00000 -0.04073 0.02351 -0.00200
|
|
155 7PX 0.00097 -0.12521 0.11940 0.01210 0.33615
|
|
156 7PY -0.20816 -0.21688 0.01210 0.13337 -0.19408
|
|
157 7PZ -0.08843 0.00000 0.28147 -0.16251 0.00366
|
|
158 8PX -0.19655 0.24607 -0.86044 0.46914 1.41105
|
|
159 8PY -0.22712 0.42621 0.46914 -0.31872 -0.81467
|
|
160 8PZ 0.16685 0.00000 -0.11510 0.06645 -0.99461
|
|
161 9PX 0.08760 0.42717 -0.87950 0.08696 0.70533
|
|
162 9PY -0.17518 0.73987 0.08696 -0.77909 -0.40722
|
|
163 9PZ 0.03551 0.00000 -0.49394 0.28518 0.21952
|
|
164 10D 0 0.02527 0.00000 -0.06820 0.03938 0.02962
|
|
165 10D+1 0.07404 -0.04559 0.06196 -0.02767 -0.03140
|
|
166 10D-1 0.07551 -0.07897 -0.02767 0.03001 0.01813
|
|
167 10D+2 0.03683 -0.10343 0.03064 0.06720 -0.01767
|
|
168 10D-2 -0.00570 -0.05971 0.03182 0.03064 0.03060
|
|
169 11D 0 -0.11849 0.00000 0.51976 -0.30008 -0.17126
|
|
170 11D+1 -0.43261 0.27767 -0.46704 0.23504 0.42549
|
|
171 11D-1 -0.50405 0.48094 0.23504 -0.19564 -0.24565
|
|
172 11D+2 -0.24458 0.77077 -0.27796 -0.54530 0.00986
|
|
173 11D-2 0.12703 0.44501 -0.22435 -0.27796 -0.01708
|
|
174 12D 0 0.12279 0.00000 -1.23905 0.71537 0.14171
|
|
175 12D+1 0.19338 -0.13176 0.02726 0.13176 -0.57437
|
|
176 12D-1 0.07737 -0.22821 0.13176 0.17940 0.33161
|
|
177 12D+2 1.01928 -1.10517 1.00237 0.07870 0.06131
|
|
178 12D-2 0.07633 -0.63807 -1.07874 1.00237 -0.10619
|
|
179 13F 0 -0.00545 0.00000 0.01444 -0.00834 0.01592
|
|
180 13F+1 -0.01187 0.00093 -0.01322 0.01115 0.00929
|
|
181 13F-1 -0.00116 0.00161 0.01115 -0.00035 -0.00536
|
|
182 13F+2 -0.01502 -0.00690 -0.01318 0.00901 -0.02968
|
|
183 13F-2 -0.02051 -0.00398 0.02423 -0.01318 0.05140
|
|
184 13F+3 0.02713 -0.01107 0.00349 0.00604 0.00000
|
|
185 13F-3 -0.02660 0.00000 -0.04982 0.02877 -0.02774
|
|
186 14F 0 0.10502 0.00000 -0.22076 0.12746 -0.20179
|
|
187 14F+1 0.18641 0.00411 0.28877 -0.21426 0.01103
|
|
188 14F-1 0.09608 0.00711 -0.21426 0.04136 -0.00637
|
|
189 14F+2 0.20558 0.03168 0.14610 -0.22643 0.27225
|
|
190 14F-2 0.25183 0.01829 -0.39513 0.14610 -0.47155
|
|
191 14F+3 -0.61730 0.08478 0.05896 0.10212 0.00000
|
|
192 14F-3 0.29147 0.00000 0.78336 -0.45227 0.30675
|
|
193 15G 0 0.00548 0.00000 0.01848 -0.01067 -0.00318
|
|
194 15G+1 -0.00065 -0.00102 0.00899 -0.00724 0.01049
|
|
195 15G-1 0.00502 -0.00177 -0.00724 0.00063 -0.00606
|
|
196 15G+2 -0.00814 0.00113 -0.01342 0.00088 0.00245
|
|
197 15G-2 -0.00004 0.00065 0.01638 -0.01342 -0.00425
|
|
198 15G+3 -0.00494 0.00800 0.00013 0.00022 0.00000
|
|
199 15G-3 0.00068 0.00000 0.01420 -0.00820 0.01435
|
|
200 15G+4 0.02308 -0.00878 -0.01010 0.00449 -0.00428
|
|
201 15G-4 -0.02478 0.00507 -0.01615 0.01010 -0.00741
|
|
202 4 H 1S 0.01313 0.00000 -0.01851 -0.01069 0.01567
|
|
203 2S -0.17698 0.00000 -0.05283 -0.03050 -0.43059
|
|
204 3S -0.18909 0.00000 2.18040 1.25886 -5.94512
|
|
205 4S -0.46112 0.00000 0.96825 0.55902 -1.90967
|
|
206 5S 0.03473 0.00000 -0.23286 -0.13444 -0.14254
|
|
207 6PX -0.00808 0.01942 -0.01451 0.00652 0.03792
|
|
208 6PY 0.03280 -0.03364 0.00652 -0.02204 0.02189
|
|
209 6PZ 0.01169 0.00000 0.04073 0.02351 -0.00200
|
|
210 7PX -0.00097 -0.12521 0.11940 -0.01210 -0.33615
|
|
211 7PY -0.20816 0.21688 -0.01210 0.13337 -0.19408
|
|
212 7PZ -0.08843 0.00000 -0.28147 -0.16251 0.00366
|
|
213 8PX 0.19655 0.24607 -0.86044 -0.46914 -1.41105
|
|
214 8PY -0.22712 -0.42621 -0.46914 -0.31872 -0.81467
|
|
215 8PZ 0.16685 0.00000 0.11510 0.06645 -0.99461
|
|
216 9PX -0.08760 0.42717 -0.87950 -0.08696 -0.70533
|
|
217 9PY -0.17518 -0.73987 -0.08696 -0.77909 -0.40722
|
|
218 9PZ 0.03551 0.00000 0.49394 0.28518 0.21952
|
|
219 10D 0 0.02527 0.00000 0.06820 0.03938 0.02962
|
|
220 10D+1 -0.07404 -0.04559 0.06196 0.02767 0.03140
|
|
221 10D-1 0.07551 0.07897 0.02767 0.03001 0.01813
|
|
222 10D+2 0.03683 0.10343 -0.03064 0.06720 -0.01767
|
|
223 10D-2 0.00570 -0.05971 0.03182 -0.03064 -0.03060
|
|
224 11D 0 -0.11849 0.00000 -0.51976 -0.30008 -0.17126
|
|
225 11D+1 0.43261 0.27767 -0.46704 -0.23504 -0.42549
|
|
226 11D-1 -0.50405 -0.48094 -0.23504 -0.19564 -0.24565
|
|
227 11D+2 -0.24458 -0.77077 0.27796 -0.54530 0.00986
|
|
228 11D-2 -0.12703 0.44501 -0.22435 0.27796 0.01708
|
|
229 12D 0 0.12279 0.00000 1.23905 0.71537 0.14171
|
|
230 12D+1 -0.19338 -0.13176 0.02726 -0.13176 0.57437
|
|
231 12D-1 0.07737 0.22821 -0.13176 0.17940 0.33161
|
|
232 12D+2 1.01928 1.10517 -1.00237 0.07870 0.06131
|
|
233 12D-2 -0.07633 -0.63807 -1.07874 -1.00237 0.10619
|
|
234 13F 0 -0.00545 0.00000 -0.01444 -0.00834 0.01592
|
|
235 13F+1 0.01187 0.00093 -0.01322 -0.01115 -0.00929
|
|
236 13F-1 -0.00116 -0.00161 -0.01115 -0.00035 -0.00536
|
|
237 13F+2 -0.01502 0.00690 0.01318 0.00901 -0.02968
|
|
238 13F-2 0.02051 -0.00398 0.02423 0.01318 -0.05140
|
|
239 13F+3 -0.02713 -0.01107 0.00349 -0.00604 0.00000
|
|
240 13F-3 -0.02660 0.00000 0.04982 0.02877 -0.02774
|
|
241 14F 0 0.10502 0.00000 0.22076 0.12746 -0.20179
|
|
242 14F+1 -0.18641 0.00411 0.28877 0.21426 -0.01103
|
|
243 14F-1 0.09608 -0.00711 0.21426 0.04136 -0.00637
|
|
244 14F+2 0.20558 -0.03168 -0.14610 -0.22643 0.27225
|
|
245 14F-2 -0.25183 0.01829 -0.39513 -0.14610 0.47155
|
|
246 14F+3 0.61730 0.08478 0.05896 -0.10212 0.00000
|
|
247 14F-3 0.29147 0.00000 -0.78336 -0.45227 0.30675
|
|
248 15G 0 0.00548 0.00000 -0.01848 -0.01067 -0.00318
|
|
249 15G+1 0.00065 -0.00102 0.00899 0.00724 -0.01049
|
|
250 15G-1 0.00502 0.00177 0.00724 0.00063 -0.00606
|
|
251 15G+2 -0.00814 -0.00113 0.01342 0.00088 0.00245
|
|
252 15G-2 0.00004 0.00065 0.01638 0.01342 0.00425
|
|
253 15G+3 0.00494 0.00800 0.00013 -0.00022 0.00000
|
|
254 15G-3 0.00068 0.00000 -0.01420 -0.00820 0.01435
|
|
255 15G+4 0.02308 0.00878 0.01010 0.00449 -0.00428
|
|
256 15G-4 0.02478 0.00507 -0.01615 -0.01010 0.00741
|
|
106 107 108 109 110
|
|
(E)--V (E)--V (A2)--V (A1)--V (E)--V
|
|
Eigenvalues -- 5.47865 5.47865 5.51966 5.58451 5.80710
|
|
1 1 N 1S 0.00000 0.00000 0.00000 -0.01887 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 0.03593 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 -0.19154 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 0.21306 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 8.39472 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 3.16700 0.00000
|
|
7 7PX 0.00000 -0.05293 0.00000 0.00000 0.00000
|
|
8 7PY -0.05293 0.00000 0.00000 0.00000 0.03263
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00229 0.00000
|
|
10 8PX 0.00000 -1.08692 0.00000 0.00000 0.00000
|
|
11 8PY -1.08692 0.00000 0.00000 0.00000 -0.99899
|
|
12 8PZ 0.00000 0.00000 0.00000 -0.47358 0.00000
|
|
13 9PX 0.00000 1.36695 0.00000 0.00000 0.00000
|
|
14 9PY 1.36695 0.00000 0.00000 0.00000 6.68078
|
|
15 9PZ 0.00000 0.00000 0.00000 0.69188 0.00000
|
|
16 10PX 0.00000 0.92534 0.00000 0.00000 0.00000
|
|
17 10PY 0.92534 0.00000 0.00000 0.00000 10.90539
|
|
18 10PZ 0.00000 0.00000 0.00000 1.42329 0.00000
|
|
19 11PX 0.00000 0.02094 0.00000 0.00000 0.00000
|
|
20 11PY 0.02094 0.00000 0.00000 0.00000 0.33926
|
|
21 11PZ 0.00000 0.00000 0.00000 -0.41707 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.02524 0.00000
|
|
23 12D+1 0.00000 0.00574 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00574 0.00000 0.00000 0.00000 0.00218
|
|
25 12D+2 -0.01921 0.00000 0.00000 0.00000 -0.00639
|
|
26 12D-2 0.00000 -0.01921 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 -0.14475 0.00000
|
|
28 13D+1 0.00000 -0.02076 0.00000 0.00000 0.00000
|
|
29 13D-1 -0.02076 0.00000 0.00000 0.00000 0.18050
|
|
30 13D+2 -0.01521 0.00000 0.00000 0.00000 0.12103
|
|
31 13D-2 0.00000 -0.01521 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 -1.42247 0.00000
|
|
33 14D+1 0.00000 -0.37809 0.00000 0.00000 0.00000
|
|
34 14D-1 -0.37809 0.00000 0.00000 0.00000 -2.37446
|
|
35 14D+2 0.51864 0.00000 0.00000 0.00000 -1.57750
|
|
36 14D-2 0.00000 0.51864 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 -1.24296 0.00000
|
|
38 15D+1 0.00000 -0.01548 0.00000 0.00000 0.00000
|
|
39 15D-1 -0.01548 0.00000 0.00000 0.00000 -2.27795
|
|
40 15D+2 0.25409 0.00000 0.00000 0.00000 -1.65205
|
|
41 15D-2 0.00000 0.25409 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 -0.03873 0.00000
|
|
43 16F+1 0.00000 -0.08054 0.00000 0.00000 0.00000
|
|
44 16F-1 -0.08054 0.00000 0.00000 0.00000 -0.00680
|
|
45 16F+2 0.01612 0.00000 0.00000 0.00000 0.04223
|
|
46 16F-2 0.00000 0.01612 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 -0.01214 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.04413 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.55430 0.00000
|
|
50 17F+1 0.00000 0.73521 0.00000 0.00000 0.00000
|
|
51 17F-1 0.73521 0.00000 0.00000 0.00000 0.12012
|
|
52 17F+2 -0.21705 0.00000 0.00000 0.00000 -0.26818
|
|
53 17F-2 0.00000 -0.21705 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 -0.03534 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 -0.55805 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 -1.60148 0.00000
|
|
57 18F+1 0.00000 -1.07551 0.00000 0.00000 0.00000
|
|
58 18F-1 -1.07551 0.00000 0.00000 0.00000 -1.32816
|
|
59 18F+2 0.52829 0.00000 0.00000 0.00000 0.39674
|
|
60 18F-2 0.00000 0.52829 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 3.73213 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 -0.78825 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 -0.07487 0.00000
|
|
64 19G+1 0.00000 -0.00617 0.00000 0.00000 0.00000
|
|
65 19G-1 -0.00617 0.00000 0.00000 0.00000 -0.03813
|
|
66 19G+2 0.02988 0.00000 0.00000 0.00000 -0.04627
|
|
67 19G-2 0.00000 0.02988 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00367 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.06276 0.00000
|
|
70 19G+4 0.00844 0.00000 0.00000 0.00000 -0.06142
|
|
71 19G-4 0.00000 -0.00844 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 1.11816 0.00000
|
|
73 20G+1 0.00000 0.07207 0.00000 0.00000 0.00000
|
|
74 20G-1 0.07207 0.00000 0.00000 0.00000 0.80970
|
|
75 20G+2 -0.43042 0.00000 0.00000 0.00000 0.59297
|
|
76 20G-2 0.00000 -0.43042 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 -0.13362 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 -0.61971 0.00000
|
|
79 20G+4 0.02751 0.00000 0.00000 0.00000 1.37210
|
|
80 20G-4 0.00000 -0.02751 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 -0.02119 0.00000
|
|
82 21H+1 0.00000 0.00951 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00951 0.00000 0.00000 0.00000 -0.00538
|
|
84 21H+2 0.00019 0.00000 0.00000 0.00000 -0.03327
|
|
85 21H-2 0.00000 0.00019 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 -0.07005 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.12053 0.00000
|
|
88 21H+4 0.00035 0.00000 0.00000 0.00000 -0.11947
|
|
89 21H-4 0.00000 -0.00035 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00957 0.00000 0.00000 0.00000
|
|
91 21H-5 -0.00957 0.00000 0.00000 0.00000 0.01151
|
|
92 2 H 1S 0.01210 0.00000 0.00000 -0.02045 0.06118
|
|
93 2S -0.11339 0.00000 0.00000 0.78875 -0.57819
|
|
94 3S -0.54852 0.00000 0.00000 -2.01754 -9.31718
|
|
95 4S -0.82775 0.00000 0.00000 -2.28761 -4.01294
|
|
96 5S 0.09250 0.00000 0.00000 0.05787 0.35002
|
|
97 6PX 0.00000 -0.02022 0.04405 0.00000 0.00000
|
|
98 6PY 0.02099 0.00000 0.00000 0.00468 -0.04305
|
|
99 6PZ 0.02908 0.00000 0.00000 -0.08010 0.02502
|
|
100 7PX 0.00000 0.17581 -0.37569 0.00000 0.00000
|
|
101 7PY -0.14753 0.00000 0.00000 -0.16603 0.33683
|
|
102 7PZ -0.26187 0.00000 0.00000 0.75501 -0.11380
|
|
103 8PX 0.00000 -0.37663 2.09222 0.00000 0.00000
|
|
104 8PY 0.26635 0.00000 0.00000 0.70304 3.05966
|
|
105 8PZ 0.14286 0.00000 0.00000 -2.49057 -2.79917
|
|
106 9PX 0.00000 -0.15619 -0.21613 0.00000 0.00000
|
|
107 9PY 0.49123 0.00000 0.00000 0.96696 1.38233
|
|
108 9PZ 0.35003 0.00000 0.00000 -0.92331 -1.20113
|
|
109 10D 0 0.07512 0.00000 0.00000 0.02811 0.00136
|
|
110 10D+1 0.00000 -0.02621 -0.01196 0.00000 0.00000
|
|
111 10D-1 -0.03505 0.00000 0.00000 -0.03093 -0.03355
|
|
112 10D+2 0.03959 0.00000 0.00000 -0.03155 -0.02770
|
|
113 10D-2 0.00000 0.01274 0.06200 0.00000 0.00000
|
|
114 11D 0 -0.47196 0.00000 0.00000 -0.32956 0.05375
|
|
115 11D+1 0.00000 0.17780 0.09798 0.00000 0.00000
|
|
116 11D-1 0.25396 0.00000 0.00000 0.28602 0.85430
|
|
117 11D+2 -0.22342 0.00000 0.00000 0.08671 0.66913
|
|
118 11D-2 0.00000 -0.09692 -0.47555 0.00000 0.00000
|
|
119 12D 0 0.73142 0.00000 0.00000 -0.59090 -0.41737
|
|
120 12D+1 0.00000 -0.97702 1.28447 0.00000 0.00000
|
|
121 12D-1 -0.84910 0.00000 0.00000 0.84723 0.80802
|
|
122 12D+2 0.00407 0.00000 0.00000 0.34706 0.17561
|
|
123 12D-2 0.00000 0.15086 0.33069 0.00000 0.00000
|
|
124 13F 0 0.03928 0.00000 0.00000 0.03005 0.01940
|
|
125 13F+1 0.00000 0.00463 -0.06822 0.00000 0.00000
|
|
126 13F-1 -0.00797 0.00000 0.00000 0.03488 0.03391
|
|
127 13F+2 0.04029 0.00000 0.00000 0.05439 0.03002
|
|
128 13F-2 0.00000 -0.03339 0.05655 0.00000 0.00000
|
|
129 13F+3 0.00000 0.01617 -0.06744 0.00000 0.00000
|
|
130 13F-3 -0.04210 0.00000 0.00000 0.01851 0.02318
|
|
131 14F 0 -0.41296 0.00000 0.00000 -0.13105 0.16880
|
|
132 14F+1 0.00000 -0.14268 0.75055 0.00000 0.00000
|
|
133 14F-1 -0.27975 0.00000 0.00000 0.37621 0.09295
|
|
134 14F+2 -0.60184 0.00000 0.00000 -0.05671 0.32566
|
|
135 14F-2 0.00000 0.61654 -0.76585 0.00000 0.00000
|
|
136 14F+3 0.00000 -0.04187 0.52942 0.00000 0.00000
|
|
137 14F-3 0.33330 0.00000 0.00000 -0.13771 -0.53012
|
|
138 15G 0 -0.01831 0.00000 0.00000 0.02596 0.00785
|
|
139 15G+1 0.00000 0.00423 0.00186 0.00000 0.00000
|
|
140 15G-1 -0.00818 0.00000 0.00000 0.00382 0.00092
|
|
141 15G+2 -0.02445 0.00000 0.00000 0.02827 0.01492
|
|
142 15G-2 0.00000 0.01257 -0.00992 0.00000 0.00000
|
|
143 15G+3 0.00000 0.02307 0.00067 0.00000 0.00000
|
|
144 15G-3 0.01721 0.00000 0.00000 -0.01403 -0.02045
|
|
145 15G+4 -0.01022 0.00000 0.00000 0.00431 -0.00284
|
|
146 15G-4 0.00000 -0.00583 -0.00698 0.00000 0.00000
|
|
147 3 H 1S -0.00605 0.01048 0.00000 -0.02045 -0.03059
|
|
148 2S 0.05669 -0.09820 0.00000 0.78875 0.28910
|
|
149 3S 0.27426 -0.47504 0.00000 -2.01754 4.65859
|
|
150 4S 0.41388 -0.71685 0.00000 -2.28761 2.00647
|
|
151 5S -0.04625 0.08011 0.00000 0.05787 -0.17501
|
|
152 6PX -0.01785 0.01069 -0.02202 0.00405 -0.01513
|
|
153 6PY -0.00992 -0.01785 -0.03815 -0.00234 -0.06925
|
|
154 6PZ -0.01454 0.02518 0.00000 -0.08010 -0.01251
|
|
155 7PX 0.14001 -0.06670 0.18784 -0.14379 0.17572
|
|
156 7PY 0.09497 0.14001 0.32535 0.08302 0.64119
|
|
157 7PZ 0.13093 -0.22679 0.00000 0.75501 0.05690
|
|
158 8PX -0.27842 0.10561 -1.04611 0.60885 -2.36191
|
|
159 8PY -0.21588 -0.27842 -1.81192 -0.35152 -1.03129
|
|
160 8PZ -0.07143 0.12372 0.00000 -2.49057 1.39958
|
|
161 9PX -0.28034 0.32937 0.10806 0.83742 -1.03529
|
|
162 9PY 0.00566 -0.28034 0.18717 -0.48348 -0.41085
|
|
163 9PZ -0.17501 0.30313 0.00000 -0.92331 0.60057
|
|
164 10D 0 -0.03756 0.06506 0.00000 0.02811 -0.00068
|
|
165 10D+1 0.00383 -0.03284 0.00598 -0.02678 0.02199
|
|
166 10D-1 -0.02842 0.00383 0.01036 0.01546 0.00453
|
|
167 10D+2 0.01945 -0.01163 -0.05370 0.01578 0.00899
|
|
168 10D-2 -0.01163 0.03287 -0.03100 -0.02732 0.02118
|
|
169 11D 0 0.23598 -0.40873 0.00000 -0.32956 -0.02688
|
|
170 11D+1 -0.03298 0.23492 -0.04899 0.24770 -0.46456
|
|
171 11D-1 0.19684 -0.03298 -0.08485 -0.14301 0.04965
|
|
172 11D+2 -0.12855 0.05477 0.41184 -0.04335 0.20842
|
|
173 11D-2 0.05477 -0.19179 0.23777 0.07509 -0.26599
|
|
174 12D 0 -0.36571 0.63343 0.00000 -0.59090 0.20869
|
|
175 12D+1 -0.05539 -0.88108 -0.64223 0.73372 -0.53925
|
|
176 12D-1 -0.94504 -0.05539 -1.11238 -0.42362 -0.12598
|
|
177 12D+2 0.11416 0.06356 -0.28638 -0.17353 1.21387
|
|
178 12D-2 0.06356 0.04076 -0.16534 0.30056 0.59944
|
|
179 13F 0 -0.01964 0.03402 0.00000 0.03005 -0.00970
|
|
180 13F+1 0.00546 -0.00482 0.03411 0.03020 -0.01730
|
|
181 13F-1 0.00148 0.00546 0.05908 -0.01744 0.00395
|
|
182 13F+2 -0.01497 -0.03191 -0.04898 -0.02720 0.04321
|
|
183 13F-2 -0.03191 0.02187 -0.02828 0.04710 0.00762
|
|
184 13F+3 -0.01401 -0.00809 -0.06744 0.00000 -0.04086
|
|
185 13F-3 0.02105 -0.03646 0.00000 0.01851 -0.01159
|
|
186 14F 0 0.20648 -0.35763 0.00000 -0.13105 -0.08440
|
|
187 14F+1 0.05935 -0.24548 -0.37527 0.32580 0.02287
|
|
188 14F-1 -0.17695 0.05935 -0.64999 -0.18810 0.13257
|
|
189 14F+2 0.31195 0.52757 0.66325 0.02836 0.20763
|
|
190 14F-2 0.52757 -0.29724 0.38293 -0.04912 -0.06815
|
|
191 14F+3 0.03626 0.02094 0.52942 0.00000 -0.40684
|
|
192 14F-3 -0.16665 0.28865 0.00000 -0.13771 0.26506
|
|
193 15G 0 0.00915 -0.01585 0.00000 0.02596 -0.00393
|
|
194 15G+1 0.00538 -0.00508 -0.00093 0.00331 0.00557
|
|
195 15G-1 0.00113 0.00538 -0.00161 -0.00191 0.01057
|
|
196 15G+2 0.00331 0.01603 0.00859 -0.01413 0.00675
|
|
197 15G-2 0.01603 -0.01519 0.00496 0.02448 -0.00472
|
|
198 15G+3 -0.01998 -0.01154 0.00067 0.00000 -0.02673
|
|
199 15G-3 -0.00860 0.01490 0.00000 -0.01403 0.01022
|
|
200 15G+4 0.00182 0.00695 -0.00605 -0.00215 0.03385
|
|
201 15G-4 -0.00695 0.00621 0.00349 -0.00373 -0.02118
|
|
202 4 H 1S -0.00605 -0.01048 0.00000 -0.02045 -0.03059
|
|
203 2S 0.05669 0.09820 0.00000 0.78875 0.28910
|
|
204 3S 0.27426 0.47504 0.00000 -2.01754 4.65859
|
|
205 4S 0.41388 0.71685 0.00000 -2.28761 2.00647
|
|
206 5S -0.04625 -0.08011 0.00000 0.05787 -0.17501
|
|
207 6PX 0.01785 0.01069 -0.02202 -0.00405 0.01513
|
|
208 6PY -0.00992 0.01785 0.03815 -0.00234 -0.06925
|
|
209 6PZ -0.01454 -0.02518 0.00000 -0.08010 -0.01251
|
|
210 7PX -0.14001 -0.06670 0.18784 0.14379 -0.17572
|
|
211 7PY 0.09497 -0.14001 -0.32535 0.08302 0.64119
|
|
212 7PZ 0.13093 0.22679 0.00000 0.75501 0.05690
|
|
213 8PX 0.27842 0.10561 -1.04611 -0.60885 2.36191
|
|
214 8PY -0.21588 0.27842 1.81192 -0.35152 -1.03129
|
|
215 8PZ -0.07143 -0.12372 0.00000 -2.49057 1.39958
|
|
216 9PX 0.28034 0.32937 0.10806 -0.83742 1.03529
|
|
217 9PY 0.00566 0.28034 -0.18717 -0.48348 -0.41085
|
|
218 9PZ -0.17501 -0.30313 0.00000 -0.92331 0.60057
|
|
219 10D 0 -0.03756 -0.06506 0.00000 0.02811 -0.00068
|
|
220 10D+1 -0.00383 -0.03284 0.00598 0.02678 -0.02199
|
|
221 10D-1 -0.02842 -0.00383 -0.01036 0.01546 0.00453
|
|
222 10D+2 0.01945 0.01163 0.05370 0.01578 0.00899
|
|
223 10D-2 0.01163 0.03287 -0.03100 0.02732 -0.02118
|
|
224 11D 0 0.23598 0.40873 0.00000 -0.32956 -0.02688
|
|
225 11D+1 0.03298 0.23492 -0.04899 -0.24770 0.46456
|
|
226 11D-1 0.19684 0.03298 0.08485 -0.14301 0.04965
|
|
227 11D+2 -0.12855 -0.05477 -0.41184 -0.04335 0.20842
|
|
228 11D-2 -0.05477 -0.19179 0.23777 -0.07509 0.26599
|
|
229 12D 0 -0.36571 -0.63343 0.00000 -0.59090 0.20869
|
|
230 12D+1 0.05539 -0.88108 -0.64223 -0.73372 0.53925
|
|
231 12D-1 -0.94504 0.05539 1.11238 -0.42362 -0.12598
|
|
232 12D+2 0.11416 -0.06356 0.28638 -0.17353 1.21387
|
|
233 12D-2 -0.06356 0.04076 -0.16534 -0.30056 -0.59944
|
|
234 13F 0 -0.01964 -0.03402 0.00000 0.03005 -0.00970
|
|
235 13F+1 -0.00546 -0.00482 0.03411 -0.03020 0.01730
|
|
236 13F-1 0.00148 -0.00546 -0.05908 -0.01744 0.00395
|
|
237 13F+2 -0.01497 0.03191 0.04898 -0.02720 0.04321
|
|
238 13F-2 0.03191 0.02187 -0.02828 -0.04710 -0.00762
|
|
239 13F+3 0.01401 -0.00809 -0.06744 0.00000 0.04086
|
|
240 13F-3 0.02105 0.03646 0.00000 0.01851 -0.01159
|
|
241 14F 0 0.20648 0.35763 0.00000 -0.13105 -0.08440
|
|
242 14F+1 -0.05935 -0.24548 -0.37527 -0.32580 -0.02287
|
|
243 14F-1 -0.17695 -0.05935 0.64999 -0.18810 0.13257
|
|
244 14F+2 0.31195 -0.52757 -0.66325 0.02836 0.20763
|
|
245 14F-2 -0.52757 -0.29724 0.38293 0.04912 0.06815
|
|
246 14F+3 -0.03626 0.02094 0.52942 0.00000 0.40684
|
|
247 14F-3 -0.16665 -0.28865 0.00000 -0.13771 0.26506
|
|
248 15G 0 0.00915 0.01585 0.00000 0.02596 -0.00393
|
|
249 15G+1 -0.00538 -0.00508 -0.00093 -0.00331 -0.00557
|
|
250 15G-1 0.00113 -0.00538 0.00161 -0.00191 0.01057
|
|
251 15G+2 0.00331 -0.01603 -0.00859 -0.01413 0.00675
|
|
252 15G-2 -0.01603 -0.01519 0.00496 -0.02448 0.00472
|
|
253 15G+3 0.01998 -0.01154 0.00067 0.00000 0.02673
|
|
254 15G-3 -0.00860 -0.01490 0.00000 -0.01403 0.01022
|
|
255 15G+4 0.00182 -0.00695 0.00605 -0.00215 0.03385
|
|
256 15G-4 0.00695 0.00621 0.00349 0.00373 0.02118
|
|
111 112 113 114 115
|
|
(E)--V (A1)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 5.80710 5.92118 5.98603 5.98603 6.14591
|
|
1 1 N 1S 0.00000 0.00102 0.00000 0.00000 -0.01479
|
|
2 2S 0.00000 -0.08095 0.00000 0.00000 0.05803
|
|
3 3S 0.00000 -0.34800 0.00000 0.00000 0.22286
|
|
4 4S 0.00000 -4.59399 0.00000 0.00000 -3.29424
|
|
5 5S 0.00000 36.07747 0.00000 0.00000 9.47183
|
|
6 6S 0.00000 13.49678 0.00000 0.00000 -0.62486
|
|
7 7PX 0.03263 0.00000 -0.11688 0.00000 0.00000
|
|
8 7PY 0.00000 0.00000 0.00000 -0.11688 0.00000
|
|
9 7PZ 0.00000 0.13325 0.00000 0.00000 0.02644
|
|
10 8PX -0.99899 0.00000 -0.95273 0.00000 0.00000
|
|
11 8PY 0.00000 0.00000 0.00000 -0.95273 0.00000
|
|
12 8PZ 0.00000 1.45623 0.00000 0.00000 0.82522
|
|
13 9PX 6.68078 0.00000 5.04230 0.00000 0.00000
|
|
14 9PY 0.00000 0.00000 0.00000 5.04230 0.00000
|
|
15 9PZ 0.00000 -7.08297 0.00000 0.00000 -2.30383
|
|
16 10PX 10.90539 0.00000 -1.63783 0.00000 0.00000
|
|
17 10PY 0.00000 0.00000 0.00000 -1.63783 0.00000
|
|
18 10PZ 0.00000 -10.29158 0.00000 0.00000 -0.72220
|
|
19 11PX 0.33926 0.00000 -0.86191 0.00000 0.00000
|
|
20 11PY 0.00000 0.00000 0.00000 -0.86191 0.00000
|
|
21 11PZ 0.00000 -1.19664 0.00000 0.00000 0.42281
|
|
22 12D 0 0.00000 0.02801 0.00000 0.00000 -0.00198
|
|
23 12D+1 0.00218 0.00000 0.02829 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.02829 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.03747 0.00000
|
|
26 12D-2 -0.00639 0.00000 0.03747 0.00000 0.00000
|
|
27 13D 0 0.00000 -0.31374 0.00000 0.00000 0.14122
|
|
28 13D+1 0.18050 0.00000 -0.18104 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 -0.18104 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 -0.23667 0.00000
|
|
31 13D-2 0.12103 0.00000 -0.23667 0.00000 0.00000
|
|
32 14D 0 0.00000 -0.91466 0.00000 0.00000 -0.50945
|
|
33 14D+1 -2.37446 0.00000 0.57047 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.57047 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.19521 0.00000
|
|
36 14D-2 -1.57750 0.00000 0.19521 0.00000 0.00000
|
|
37 15D 0 0.00000 0.12252 0.00000 0.00000 -1.05171
|
|
38 15D+1 -2.27795 0.00000 2.26006 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 2.26006 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 2.20637 0.00000
|
|
41 15D-2 -1.65205 0.00000 2.20637 0.00000 0.00000
|
|
42 16F 0 0.00000 -0.03959 0.00000 0.00000 0.06353
|
|
43 16F+1 -0.00680 0.00000 0.06031 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.06031 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 -0.02434 0.00000
|
|
46 16F-2 0.04223 0.00000 -0.02434 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.04715 0.00000 0.00000 0.09376
|
|
49 17F 0 0.00000 0.68489 0.00000 0.00000 -0.62896
|
|
50 17F+1 0.12012 0.00000 -0.42802 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 -0.42802 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.59048 0.00000
|
|
53 17F-2 -0.26818 0.00000 0.59048 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 -0.91918 0.00000 0.00000 -0.87214
|
|
56 18F 0 0.00000 0.94601 0.00000 0.00000 0.97337
|
|
57 18F+1 -1.32816 0.00000 -1.42401 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 -1.42401 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 -2.52661 0.00000
|
|
60 18F-2 0.39674 0.00000 -2.52661 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 -0.17877 0.00000 0.00000 0.28369
|
|
63 19G 0 0.00000 0.02845 0.00000 0.00000 0.04662
|
|
64 19G+1 -0.03813 0.00000 0.02294 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.02294 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 -0.04694 0.00000
|
|
67 19G-2 -0.04627 0.00000 -0.04694 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.07026 0.00000 0.00000 0.08543
|
|
70 19G+4 0.00000 0.00000 0.00000 -0.03680 0.00000
|
|
71 19G-4 0.06142 0.00000 0.03680 0.00000 0.00000
|
|
72 20G 0 0.00000 -0.58607 0.00000 0.00000 -0.50098
|
|
73 20G+1 0.80970 0.00000 -0.02941 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 -0.02941 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.78318 0.00000
|
|
76 20G-2 0.59297 0.00000 0.78318 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 -0.07649 0.00000 0.00000 -0.52479
|
|
79 20G+4 0.00000 0.00000 0.00000 0.82464 0.00000
|
|
80 20G-4 -1.37210 0.00000 -0.82464 0.00000 0.00000
|
|
81 21H 0 0.00000 0.03840 0.00000 0.00000 -0.00210
|
|
82 21H+1 -0.00538 0.00000 0.06995 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.06995 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00668 0.00000
|
|
85 21H-2 -0.03327 0.00000 0.00668 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 -0.02565 0.00000 0.00000 -0.04159
|
|
88 21H+4 0.00000 0.00000 0.00000 -0.03992 0.00000
|
|
89 21H-4 0.11947 0.00000 0.03992 0.00000 0.00000
|
|
90 21H+5 -0.01151 0.00000 0.04523 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 -0.04523 0.00000
|
|
92 2 H 1S 0.00000 -0.00902 0.00000 0.00938 -0.02923
|
|
93 2S 0.00000 1.14731 0.00000 0.47065 0.59148
|
|
94 3S 0.00000 -10.72518 0.00000 1.01167 -4.00616
|
|
95 4S 0.00000 -7.33647 0.00000 -0.36161 0.62255
|
|
96 5S 0.00000 0.03119 0.00000 0.47831 -0.06925
|
|
97 6PX -0.07799 0.00000 -0.03681 0.00000 0.00000
|
|
98 6PY 0.00000 0.08748 0.00000 0.05819 -0.03348
|
|
99 6PZ 0.00000 0.00259 0.00000 -0.08840 -0.01298
|
|
100 7PX 0.74264 0.00000 0.35703 0.00000 0.00000
|
|
101 7PY 0.00000 -0.97113 0.00000 -0.52808 0.18837
|
|
102 7PZ 0.00000 0.06436 0.00000 0.85179 0.14679
|
|
103 8PX -2.39493 0.00000 -2.11932 0.00000 0.00000
|
|
104 8PY 0.00000 6.20051 0.00000 0.88870 1.54075
|
|
105 8PZ 0.00000 -1.23767 0.00000 -3.42322 -0.51512
|
|
106 9PX -1.00858 0.00000 0.18563 0.00000 0.00000
|
|
107 9PY 0.00000 3.64736 0.00000 0.70361 -0.17698
|
|
108 9PZ 0.00000 -0.64903 0.00000 -0.48454 -0.40259
|
|
109 10D 0 0.00000 -0.04470 0.00000 0.06898 -0.02045
|
|
110 10D+1 0.01723 0.00000 -0.00474 0.00000 0.00000
|
|
111 10D-1 0.00000 -0.02765 0.00000 -0.02093 0.02613
|
|
112 10D+2 0.00000 -0.00663 0.00000 0.02006 -0.07515
|
|
113 10D-2 0.02122 0.00000 -0.09808 0.00000 0.00000
|
|
114 11D 0 0.00000 0.38853 0.00000 -0.63120 0.23092
|
|
115 11D+1 -0.21856 0.00000 -0.00705 0.00000 0.00000
|
|
116 11D-1 0.00000 0.30649 0.00000 0.36185 -0.17138
|
|
117 11D+2 0.00000 0.20263 0.00000 -0.16419 0.63503
|
|
118 11D-2 0.05485 0.00000 0.89752 0.00000 0.00000
|
|
119 12D 0 0.00000 0.75663 0.00000 -0.05738 -0.06286
|
|
120 12D+1 -0.43732 0.00000 -0.52865 0.00000 0.00000
|
|
121 12D-1 0.00000 0.45805 0.00000 1.50977 0.29263
|
|
122 12D+2 0.00000 1.49304 0.00000 0.46873 -0.56240
|
|
123 12D-2 1.55995 0.00000 0.04812 0.00000 0.00000
|
|
124 13F 0 0.00000 0.03397 0.00000 0.03109 0.04892
|
|
125 13F+1 -0.00604 0.00000 0.02210 0.00000 0.00000
|
|
126 13F-1 0.00000 -0.04211 0.00000 0.05295 -0.02067
|
|
127 13F+2 0.00000 0.04124 0.00000 0.04682 0.02624
|
|
128 13F-2 0.04761 0.00000 0.01310 0.00000 0.00000
|
|
129 13F+3 0.04718 0.00000 0.05970 0.00000 0.00000
|
|
130 13F-3 0.00000 -0.06755 0.00000 -0.03177 -0.01920
|
|
131 14F 0 0.00000 0.01443 0.00000 -0.02928 -0.25854
|
|
132 14F+1 0.14577 0.00000 -0.09147 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00008 0.00000 0.21528 0.13235
|
|
134 14F+2 0.00000 -0.06308 0.00000 0.28478 -0.12586
|
|
135 14F-2 0.16829 0.00000 0.17548 0.00000 0.00000
|
|
136 14F+3 0.46978 0.00000 -0.07157 0.00000 0.00000
|
|
137 14F-3 0.00000 0.02580 0.00000 0.11996 0.17696
|
|
138 15G 0 0.00000 -0.01137 0.00000 0.01842 0.00256
|
|
139 15G+1 0.01379 0.00000 0.00306 0.00000 0.00000
|
|
140 15G-1 0.00000 -0.01276 0.00000 0.00078 -0.00412
|
|
141 15G+2 0.00000 -0.01629 0.00000 0.02824 0.00030
|
|
142 15G-2 0.00403 0.00000 -0.00503 0.00000 0.00000
|
|
143 15G+3 0.03087 0.00000 0.01139 0.00000 0.00000
|
|
144 15G-3 0.00000 -0.01983 0.00000 -0.03327 -0.00714
|
|
145 15G+4 0.00000 -0.01539 0.00000 -0.01525 0.01138
|
|
146 15G-4 -0.04608 0.00000 -0.01899 0.00000 0.00000
|
|
147 3 H 1S 0.05298 -0.00902 0.00813 -0.00469 -0.02923
|
|
148 2S -0.50073 1.14731 0.40759 -0.23532 0.59148
|
|
149 3S -8.06892 -10.72518 0.87613 -0.50583 -4.00616
|
|
150 4S -3.47531 -7.33647 -0.31316 0.18080 0.62255
|
|
151 5S 0.30312 0.03119 0.41423 -0.23916 -0.06925
|
|
152 6PX -0.05179 0.07576 0.03444 -0.04114 -0.02900
|
|
153 6PY -0.01513 -0.04374 -0.04114 -0.01306 0.01674
|
|
154 6PZ 0.02167 0.00259 -0.07655 0.04420 -0.01298
|
|
155 7PX 0.43828 -0.84102 -0.30680 0.38327 0.16313
|
|
156 7PY 0.17572 0.48556 0.38327 0.13575 -0.09418
|
|
157 7PZ -0.09855 0.06436 0.73767 -0.42589 0.14679
|
|
158 8PX 1.69601 5.36980 0.13670 -1.30251 1.33433
|
|
159 8PY -2.36191 -3.10026 -1.30251 -1.36732 -0.77037
|
|
160 8PZ -2.42415 -1.23767 -2.96459 1.71161 -0.51512
|
|
161 9PX 0.78460 3.15871 0.57412 -0.22429 -0.15327
|
|
162 9PY -1.03529 -1.82368 -0.22429 0.31513 0.08849
|
|
163 9PZ -1.04021 -0.64903 -0.41962 0.24227 -0.40259
|
|
164 10D 0 0.00117 -0.04470 0.05974 -0.03449 -0.02045
|
|
165 10D+1 -0.02086 -0.02395 -0.01689 0.00701 0.02263
|
|
166 10D-1 0.02199 0.01383 0.00701 -0.00879 -0.01307
|
|
167 10D+2 0.02118 0.00332 -0.05116 -0.06854 0.03757
|
|
168 10D-2 -0.01547 -0.00574 -0.00947 -0.05116 -0.06508
|
|
169 11D 0 0.04655 0.38853 -0.54664 0.31560 0.23092
|
|
170 11D+1 0.58608 0.26543 0.26963 -0.15974 -0.14842
|
|
171 11D-1 -0.46456 -0.15325 -0.15974 0.08517 0.08569
|
|
172 11D+2 -0.26599 -0.10132 0.45973 0.63209 -0.31752
|
|
173 11D-2 0.51556 0.17548 0.10124 0.45973 0.54995
|
|
174 12D 0 -0.36146 0.75663 -0.04969 0.02869 -0.06286
|
|
175 12D+1 0.49669 0.39668 1.00017 -0.88266 0.25343
|
|
176 12D-1 -0.53925 -0.22902 -0.88266 -0.01905 -0.14632
|
|
177 12D+2 0.59944 -0.74652 -0.18213 0.15327 0.28120
|
|
178 12D-2 0.52169 1.29301 0.36358 -0.18213 -0.48705
|
|
179 13F 0 0.01680 0.03397 0.02692 -0.01554 0.04892
|
|
180 13F+1 0.02393 -0.03647 0.04524 -0.01336 -0.01790
|
|
181 13F-1 -0.01730 0.02105 -0.01336 0.02981 0.01033
|
|
182 13F+2 0.00762 -0.02062 -0.01460 0.02153 -0.01312
|
|
183 13F-2 0.03441 0.03571 0.03839 -0.01460 0.02272
|
|
184 13F+3 -0.02359 0.00000 -0.02985 -0.05170 0.00000
|
|
185 13F-3 0.02007 -0.06755 -0.02751 0.01588 -0.01920
|
|
186 14F 0 0.14618 0.01443 -0.02536 0.01464 -0.25854
|
|
187 14F+1 0.10616 0.00007 0.13859 -0.13283 0.11462
|
|
188 14F-1 0.02287 -0.00004 -0.13283 -0.01478 -0.06618
|
|
189 14F+2 -0.06815 0.03154 -0.04733 0.20281 0.06293
|
|
190 14F-2 0.28632 -0.05463 0.25745 -0.04733 -0.10900
|
|
191 14F+3 -0.23489 0.00000 0.03579 0.06198 0.00000
|
|
192 14F-3 -0.45910 0.02580 0.10389 -0.05998 0.17696
|
|
193 15G 0 0.00680 -0.01137 0.01595 -0.00921 0.00256
|
|
194 15G+1 0.00414 -0.01105 0.00135 0.00099 -0.00357
|
|
195 15G-1 0.00557 0.00638 0.00099 0.00249 0.00206
|
|
196 15G+2 -0.00472 0.00815 -0.01441 0.00329 -0.00015
|
|
197 15G-2 0.01220 -0.01411 0.01992 -0.01441 0.00026
|
|
198 15G+3 -0.01543 0.00000 -0.00570 -0.00987 0.00000
|
|
199 15G-3 -0.01771 -0.01983 -0.02881 0.01663 -0.00714
|
|
200 15G+4 0.02118 0.00770 0.01483 0.01043 -0.00569
|
|
201 15G-4 -0.00939 0.01333 0.00669 -0.01483 -0.00986
|
|
202 4 H 1S -0.05298 -0.00902 -0.00813 -0.00469 -0.02923
|
|
203 2S 0.50073 1.14731 -0.40759 -0.23532 0.59148
|
|
204 3S 8.06892 -10.72518 -0.87613 -0.50583 -4.00616
|
|
205 4S 3.47531 -7.33647 0.31316 0.18080 0.62255
|
|
206 5S -0.30312 0.03119 -0.41423 -0.23916 -0.06925
|
|
207 6PX -0.05179 -0.07576 0.03444 0.04114 0.02900
|
|
208 6PY 0.01513 -0.04374 0.04114 -0.01306 0.01674
|
|
209 6PZ -0.02167 0.00259 0.07655 0.04420 -0.01298
|
|
210 7PX 0.43828 0.84102 -0.30680 -0.38327 -0.16313
|
|
211 7PY -0.17572 0.48556 -0.38327 0.13575 -0.09418
|
|
212 7PZ 0.09855 0.06436 -0.73767 -0.42589 0.14679
|
|
213 8PX 1.69601 -5.36980 0.13670 1.30251 -1.33433
|
|
214 8PY 2.36191 -3.10026 1.30251 -1.36732 -0.77037
|
|
215 8PZ 2.42415 -1.23767 2.96459 1.71161 -0.51512
|
|
216 9PX 0.78460 -3.15871 0.57412 0.22429 0.15327
|
|
217 9PY 1.03529 -1.82368 0.22429 0.31513 0.08849
|
|
218 9PZ 1.04021 -0.64903 0.41962 0.24227 -0.40259
|
|
219 10D 0 -0.00117 -0.04470 -0.05974 -0.03449 -0.02045
|
|
220 10D+1 -0.02086 0.02395 -0.01689 -0.00701 -0.02263
|
|
221 10D-1 -0.02199 0.01383 -0.00701 -0.00879 -0.01307
|
|
222 10D+2 -0.02118 0.00332 0.05116 -0.06854 0.03757
|
|
223 10D-2 -0.01547 0.00574 -0.00947 0.05116 0.06508
|
|
224 11D 0 -0.04655 0.38853 0.54664 0.31560 0.23092
|
|
225 11D+1 0.58608 -0.26543 0.26963 0.15974 0.14842
|
|
226 11D-1 0.46456 -0.15325 0.15974 0.08517 0.08569
|
|
227 11D+2 0.26599 -0.10132 -0.45973 0.63209 -0.31752
|
|
228 11D-2 0.51556 -0.17548 0.10124 -0.45973 -0.54995
|
|
229 12D 0 0.36146 0.75663 0.04969 0.02869 -0.06286
|
|
230 12D+1 0.49669 -0.39668 1.00017 0.88266 -0.25343
|
|
231 12D-1 0.53925 -0.22902 0.88266 -0.01905 -0.14632
|
|
232 12D+2 -0.59944 -0.74652 0.18213 0.15327 0.28120
|
|
233 12D-2 0.52169 -1.29301 0.36358 0.18213 0.48705
|
|
234 13F 0 -0.01680 0.03397 -0.02692 -0.01554 0.04892
|
|
235 13F+1 0.02393 0.03647 0.04524 0.01336 0.01790
|
|
236 13F-1 0.01730 0.02105 0.01336 0.02981 0.01033
|
|
237 13F+2 -0.00762 -0.02062 0.01460 0.02153 -0.01312
|
|
238 13F-2 0.03441 -0.03571 0.03839 0.01460 -0.02272
|
|
239 13F+3 -0.02359 0.00000 -0.02985 0.05170 0.00000
|
|
240 13F-3 -0.02007 -0.06755 0.02751 0.01588 -0.01920
|
|
241 14F 0 -0.14618 0.01443 0.02536 0.01464 -0.25854
|
|
242 14F+1 0.10616 -0.00007 0.13859 0.13283 -0.11462
|
|
243 14F-1 -0.02287 -0.00004 0.13283 -0.01478 -0.06618
|
|
244 14F+2 0.06815 0.03154 0.04733 0.20281 0.06293
|
|
245 14F-2 0.28632 0.05463 0.25745 0.04733 0.10900
|
|
246 14F+3 -0.23489 0.00000 0.03579 -0.06198 0.00000
|
|
247 14F-3 0.45910 0.02580 -0.10389 -0.05998 0.17696
|
|
248 15G 0 -0.00680 -0.01137 -0.01595 -0.00921 0.00256
|
|
249 15G+1 0.00414 0.01105 0.00135 -0.00099 0.00357
|
|
250 15G-1 -0.00557 0.00638 -0.00099 0.00249 0.00206
|
|
251 15G+2 0.00472 0.00815 0.01441 0.00329 -0.00015
|
|
252 15G-2 0.01220 0.01411 0.01992 0.01441 -0.00026
|
|
253 15G+3 -0.01543 0.00000 -0.00570 0.00987 0.00000
|
|
254 15G-3 0.01771 -0.01983 0.02881 0.01663 -0.00714
|
|
255 15G+4 -0.02118 0.00770 -0.01483 0.01043 -0.00569
|
|
256 15G-4 -0.00939 -0.01333 0.00669 0.01483 0.00986
|
|
116 117 118 119 120
|
|
(A2)--V (E)--V (E)--V (A1)--V (A1)--V
|
|
Eigenvalues -- 6.18665 6.20051 6.20051 6.28187 6.56452
|
|
1 1 N 1S 0.00000 0.00000 0.00000 -0.14838 -0.03855
|
|
2 2S 0.00000 0.00000 0.00000 0.26226 -0.01847
|
|
3 3S 0.00000 0.00000 0.00000 -0.65923 -0.59903
|
|
4 4S 0.00000 0.00000 0.00000 -2.33592 -0.53081
|
|
5 5S 0.00000 0.00000 0.00000 36.95018 21.47214
|
|
6 6S 0.00000 0.00000 0.00000 9.46004 8.33938
|
|
7 7PX 0.00000 0.00000 -0.00130 0.00000 0.00000
|
|
8 7PY 0.00000 -0.00130 0.00000 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 -0.02486 0.01938
|
|
10 8PX 0.00000 0.00000 0.47987 0.00000 0.00000
|
|
11 8PY 0.00000 0.47987 0.00000 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 1.07339 0.81254
|
|
13 9PX 0.00000 0.00000 -2.72897 0.00000 0.00000
|
|
14 9PY 0.00000 -2.72897 0.00000 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 -8.18770 -5.82641
|
|
16 10PX 0.00000 0.00000 -0.61136 0.00000 0.00000
|
|
17 10PY 0.00000 -0.61136 0.00000 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 -7.98244 -4.93489
|
|
19 11PX 0.00000 0.00000 0.06489 0.00000 0.00000
|
|
20 11PY 0.00000 0.06489 0.00000 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 -0.56788 -0.74128
|
|
22 12D 0 0.00000 0.00000 0.00000 0.01035 0.02243
|
|
23 12D+1 0.00000 0.00000 0.01129 0.00000 0.00000
|
|
24 12D-1 0.00000 0.01129 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00906 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00906 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.10856 -0.06413
|
|
28 13D+1 0.00000 0.00000 -0.14237 0.00000 0.00000
|
|
29 13D-1 0.00000 -0.14237 0.00000 0.00000 0.00000
|
|
30 13D+2 0.00000 -0.12994 0.00000 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 -0.12994 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 -3.23699 0.11298
|
|
33 14D+1 0.00000 0.00000 -0.89541 0.00000 0.00000
|
|
34 14D-1 0.00000 -0.89541 0.00000 0.00000 0.00000
|
|
35 14D+2 0.00000 4.72874 0.00000 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 4.72874 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 -1.20289 -0.82949
|
|
38 15D+1 0.00000 0.00000 -1.74232 0.00000 0.00000
|
|
39 15D-1 0.00000 -1.74232 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 2.19657 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 2.19657 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 -0.14146 0.01154
|
|
43 16F+1 0.00000 0.00000 -0.03355 0.00000 0.00000
|
|
44 16F-1 0.00000 -0.03355 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.01428 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.01428 0.00000 0.00000
|
|
47 16F+3 -0.07938 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.13082 0.04133
|
|
49 17F 0 0.00000 0.00000 0.00000 1.46391 0.00705
|
|
50 17F+1 0.00000 0.00000 0.13085 0.00000 0.00000
|
|
51 17F-1 0.00000 0.13085 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 -0.09021 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 -0.09021 0.00000 0.00000
|
|
54 17F+3 0.38642 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 -1.46301 -0.65515
|
|
56 18F 0 0.00000 0.00000 0.00000 1.54018 0.60520
|
|
57 18F+1 0.00000 0.00000 1.64958 0.00000 0.00000
|
|
58 18F-1 0.00000 1.64958 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 -0.30716 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 -0.30716 0.00000 0.00000
|
|
61 18F+3 3.75945 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 -1.57069 -2.72135
|
|
63 19G 0 0.00000 0.00000 0.00000 -0.01062 -0.00746
|
|
64 19G+1 0.00000 0.00000 0.01706 0.00000 0.00000
|
|
65 19G-1 0.00000 0.01706 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.03279 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.03279 0.00000 0.00000
|
|
68 19G+3 0.14606 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.10121 -0.08339
|
|
70 19G+4 0.00000 0.00478 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 -0.00478 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 -0.18670 -0.16184
|
|
73 20G+1 0.00000 0.00000 -0.29789 0.00000 0.00000
|
|
74 20G-1 0.00000 -0.29789 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 -0.88901 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 -0.88901 0.00000 0.00000
|
|
77 20G+3 -2.34070 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.47825 1.65075
|
|
79 20G+4 0.00000 0.07351 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 -0.07351 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 -0.04240 0.02027
|
|
82 21H+1 0.00000 0.00000 -0.06900 0.00000 0.00000
|
|
83 21H-1 0.00000 -0.06900 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.10622 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.10622 0.00000 0.00000
|
|
86 21H+3 0.09636 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 -0.02034 -0.07403
|
|
88 21H+4 0.00000 -0.05516 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.05516 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.13321 0.00000 0.00000
|
|
91 21H-5 0.00000 -0.13321 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00116 0.00000 -0.01046 0.05348
|
|
93 2S 0.00000 0.06473 0.00000 0.60127 -0.68960
|
|
94 3S 0.00000 3.70982 0.00000 -13.57774 -6.71578
|
|
95 4S 0.00000 1.58441 0.00000 -4.25237 -4.14422
|
|
96 5S 0.00000 0.04012 0.00000 -0.14177 -0.02721
|
|
97 6PX 0.04330 0.00000 -0.14120 0.00000 0.00000
|
|
98 6PY 0.00000 0.09320 0.00000 -0.05998 0.00716
|
|
99 6PZ 0.00000 0.08691 0.00000 0.04244 -0.01518
|
|
100 7PX -0.53562 0.00000 1.19877 0.00000 0.00000
|
|
101 7PY 0.00000 -0.74135 0.00000 0.10973 -0.17417
|
|
102 7PZ 0.00000 -0.83348 0.00000 -0.18400 0.12491
|
|
103 8PX 3.61782 0.00000 -2.89211 0.00000 0.00000
|
|
104 8PY 0.00000 -0.62651 0.00000 6.68263 3.72875
|
|
105 8PZ 0.00000 4.06901 0.00000 -2.52365 -1.21454
|
|
106 9PX 0.86685 0.00000 -1.03742 0.00000 0.00000
|
|
107 9PY 0.00000 -1.00887 0.00000 2.37130 1.90804
|
|
108 9PZ 0.00000 1.18321 0.00000 -0.75477 -0.58786
|
|
109 10D 0 0.00000 -0.05279 0.00000 -0.07625 0.01791
|
|
110 10D+1 0.01889 0.00000 0.09574 0.00000 0.00000
|
|
111 10D-1 0.00000 0.08584 0.00000 -0.12769 0.03106
|
|
112 10D+2 0.00000 -0.02773 0.00000 -0.12112 -0.07103
|
|
113 10D-2 0.05631 0.00000 -0.06899 0.00000 0.00000
|
|
114 11D 0 0.00000 0.38048 0.00000 0.71447 0.07327
|
|
115 11D+1 0.01724 0.00000 -0.69673 0.00000 0.00000
|
|
116 11D-1 0.00000 -0.98318 0.00000 1.38539 -0.00895
|
|
117 11D+2 0.00000 0.03869 0.00000 1.38588 0.92784
|
|
118 11D-2 -0.78664 0.00000 0.47621 0.00000 0.00000
|
|
119 12D 0 0.00000 0.67131 0.00000 0.35390 0.21893
|
|
120 12D+1 0.68708 0.00000 -0.36135 0.00000 0.00000
|
|
121 12D-1 0.00000 -1.43376 0.00000 0.45660 0.36108
|
|
122 12D+2 0.00000 -0.07147 0.00000 0.69486 1.12165
|
|
123 12D-2 -1.60774 0.00000 1.35291 0.00000 0.00000
|
|
124 13F 0 0.00000 -0.02784 0.00000 0.02384 0.02065
|
|
125 13F+1 0.00456 0.00000 0.01372 0.00000 0.00000
|
|
126 13F-1 0.00000 -0.02657 0.00000 0.00033 -0.03602
|
|
127 13F+2 0.00000 -0.02770 0.00000 0.04656 0.01357
|
|
128 13F-2 -0.05401 0.00000 -0.01586 0.00000 0.00000
|
|
129 13F+3 -0.07200 0.00000 0.01129 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00263 0.00000 -0.05749 0.03366
|
|
131 14F 0 0.00000 -0.16640 0.00000 0.30680 -0.13398
|
|
132 14F+1 -0.25452 0.00000 -0.18448 0.00000 0.00000
|
|
133 14F-1 0.00000 -0.53445 0.00000 -0.11596 -0.09205
|
|
134 14F+2 0.00000 -0.44034 0.00000 0.27054 0.16480
|
|
135 14F-2 0.01809 0.00000 0.68916 0.00000 0.00000
|
|
136 14F+3 -0.53590 0.00000 0.51021 0.00000 0.00000
|
|
137 14F-3 0.00000 -0.21657 0.00000 -0.15630 -0.82930
|
|
138 15G 0 0.00000 -0.03337 0.00000 0.00637 -0.01058
|
|
139 15G+1 -0.01325 0.00000 0.00309 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00542 0.00000 -0.01838 -0.01235
|
|
141 15G+2 0.00000 -0.03223 0.00000 0.00194 -0.01117
|
|
142 15G-2 0.02838 0.00000 0.01287 0.00000 0.00000
|
|
143 15G+3 -0.01795 0.00000 0.03671 0.00000 0.00000
|
|
144 15G-3 0.00000 0.01239 0.00000 -0.02289 -0.01202
|
|
145 15G+4 0.00000 -0.01363 0.00000 -0.01459 -0.01933
|
|
146 15G-4 0.05173 0.00000 -0.02579 0.00000 0.00000
|
|
147 3 H 1S 0.00000 -0.00058 0.00101 -0.01046 0.05348
|
|
148 2S 0.00000 -0.03237 0.05606 0.60127 -0.68960
|
|
149 3S 0.00000 -1.85491 3.21279 -13.57774 -6.71578
|
|
150 4S 0.00000 -0.79220 1.37214 -4.25237 -4.14422
|
|
151 5S 0.00000 -0.02006 0.03475 -0.14177 -0.02721
|
|
152 6PX -0.02165 -0.10150 0.03460 -0.05194 0.00620
|
|
153 6PY -0.03750 -0.08260 -0.10150 0.02999 -0.00358
|
|
154 6PZ 0.00000 -0.04345 0.07527 0.04244 -0.01518
|
|
155 7PX 0.26781 0.84010 -0.25632 0.09503 -0.15084
|
|
156 7PY 0.46386 0.71374 0.84010 -0.05486 0.08709
|
|
157 7PZ 0.00000 0.41674 -0.72182 -0.18400 0.12491
|
|
158 8PX -1.80891 -0.98103 -1.19291 5.78733 3.22920
|
|
159 8PY -3.13313 -2.32571 -0.98103 -3.34132 -1.86438
|
|
160 8PZ 0.00000 -2.03451 3.52387 -2.52365 -1.21454
|
|
161 9PX -0.43342 -0.01236 -1.01601 2.05360 1.65241
|
|
162 9PY -0.75071 -1.03029 -0.01236 -1.18565 -0.95402
|
|
163 9PZ 0.00000 -0.59160 1.02469 -0.75477 -0.58786
|
|
164 10D 0 0.00000 0.02639 -0.04571 -0.07625 0.01791
|
|
165 10D+1 -0.00945 0.00429 0.08831 -0.11058 0.02690
|
|
166 10D-1 -0.01636 0.09326 0.00429 0.06385 -0.01553
|
|
167 10D+2 -0.04876 -0.05868 -0.01787 0.06056 0.03552
|
|
168 10D-2 -0.02815 -0.01787 -0.03804 -0.10489 -0.06152
|
|
169 11D 0 0.00000 -0.19024 0.32951 0.71447 0.07327
|
|
170 11D+1 -0.00862 0.12403 -0.91156 1.19979 -0.00775
|
|
171 11D-1 -0.01493 -0.76834 0.12403 -0.69270 0.00448
|
|
172 11D+2 0.68125 0.36683 0.18945 -0.69294 -0.46392
|
|
173 11D-2 0.39332 0.18945 0.14807 1.20021 0.80353
|
|
174 12D 0 0.00000 -0.33565 0.58137 0.35390 0.21893
|
|
175 12D+1 -0.34354 0.46437 -1.16566 0.39543 0.31270
|
|
176 12D-1 -0.59503 -0.62945 0.46437 -0.22830 -0.18054
|
|
177 12D+2 1.39234 0.99682 0.61677 -0.34743 -0.56083
|
|
178 12D-2 0.80387 0.61677 0.28463 0.60176 0.97138
|
|
179 13F 0 0.00000 0.01392 -0.02411 0.02384 0.02065
|
|
180 13F+1 -0.00228 0.01745 -0.01650 0.00029 -0.03120
|
|
181 13F-1 -0.00395 0.00365 0.01745 -0.00016 0.01801
|
|
182 13F+2 0.04678 -0.01882 0.00513 -0.02328 -0.00678
|
|
183 13F-2 0.02701 0.00513 -0.02474 0.04032 0.01175
|
|
184 13F+3 -0.07200 -0.00978 -0.00564 0.00000 0.00000
|
|
185 13F-3 0.00000 -0.00131 0.00228 -0.05749 0.03366
|
|
186 14F 0 0.00000 0.08320 -0.14411 0.30680 -0.13398
|
|
187 14F+1 0.12726 0.15154 -0.44696 -0.10043 -0.07972
|
|
188 14F-1 0.22042 -0.27197 0.15154 0.05798 0.04603
|
|
189 14F+2 -0.01567 0.40679 0.48909 -0.13527 -0.08240
|
|
190 14F-2 -0.00905 0.48909 -0.15796 0.23429 0.14272
|
|
191 14F+3 -0.53590 -0.44185 -0.25510 0.00000 0.00000
|
|
192 14F-3 0.00000 0.10828 -0.18755 -0.15630 -0.82930
|
|
193 15G 0 0.00000 0.01669 -0.02890 0.00637 -0.01058
|
|
194 15G+1 0.00662 -0.00101 0.00484 -0.01592 -0.01070
|
|
195 15G-1 0.01147 0.00368 -0.00101 0.00919 0.00618
|
|
196 15G+2 -0.02458 0.00160 0.01953 -0.00097 0.00558
|
|
197 15G-2 -0.01419 0.01953 -0.02095 0.00168 -0.00967
|
|
198 15G+3 -0.01795 -0.03179 -0.01836 0.00000 0.00000
|
|
199 15G-3 0.00000 -0.00620 0.01073 -0.02289 -0.01202
|
|
200 15G+4 0.04480 0.01594 0.01707 0.00729 0.00967
|
|
201 15G-4 -0.02586 -0.01707 0.00377 0.01263 0.01674
|
|
202 4 H 1S 0.00000 -0.00058 -0.00101 -0.01046 0.05348
|
|
203 2S 0.00000 -0.03237 -0.05606 0.60127 -0.68960
|
|
204 3S 0.00000 -1.85491 -3.21279 -13.57774 -6.71578
|
|
205 4S 0.00000 -0.79220 -1.37214 -4.25237 -4.14422
|
|
206 5S 0.00000 -0.02006 -0.03475 -0.14177 -0.02721
|
|
207 6PX -0.02165 0.10150 0.03460 0.05194 -0.00620
|
|
208 6PY 0.03750 -0.08260 0.10150 0.02999 -0.00358
|
|
209 6PZ 0.00000 -0.04345 -0.07527 0.04244 -0.01518
|
|
210 7PX 0.26781 -0.84010 -0.25632 -0.09503 0.15084
|
|
211 7PY -0.46386 0.71374 -0.84010 -0.05486 0.08709
|
|
212 7PZ 0.00000 0.41674 0.72182 -0.18400 0.12491
|
|
213 8PX -1.80891 0.98103 -1.19291 -5.78733 -3.22920
|
|
214 8PY 3.13313 -2.32571 0.98103 -3.34132 -1.86438
|
|
215 8PZ 0.00000 -2.03451 -3.52387 -2.52365 -1.21454
|
|
216 9PX -0.43342 0.01236 -1.01601 -2.05360 -1.65241
|
|
217 9PY 0.75071 -1.03029 0.01236 -1.18565 -0.95402
|
|
218 9PZ 0.00000 -0.59160 -1.02469 -0.75477 -0.58786
|
|
219 10D 0 0.00000 0.02639 0.04571 -0.07625 0.01791
|
|
220 10D+1 -0.00945 -0.00429 0.08831 0.11058 -0.02690
|
|
221 10D-1 0.01636 0.09326 -0.00429 0.06385 -0.01553
|
|
222 10D+2 0.04876 -0.05868 0.01787 0.06056 0.03552
|
|
223 10D-2 -0.02815 0.01787 -0.03804 0.10489 0.06152
|
|
224 11D 0 0.00000 -0.19024 -0.32951 0.71447 0.07327
|
|
225 11D+1 -0.00862 -0.12403 -0.91156 -1.19979 0.00775
|
|
226 11D-1 0.01493 -0.76834 -0.12403 -0.69270 0.00448
|
|
227 11D+2 -0.68125 0.36683 -0.18945 -0.69294 -0.46392
|
|
228 11D-2 0.39332 -0.18945 0.14807 -1.20021 -0.80353
|
|
229 12D 0 0.00000 -0.33565 -0.58137 0.35390 0.21893
|
|
230 12D+1 -0.34354 -0.46437 -1.16566 -0.39543 -0.31270
|
|
231 12D-1 0.59503 -0.62945 -0.46437 -0.22830 -0.18054
|
|
232 12D+2 -1.39234 0.99682 -0.61677 -0.34743 -0.56083
|
|
233 12D-2 0.80387 -0.61677 0.28463 -0.60176 -0.97138
|
|
234 13F 0 0.00000 0.01392 0.02411 0.02384 0.02065
|
|
235 13F+1 -0.00228 -0.01745 -0.01650 -0.00029 0.03120
|
|
236 13F-1 0.00395 0.00365 -0.01745 -0.00016 0.01801
|
|
237 13F+2 -0.04678 -0.01882 -0.00513 -0.02328 -0.00678
|
|
238 13F-2 0.02701 -0.00513 -0.02474 -0.04032 -0.01175
|
|
239 13F+3 -0.07200 0.00978 -0.00564 0.00000 0.00000
|
|
240 13F-3 0.00000 -0.00131 -0.00228 -0.05749 0.03366
|
|
241 14F 0 0.00000 0.08320 0.14411 0.30680 -0.13398
|
|
242 14F+1 0.12726 -0.15154 -0.44696 0.10043 0.07972
|
|
243 14F-1 -0.22042 -0.27197 -0.15154 0.05798 0.04603
|
|
244 14F+2 0.01567 0.40679 -0.48909 -0.13527 -0.08240
|
|
245 14F-2 -0.00905 -0.48909 -0.15796 -0.23429 -0.14272
|
|
246 14F+3 -0.53590 0.44185 -0.25510 0.00000 0.00000
|
|
247 14F-3 0.00000 0.10828 0.18755 -0.15630 -0.82930
|
|
248 15G 0 0.00000 0.01669 0.02890 0.00637 -0.01058
|
|
249 15G+1 0.00662 0.00101 0.00484 0.01592 0.01070
|
|
250 15G-1 -0.01147 0.00368 0.00101 0.00919 0.00618
|
|
251 15G+2 0.02458 0.00160 -0.01953 -0.00097 0.00558
|
|
252 15G-2 -0.01419 -0.01953 -0.02095 -0.00168 0.00967
|
|
253 15G+3 -0.01795 0.03179 -0.01836 0.00000 0.00000
|
|
254 15G-3 0.00000 -0.00620 -0.01073 -0.02289 -0.01202
|
|
255 15G+4 -0.04480 0.01594 -0.01707 0.00729 0.00967
|
|
256 15G-4 -0.02586 0.01707 0.00377 -0.01263 -0.01674
|
|
121 122 123 124 125
|
|
(E)--V (E)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 6.59572 6.59572 6.61698 6.93797 6.93797
|
|
1 1 N 1S 0.00000 0.00000 -0.00824 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.01527 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 -0.04623 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 0.66069 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 -0.29323 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.24384 0.00000 0.00000
|
|
7 7PX 0.00000 -0.01631 0.00000 0.00000 -0.00810
|
|
8 7PY 0.01631 0.00000 0.00000 -0.00810 0.00000
|
|
9 7PZ 0.00000 0.00000 -0.00665 0.00000 0.00000
|
|
10 8PX 0.00000 -0.51468 0.00000 0.00000 0.59831
|
|
11 8PY 0.51468 0.00000 0.00000 0.59831 0.00000
|
|
12 8PZ 0.00000 0.00000 -0.57154 0.00000 0.00000
|
|
13 9PX 0.00000 5.34575 0.00000 0.00000 -6.78413
|
|
14 9PY -5.34575 0.00000 0.00000 -6.78413 0.00000
|
|
15 9PZ 0.00000 0.00000 3.16893 0.00000 0.00000
|
|
16 10PX 0.00000 1.81779 0.00000 0.00000 -5.92248
|
|
17 10PY -1.81779 0.00000 0.00000 -5.92248 0.00000
|
|
18 10PZ 0.00000 0.00000 2.08684 0.00000 0.00000
|
|
19 11PX 0.00000 -0.11459 0.00000 0.00000 -0.35785
|
|
20 11PY 0.11459 0.00000 0.00000 -0.35785 0.00000
|
|
21 11PZ 0.00000 0.00000 0.04367 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.01497 0.00000 0.00000
|
|
23 12D+1 0.00000 -0.00839 0.00000 0.00000 0.03737
|
|
24 12D-1 0.00839 0.00000 0.00000 0.03737 0.00000
|
|
25 12D+2 -0.02689 0.00000 0.00000 -0.03822 0.00000
|
|
26 12D-2 0.00000 0.02689 0.00000 0.00000 -0.03822
|
|
27 13D 0 0.00000 0.00000 -0.17441 0.00000 0.00000
|
|
28 13D+1 0.00000 0.28674 0.00000 0.00000 -0.86240
|
|
29 13D-1 -0.28674 0.00000 0.00000 -0.86240 0.00000
|
|
30 13D+2 0.04579 0.00000 0.00000 0.24970 0.00000
|
|
31 13D-2 0.00000 -0.04579 0.00000 0.00000 0.24970
|
|
32 14D 0 0.00000 0.00000 -2.09939 0.00000 0.00000
|
|
33 14D+1 0.00000 -2.35537 0.00000 0.00000 3.22773
|
|
34 14D-1 2.35537 0.00000 0.00000 3.22773 0.00000
|
|
35 14D+2 1.36849 0.00000 0.00000 3.07701 0.00000
|
|
36 14D-2 0.00000 -1.36849 0.00000 0.00000 3.07701
|
|
37 15D 0 0.00000 0.00000 -1.42614 0.00000 0.00000
|
|
38 15D+1 0.00000 0.33175 0.00000 0.00000 1.97094
|
|
39 15D-1 -0.33175 0.00000 0.00000 1.97094 0.00000
|
|
40 15D+2 1.04215 0.00000 0.00000 1.89793 0.00000
|
|
41 15D-2 0.00000 -1.04215 0.00000 0.00000 1.89793
|
|
42 16F 0 0.00000 0.00000 0.00220 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00308 0.00000 0.00000 -0.02784
|
|
44 16F-1 -0.00308 0.00000 0.00000 -0.02784 0.00000
|
|
45 16F+2 0.04852 0.00000 0.00000 0.04275 0.00000
|
|
46 16F-2 0.00000 -0.04852 0.00000 0.00000 0.04275
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.03617 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 -0.05597 0.00000 0.00000
|
|
50 17F+1 0.00000 -0.07428 0.00000 0.00000 0.46594
|
|
51 17F-1 0.07428 0.00000 0.00000 0.46594 0.00000
|
|
52 17F+2 -0.57264 0.00000 0.00000 -0.55409 0.00000
|
|
53 17F-2 0.00000 0.57264 0.00000 0.00000 -0.55409
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 -0.23703 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.70302 0.00000 0.00000
|
|
57 18F+1 0.00000 -1.07266 0.00000 0.00000 -1.02733
|
|
58 18F-1 1.07266 0.00000 0.00000 -1.02733 0.00000
|
|
59 18F+2 -1.02868 0.00000 0.00000 -1.84368 0.00000
|
|
60 18F-2 0.00000 1.02868 0.00000 0.00000 -1.84368
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 -0.45697 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.10164 0.00000 0.00000
|
|
64 19G+1 0.00000 -0.11239 0.00000 0.00000 -0.06531
|
|
65 19G-1 0.11239 0.00000 0.00000 -0.06531 0.00000
|
|
66 19G+2 -0.02391 0.00000 0.00000 -0.07869 0.00000
|
|
67 19G-2 0.00000 0.02391 0.00000 0.00000 -0.07869
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 -0.05342 0.00000 0.00000
|
|
70 19G+4 -0.05311 0.00000 0.00000 0.04095 0.00000
|
|
71 19G-4 0.00000 -0.05311 0.00000 0.00000 -0.04095
|
|
72 20G 0 0.00000 0.00000 -0.63233 0.00000 0.00000
|
|
73 20G+1 0.00000 1.58634 0.00000 0.00000 0.40248
|
|
74 20G-1 -1.58634 0.00000 0.00000 0.40248 0.00000
|
|
75 20G+2 0.43864 0.00000 0.00000 1.18852 0.00000
|
|
76 20G-2 0.00000 -0.43864 0.00000 0.00000 1.18852
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.36433 0.00000 0.00000
|
|
79 20G+4 0.41199 0.00000 0.00000 -0.90763 0.00000
|
|
80 20G-4 0.00000 0.41199 0.00000 0.00000 0.90763
|
|
81 21H 0 0.00000 0.00000 -0.03137 0.00000 0.00000
|
|
82 21H+1 0.00000 -0.03077 0.00000 0.00000 0.02711
|
|
83 21H-1 0.03077 0.00000 0.00000 0.02711 0.00000
|
|
84 21H+2 0.00888 0.00000 0.00000 -0.01210 0.00000
|
|
85 21H-2 0.00000 -0.00888 0.00000 0.00000 -0.01210
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.07450 0.00000 0.00000
|
|
88 21H+4 0.01253 0.00000 0.00000 0.02650 0.00000
|
|
89 21H-4 0.00000 0.01253 0.00000 0.00000 -0.02650
|
|
90 21H+5 0.00000 0.02249 0.00000 0.00000 0.00043
|
|
91 21H-5 0.02249 0.00000 0.00000 -0.00043 0.00000
|
|
92 2 H 1S -0.05166 0.00000 0.01748 -0.04155 0.00000
|
|
93 2S 0.26567 0.00000 -0.52098 -0.41551 0.00000
|
|
94 3S 5.36071 0.00000 0.20276 10.78046 0.00000
|
|
95 4S 2.26131 0.00000 -0.05939 3.79141 0.00000
|
|
96 5S -0.20644 0.00000 -0.01597 -0.14081 0.00000
|
|
97 6PX 0.00000 0.02459 0.00000 0.00000 -0.05726
|
|
98 6PY -0.01128 0.00000 -0.06822 -0.00941 0.00000
|
|
99 6PZ 0.02209 0.00000 -0.12082 0.02737 0.00000
|
|
100 7PX 0.00000 -0.21741 0.00000 0.00000 0.40266
|
|
101 7PY 0.25277 0.00000 0.59913 0.37923 0.00000
|
|
102 7PZ -0.20153 0.00000 0.97011 -0.20790 0.00000
|
|
103 8PX 0.00000 0.42509 0.00000 0.00000 -0.67229
|
|
104 8PY -3.63577 0.00000 -0.91610 -6.11040 0.00000
|
|
105 8PZ 1.68625 0.00000 -1.74443 1.21967 0.00000
|
|
106 9PX 0.00000 0.55566 0.00000 0.00000 -0.10855
|
|
107 9PY -1.50607 0.00000 -0.19500 -2.17388 0.00000
|
|
108 9PZ 0.51634 0.00000 -0.58032 0.52803 0.00000
|
|
109 10D 0 0.08441 0.00000 0.03556 -0.04380 0.00000
|
|
110 10D+1 0.00000 0.03935 0.00000 0.00000 -0.06920
|
|
111 10D-1 0.06491 0.00000 -0.03961 0.03939 0.00000
|
|
112 10D+2 -0.04778 0.00000 0.03955 0.08146 0.00000
|
|
113 10D-2 0.00000 -0.00811 0.00000 0.00000 -0.07187
|
|
114 11D 0 -0.82967 0.00000 -0.14854 -0.02103 0.00000
|
|
115 11D+1 0.00000 -0.31631 0.00000 0.00000 0.57342
|
|
116 11D-1 -0.77190 0.00000 0.25736 -0.54241 0.00000
|
|
117 11D+2 -0.06167 0.00000 -0.14702 -1.19099 0.00000
|
|
118 11D-2 0.00000 0.08875 0.00000 0.00000 0.39953
|
|
119 12D 0 -0.79561 0.00000 -0.48091 -0.62753 0.00000
|
|
120 12D+1 0.00000 -0.26387 0.00000 0.00000 -0.15236
|
|
121 12D-1 -0.70808 0.00000 0.96004 -0.46560 0.00000
|
|
122 12D+2 -0.91822 0.00000 -0.46439 -1.36023 0.00000
|
|
123 12D-2 0.00000 -0.47463 0.00000 0.00000 0.18825
|
|
124 13F 0 0.01731 0.00000 -0.01408 -0.01866 0.00000
|
|
125 13F+1 0.00000 -0.01610 0.00000 0.00000 -0.03212
|
|
126 13F-1 0.00370 0.00000 -0.02653 0.08925 0.00000
|
|
127 13F+2 -0.00304 0.00000 -0.04517 0.01005 0.00000
|
|
128 13F-2 0.00000 -0.04612 0.00000 0.00000 -0.01970
|
|
129 13F+3 0.00000 0.02961 0.00000 0.00000 -0.06059
|
|
130 13F-3 0.04604 0.00000 -0.02729 0.04625 0.00000
|
|
131 14F 0 -0.74713 0.00000 0.16624 0.01080 0.00000
|
|
132 14F+1 0.00000 0.05744 0.00000 0.00000 0.42763
|
|
133 14F-1 0.57737 0.00000 0.45806 -0.22110 0.00000
|
|
134 14F+2 -0.34664 0.00000 0.58691 -0.40658 0.00000
|
|
135 14F-2 0.00000 0.47005 0.00000 0.00000 -0.09581
|
|
136 14F+3 0.00000 -0.27771 0.00000 0.00000 0.31547
|
|
137 14F-3 -0.16661 0.00000 0.29993 0.51125 0.00000
|
|
138 15G 0 0.00487 0.00000 0.01177 0.00844 0.00000
|
|
139 15G+1 0.00000 -0.01025 0.00000 0.00000 -0.00694
|
|
140 15G-1 0.04948 0.00000 -0.00515 -0.00480 0.00000
|
|
141 15G+2 0.02311 0.00000 0.02223 0.02532 0.00000
|
|
142 15G-2 0.00000 0.00726 0.00000 0.00000 -0.01596
|
|
143 15G+3 0.00000 -0.00601 0.00000 0.00000 -0.03278
|
|
144 15G-3 0.00281 0.00000 0.01295 0.00445 0.00000
|
|
145 15G+4 -0.01360 0.00000 -0.01130 0.04293 0.00000
|
|
146 15G-4 0.00000 -0.00787 0.00000 0.00000 -0.00248
|
|
147 3 H 1S 0.02583 0.04474 0.01748 0.02077 -0.03598
|
|
148 2S -0.13283 -0.23007 -0.52098 0.20776 -0.35984
|
|
149 3S -2.68036 -4.64251 0.20276 -5.39023 9.33615
|
|
150 4S -1.13065 -1.95835 -0.05939 -1.89571 3.28346
|
|
151 5S 0.10322 0.17878 -0.01597 0.07041 -0.12195
|
|
152 6PX -0.00576 0.01461 -0.05908 -0.02072 -0.02138
|
|
153 6PY -0.02126 0.00576 0.03411 -0.04530 -0.02072
|
|
154 6PZ -0.01105 -0.01913 -0.12082 -0.01368 0.02370
|
|
155 7PX -0.01531 -0.24393 0.51886 0.01015 0.38509
|
|
156 7PY 0.22625 0.01531 -0.29956 0.39681 0.01015
|
|
157 7PZ 0.10076 0.17453 0.97011 0.10395 -0.18005
|
|
158 8PX 1.39026 2.83310 -0.79337 2.35477 -4.75087
|
|
159 8PY -1.22776 -1.39026 0.45805 -2.03181 2.35477
|
|
160 8PZ -0.84312 -1.46033 -1.74443 -0.60984 1.05627
|
|
161 9PX 0.41154 1.26847 -0.16888 0.89431 -1.65755
|
|
162 9PY -0.79326 -0.41154 0.09750 -0.62489 0.89431
|
|
163 9PZ -0.25817 -0.44716 -0.58032 -0.26401 0.45729
|
|
164 10D 0 -0.04220 -0.07310 0.03556 0.02190 -0.03793
|
|
165 10D+1 -0.04515 -0.03885 -0.03430 -0.04702 0.01224
|
|
166 10D-1 -0.01328 0.04515 0.01980 -0.04205 -0.04702
|
|
167 10D+2 -0.00586 -0.02420 -0.01977 -0.03354 -0.06639
|
|
168 10D-2 0.02420 0.03380 0.03425 -0.06639 0.04313
|
|
169 11D 0 0.41483 0.71851 -0.14854 0.01051 -0.01821
|
|
170 11D+1 0.47121 0.49985 0.22288 0.48317 -0.26346
|
|
171 11D-1 0.04425 -0.47121 -0.12868 0.29446 0.48317
|
|
172 11D+2 -0.08198 0.01172 0.07351 0.00190 0.68871
|
|
173 11D-2 -0.01172 0.06844 -0.12732 0.68871 -0.79336
|
|
174 12D 0 0.39780 0.68902 -0.48091 0.31377 -0.54346
|
|
175 12D+1 0.42087 0.46509 0.83142 0.13564 -0.38729
|
|
176 12D-1 0.02088 -0.42087 -0.48002 -0.23067 0.13564
|
|
177 12D+2 0.12641 -0.60312 0.23220 -0.19887 0.67051
|
|
178 12D-2 0.60312 0.57001 -0.40217 0.67051 -0.97311
|
|
179 13F 0 -0.00865 -0.01499 -0.01408 0.00933 -0.01616
|
|
180 13F+1 0.00537 -0.00680 -0.02298 -0.05255 0.05891
|
|
181 13F-1 0.01300 -0.00537 0.01327 -0.00177 -0.05255
|
|
182 13F+2 0.03383 -0.02129 0.02259 -0.01226 -0.01288
|
|
183 13F-2 0.02129 -0.00925 -0.03912 -0.01288 0.00261
|
|
184 13F+3 0.02564 -0.01480 0.00000 0.05247 0.03030
|
|
185 13F-3 -0.02302 -0.03987 -0.02729 -0.02313 0.04006
|
|
186 14F 0 0.37356 0.64703 0.16624 -0.00540 0.00935
|
|
187 14F+1 -0.27488 -0.41866 0.39669 0.28091 -0.05892
|
|
188 14F-1 0.10126 0.27488 -0.22903 0.26545 0.28091
|
|
189 14F+2 -0.43920 0.05344 -0.29345 -0.17350 0.13456
|
|
190 14F-2 -0.05344 0.37749 0.50828 0.13456 -0.32889
|
|
191 14F+3 -0.24051 0.13886 0.00000 -0.27320 -0.15773
|
|
192 14F-3 0.08331 0.14429 0.29993 -0.25562 0.44276
|
|
193 15G 0 -0.00243 -0.00422 0.01177 -0.00422 0.00731
|
|
194 15G+1 -0.01698 -0.03967 -0.00446 -0.00092 -0.00534
|
|
195 15G-1 0.02006 0.01698 0.00258 -0.00641 -0.00092
|
|
196 15G+2 0.00034 0.01315 -0.01112 -0.00564 -0.01787
|
|
197 15G-2 -0.01315 -0.01552 0.01926 -0.01787 0.01500
|
|
198 15G+3 -0.00520 0.00300 0.00000 0.02839 0.01639
|
|
199 15G-3 -0.00141 -0.00243 0.01295 -0.00223 0.00386
|
|
200 15G+4 -0.00930 -0.00248 0.00565 0.01259 -0.01752
|
|
201 15G-4 -0.00248 -0.01217 0.00979 0.01752 -0.03282
|
|
202 4 H 1S 0.02583 -0.04474 0.01748 0.02077 0.03598
|
|
203 2S -0.13283 0.23007 -0.52098 0.20776 0.35984
|
|
204 3S -2.68036 4.64251 0.20276 -5.39023 -9.33615
|
|
205 4S -1.13065 1.95835 -0.05939 -1.89571 -3.28346
|
|
206 5S 0.10322 -0.17878 -0.01597 0.07041 0.12195
|
|
207 6PX 0.00576 0.01461 0.05908 0.02072 -0.02138
|
|
208 6PY -0.02126 -0.00576 0.03411 -0.04530 0.02072
|
|
209 6PZ -0.01105 0.01913 -0.12082 -0.01368 -0.02370
|
|
210 7PX 0.01531 -0.24393 -0.51886 -0.01015 0.38509
|
|
211 7PY 0.22625 -0.01531 -0.29956 0.39681 -0.01015
|
|
212 7PZ 0.10076 -0.17453 0.97011 0.10395 0.18005
|
|
213 8PX -1.39026 2.83310 0.79337 -2.35477 -4.75087
|
|
214 8PY -1.22776 1.39026 0.45805 -2.03181 -2.35477
|
|
215 8PZ -0.84312 1.46033 -1.74443 -0.60984 -1.05627
|
|
216 9PX -0.41154 1.26847 0.16888 -0.89431 -1.65755
|
|
217 9PY -0.79326 0.41154 0.09750 -0.62489 -0.89431
|
|
218 9PZ -0.25817 0.44716 -0.58032 -0.26401 -0.45729
|
|
219 10D 0 -0.04220 0.07310 0.03556 0.02190 0.03793
|
|
220 10D+1 0.04515 -0.03885 0.03430 0.04702 0.01224
|
|
221 10D-1 -0.01328 -0.04515 0.01980 -0.04205 0.04702
|
|
222 10D+2 -0.00586 0.02420 -0.01977 -0.03354 0.06639
|
|
223 10D-2 -0.02420 0.03380 -0.03425 0.06639 0.04313
|
|
224 11D 0 0.41483 -0.71851 -0.14854 0.01051 0.01821
|
|
225 11D+1 -0.47121 0.49985 -0.22288 -0.48317 -0.26346
|
|
226 11D-1 0.04425 0.47121 -0.12868 0.29446 -0.48317
|
|
227 11D+2 -0.08198 -0.01172 0.07351 0.00190 -0.68871
|
|
228 11D-2 0.01172 0.06844 0.12732 -0.68871 -0.79336
|
|
229 12D 0 0.39780 -0.68902 -0.48091 0.31377 0.54346
|
|
230 12D+1 -0.42087 0.46509 -0.83142 -0.13564 -0.38729
|
|
231 12D-1 0.02088 0.42087 -0.48002 -0.23067 -0.13564
|
|
232 12D+2 0.12641 0.60312 0.23220 -0.19887 -0.67051
|
|
233 12D-2 -0.60312 0.57001 0.40217 -0.67051 -0.97311
|
|
234 13F 0 -0.00865 0.01499 -0.01408 0.00933 0.01616
|
|
235 13F+1 -0.00537 -0.00680 0.02298 0.05255 0.05891
|
|
236 13F-1 0.01300 0.00537 0.01327 -0.00177 0.05255
|
|
237 13F+2 0.03383 0.02129 0.02259 -0.01226 0.01288
|
|
238 13F-2 -0.02129 -0.00925 0.03912 0.01288 0.00261
|
|
239 13F+3 -0.02564 -0.01480 0.00000 -0.05247 0.03030
|
|
240 13F-3 -0.02302 0.03987 -0.02729 -0.02313 -0.04006
|
|
241 14F 0 0.37356 -0.64703 0.16624 -0.00540 -0.00935
|
|
242 14F+1 0.27488 -0.41866 -0.39669 -0.28091 -0.05892
|
|
243 14F-1 0.10126 -0.27488 -0.22903 0.26545 -0.28091
|
|
244 14F+2 -0.43920 -0.05344 -0.29345 -0.17350 -0.13456
|
|
245 14F-2 0.05344 0.37749 -0.50828 -0.13456 -0.32889
|
|
246 14F+3 0.24051 0.13886 0.00000 0.27320 -0.15773
|
|
247 14F-3 0.08331 -0.14429 0.29993 -0.25562 -0.44276
|
|
248 15G 0 -0.00243 0.00422 0.01177 -0.00422 -0.00731
|
|
249 15G+1 0.01698 -0.03967 0.00446 0.00092 -0.00534
|
|
250 15G-1 0.02006 -0.01698 0.00258 -0.00641 0.00092
|
|
251 15G+2 0.00034 -0.01315 -0.01112 -0.00564 0.01787
|
|
252 15G-2 0.01315 -0.01552 -0.01926 0.01787 0.01500
|
|
253 15G+3 0.00520 0.00300 0.00000 -0.02839 0.01639
|
|
254 15G-3 -0.00141 0.00243 0.01295 -0.00223 -0.00386
|
|
255 15G+4 -0.00930 0.00248 0.00565 0.01259 0.01752
|
|
256 15G-4 0.00248 -0.01217 -0.00979 -0.01752 -0.03282
|
|
126 127 128 129 130
|
|
(E)--V (E)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 6.95993 6.95993 7.14656 7.14656 7.38448
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.01749
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 -0.17178
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 -0.32080
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 -3.56112
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 19.89383
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 5.64536
|
|
7 7PX 0.00000 0.00913 0.00000 0.02872 0.00000
|
|
8 7PY 0.00913 0.00000 0.02872 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.12456
|
|
10 8PX 0.00000 2.95232 0.00000 0.44247 0.00000
|
|
11 8PY 2.95232 0.00000 0.44247 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 1.00798
|
|
13 9PX 0.00000 -22.14301 0.00000 -2.36863 0.00000
|
|
14 9PY -22.14301 0.00000 -2.36863 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 -4.61653
|
|
16 10PX 0.00000 -17.42132 0.00000 0.84252 0.00000
|
|
17 10PY -17.42132 0.00000 0.84252 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 -3.03135
|
|
19 11PX 0.00000 -1.13772 0.00000 -0.06378 0.00000
|
|
20 11PY -1.13772 0.00000 -0.06378 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.28809
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.08064
|
|
23 12D+1 0.00000 -0.01852 0.00000 -0.00544 0.00000
|
|
24 12D-1 -0.01852 0.00000 -0.00544 0.00000 0.00000
|
|
25 12D+2 0.02422 0.00000 0.01772 0.00000 0.00000
|
|
26 12D-2 0.00000 0.02422 0.00000 0.01772 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 1.39258
|
|
28 13D+1 0.00000 -0.20159 0.00000 0.02195 0.00000
|
|
29 13D-1 -0.20159 0.00000 0.02195 0.00000 0.00000
|
|
30 13D+2 -1.10759 0.00000 -0.46148 0.00000 0.00000
|
|
31 13D-2 0.00000 -1.10759 0.00000 -0.46148 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 -2.06271
|
|
33 14D+1 0.00000 7.69885 0.00000 2.40959 0.00000
|
|
34 14D-1 7.69885 0.00000 2.40959 0.00000 0.00000
|
|
35 14D+2 8.95113 0.00000 2.43510 0.00000 0.00000
|
|
36 14D-2 0.00000 8.95113 0.00000 2.43510 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 -1.41522
|
|
38 15D+1 0.00000 3.68908 0.00000 -0.07277 0.00000
|
|
39 15D-1 3.68908 0.00000 -0.07277 0.00000 0.00000
|
|
40 15D+2 4.60845 0.00000 0.72381 0.00000 0.00000
|
|
41 15D-2 0.00000 4.60845 0.00000 0.72381 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 -0.06606
|
|
43 16F+1 0.00000 -0.03564 0.00000 0.05649 0.00000
|
|
44 16F-1 -0.03564 0.00000 0.05649 0.00000 0.00000
|
|
45 16F+2 0.07557 0.00000 0.08303 0.00000 0.00000
|
|
46 16F-2 0.00000 0.07557 0.00000 0.08303 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 -0.02867
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.68416
|
|
50 17F+1 0.00000 0.36297 0.00000 -0.51115 0.00000
|
|
51 17F-1 0.36297 0.00000 -0.51115 0.00000 0.00000
|
|
52 17F+2 -0.89382 0.00000 -0.74312 0.00000 0.00000
|
|
53 17F-2 0.00000 -0.89382 0.00000 -0.74312 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.31353
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 1.31730
|
|
57 18F+1 0.00000 0.19397 0.00000 -0.28855 0.00000
|
|
58 18F-1 0.19397 0.00000 -0.28855 0.00000 0.00000
|
|
59 18F+2 -2.01344 0.00000 -0.83415 0.00000 0.00000
|
|
60 18F-2 0.00000 -2.01344 0.00000 -0.83415 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 -1.10696
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.03546
|
|
64 19G+1 0.00000 -0.09267 0.00000 0.00716 0.00000
|
|
65 19G-1 -0.09267 0.00000 0.00716 0.00000 0.00000
|
|
66 19G+2 -0.00361 0.00000 0.04769 0.00000 0.00000
|
|
67 19G-2 0.00000 -0.00361 0.00000 0.04769 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 -0.00844
|
|
70 19G+4 -0.07611 0.00000 0.08158 0.00000 0.00000
|
|
71 19G-4 0.00000 0.07611 0.00000 -0.08158 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 -0.43780
|
|
73 20G+1 0.00000 -0.10873 0.00000 -0.17076 0.00000
|
|
74 20G-1 -0.10873 0.00000 -0.17076 0.00000 0.00000
|
|
75 20G+2 -0.04881 0.00000 -0.13824 0.00000 0.00000
|
|
76 20G-2 0.00000 -0.04881 0.00000 -0.13824 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.34701
|
|
79 20G+4 -0.31595 0.00000 -0.77843 0.00000 0.00000
|
|
80 20G-4 0.00000 0.31595 0.00000 0.77843 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00486
|
|
82 21H+1 0.00000 0.01992 0.00000 0.07436 0.00000
|
|
83 21H-1 0.01992 0.00000 0.07436 0.00000 0.00000
|
|
84 21H+2 0.07045 0.00000 0.00041 0.00000 0.00000
|
|
85 21H-2 0.00000 0.07045 0.00000 0.00041 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 -0.00319
|
|
88 21H+4 0.09745 0.00000 -0.00919 0.00000 0.00000
|
|
89 21H-4 0.00000 -0.09745 0.00000 0.00919 0.00000
|
|
90 21H+5 0.00000 0.07036 0.00000 0.03362 0.00000
|
|
91 21H-5 -0.07036 0.00000 -0.03362 0.00000 0.00000
|
|
92 2 H 1S 0.01253 0.00000 -0.04734 0.00000 -0.00058
|
|
93 2S -1.79956 0.00000 0.34577 0.00000 -0.00557
|
|
94 3S 28.81461 0.00000 3.59952 0.00000 -6.20829
|
|
95 4S 10.56380 0.00000 1.43054 0.00000 -2.77364
|
|
96 5S -0.11814 0.00000 0.01131 0.00000 -0.06680
|
|
97 6PX 0.00000 0.02986 0.00000 -0.13771 0.00000
|
|
98 6PY 0.06862 0.00000 -0.03910 0.00000 -0.00734
|
|
99 6PZ 0.00902 0.00000 -0.14263 0.00000 -0.02608
|
|
100 7PX 0.00000 -0.16887 0.00000 1.25804 0.00000
|
|
101 7PY 0.03432 0.00000 0.46020 0.00000 0.01052
|
|
102 7PZ -0.38864 0.00000 1.22168 0.00000 0.33856
|
|
103 8PX 0.00000 0.47531 0.00000 -1.88838 0.00000
|
|
104 8PY -14.20897 0.00000 -3.48455 0.00000 2.76233
|
|
105 8PZ 6.62029 0.00000 -0.95213 0.00000 -1.22620
|
|
106 9PX 0.00000 0.01717 0.00000 -0.87771 0.00000
|
|
107 9PY -5.94097 0.00000 -1.27549 0.00000 1.35710
|
|
108 9PZ 2.82095 0.00000 -0.15771 0.00000 -0.86616
|
|
109 10D 0 0.05765 0.00000 0.00235 0.00000 -0.06352
|
|
110 10D+1 0.00000 -0.01390 0.00000 0.00204 0.00000
|
|
111 10D-1 0.12953 0.00000 -0.04379 0.00000 0.06220
|
|
112 10D+2 0.16771 0.00000 0.02470 0.00000 0.00034
|
|
113 10D-2 0.00000 0.10711 0.00000 0.02030 0.00000
|
|
114 11D 0 -0.84686 0.00000 -0.19080 0.00000 0.57628
|
|
115 11D+1 0.00000 0.12470 0.00000 0.03526 0.00000
|
|
116 11D-1 -2.01761 0.00000 -0.06637 0.00000 -0.28561
|
|
117 11D+2 -2.45338 0.00000 -0.63008 0.00000 0.22892
|
|
118 11D-2 0.00000 -0.65035 0.00000 -0.23171 0.00000
|
|
119 12D 0 -0.52244 0.00000 -1.30711 0.00000 0.16541
|
|
120 12D+1 0.00000 -0.10992 0.00000 -0.31728 0.00000
|
|
121 12D-1 -2.53289 0.00000 0.59860 0.00000 0.73471
|
|
122 12D+2 -2.53843 0.00000 -1.15059 0.00000 0.29493
|
|
123 12D-2 0.00000 -0.18907 0.00000 1.46103 0.00000
|
|
124 13F 0 -0.07315 0.00000 -0.03737 0.00000 0.01415
|
|
125 13F+1 0.00000 0.00876 0.00000 -0.01197 0.00000
|
|
126 13F-1 0.01556 0.00000 -0.04953 0.00000 0.04996
|
|
127 13F+2 -0.11667 0.00000 -0.03553 0.00000 0.04432
|
|
128 13F-2 0.00000 0.03973 0.00000 -0.01122 0.00000
|
|
129 13F+3 0.00000 0.08160 0.00000 -0.00714 0.00000
|
|
130 13F-3 0.09806 0.00000 0.01949 0.00000 -0.03187
|
|
131 14F 0 -0.36988 0.00000 0.27420 0.00000 0.10123
|
|
132 14F+1 0.00000 -0.07152 0.00000 0.15415 0.00000
|
|
133 14F-1 -0.17690 0.00000 0.93537 0.00000 -0.35721
|
|
134 14F+2 -0.61353 0.00000 0.12524 0.00000 -0.02809
|
|
135 14F-2 0.00000 -0.15709 0.00000 0.20704 0.00000
|
|
136 14F+3 0.00000 -0.53185 0.00000 0.48263 0.00000
|
|
137 14F-3 0.62197 0.00000 0.34884 0.00000 0.15004
|
|
138 15G 0 -0.00967 0.00000 -0.00605 0.00000 0.00908
|
|
139 15G+1 0.00000 0.01052 0.00000 -0.00902 0.00000
|
|
140 15G-1 0.01959 0.00000 0.00529 0.00000 -0.00857
|
|
141 15G+2 -0.02180 0.00000 0.01507 0.00000 0.01539
|
|
142 15G-2 0.00000 0.01711 0.00000 -0.00377 0.00000
|
|
143 15G+3 0.00000 0.01815 0.00000 0.02677 0.00000
|
|
144 15G-3 0.04652 0.00000 -0.01288 0.00000 -0.00437
|
|
145 15G+4 0.02998 0.00000 0.04457 0.00000 0.00040
|
|
146 15G-4 0.00000 -0.01650 0.00000 -0.01596 0.00000
|
|
147 3 H 1S -0.00626 0.01085 0.02367 -0.04100 -0.00058
|
|
148 2S 0.89978 -1.55847 -0.17289 0.29945 -0.00557
|
|
149 3S -14.40730 24.95418 -1.79976 3.11728 -6.20829
|
|
150 4S -5.28190 9.14852 -0.71527 1.23888 -2.77364
|
|
151 5S 0.05907 -0.10231 -0.00565 0.00979 -0.06680
|
|
152 6PX -0.01678 0.05893 -0.04270 -0.06375 -0.00636
|
|
153 6PY 0.03955 -0.01678 -0.11306 -0.04270 0.00367
|
|
154 6PZ -0.00451 0.00781 0.07131 -0.12352 -0.02608
|
|
155 7PX -0.08798 -0.01648 0.34548 0.65966 0.00911
|
|
156 7PY -0.11808 -0.08798 1.05858 0.34548 -0.00526
|
|
157 7PZ 0.19432 -0.33657 -0.61084 1.05801 0.33856
|
|
158 8PX 6.35848 -10.53790 0.69116 -3.08551 2.39225
|
|
159 8PY -3.19576 6.35848 -2.28742 0.69116 -1.38117
|
|
160 8PZ -3.31015 5.73334 0.47607 -0.82457 -1.22620
|
|
161 9PX 2.57995 -4.45144 0.17224 -1.17604 1.17528
|
|
162 9PY -1.47237 2.57995 -0.97715 0.17224 -0.67855
|
|
163 9PZ -1.41047 2.44301 0.07885 -0.13658 -0.86616
|
|
164 10D 0 -0.02882 0.04993 -0.00118 0.00204 -0.06352
|
|
165 10D+1 -0.06210 0.09367 0.01985 -0.03233 0.05387
|
|
166 10D-1 0.02196 -0.06210 -0.00942 0.01985 -0.03110
|
|
167 10D+2 0.12226 -0.02624 0.02140 -0.00191 -0.00017
|
|
168 10D-2 -0.02624 0.15256 -0.00191 0.02360 0.00030
|
|
169 11D 0 0.42343 -0.73340 0.09540 -0.16524 0.57628
|
|
170 11D+1 0.92765 -1.48203 0.04401 -0.04096 -0.24735
|
|
171 11D-1 -0.41087 0.92765 0.00985 0.04401 0.14281
|
|
172 11D+2 -1.10111 0.78074 -0.33130 0.17250 -0.11446
|
|
173 11D-2 0.78074 -2.00262 0.17250 -0.53049 0.19825
|
|
174 12D 0 0.26122 -0.45244 0.65355 -1.13199 0.16541
|
|
175 12D+1 1.04918 -1.92714 -0.39659 0.36963 0.63628
|
|
176 12D-1 -0.71566 1.04918 -0.08831 -0.39659 -0.36736
|
|
177 12D+2 -0.77641 1.01731 0.80813 1.13086 -0.14747
|
|
178 12D-2 1.01731 -1.95109 1.13086 -0.49768 0.25542
|
|
179 13F 0 0.03658 -0.06335 0.01869 -0.03237 0.01415
|
|
180 13F+1 -0.00294 0.01386 0.01626 -0.04014 0.04326
|
|
181 13F-1 0.01046 -0.00294 -0.02136 0.01626 -0.02498
|
|
182 13F+2 0.00063 0.06772 -0.01730 0.01052 -0.02216
|
|
183 13F-2 0.06772 -0.07757 0.01052 -0.02945 0.03838
|
|
184 13F+3 -0.07066 -0.04080 0.00618 0.00357 0.00000
|
|
185 13F-3 -0.04903 0.08493 -0.00975 0.01688 -0.03187
|
|
186 14F 0 0.18494 -0.32033 -0.13710 0.23746 0.10123
|
|
187 14F+1 0.04563 -0.15055 -0.33828 0.74006 -0.30935
|
|
188 14F-1 -0.09787 0.04563 0.34945 -0.33828 0.17860
|
|
189 14F+2 -0.27120 0.19764 0.18659 0.03542 0.01405
|
|
190 14F-2 0.19764 -0.49942 0.03542 0.14569 -0.02433
|
|
191 14F+3 0.46060 0.26592 -0.41797 -0.24131 0.00000
|
|
192 14F-3 -0.31098 0.53864 -0.17442 0.30210 0.15004
|
|
193 15G 0 0.00484 -0.00838 0.00303 -0.00524 0.00908
|
|
194 15G+1 -0.00393 0.01732 -0.00620 0.00171 -0.00742
|
|
195 15G-1 0.01279 -0.00393 -0.00544 -0.00620 0.00428
|
|
196 15G+2 0.00738 0.01685 0.00094 -0.00816 -0.00770
|
|
197 15G-2 0.01685 -0.01207 -0.00816 0.01036 0.01333
|
|
198 15G+3 -0.01572 -0.00907 -0.02319 -0.01339 0.00000
|
|
199 15G-3 -0.02326 0.04029 0.00644 -0.01116 -0.00437
|
|
200 15G+4 0.01987 -0.00584 0.02311 -0.01239 -0.00020
|
|
201 15G-4 0.00584 -0.02661 0.01239 -0.03742 -0.00035
|
|
202 4 H 1S -0.00626 -0.01085 0.02367 0.04100 -0.00058
|
|
203 2S 0.89978 1.55847 -0.17289 -0.29945 -0.00557
|
|
204 3S -14.40730 -24.95418 -1.79976 -3.11728 -6.20829
|
|
205 4S -5.28190 -9.14852 -0.71527 -1.23888 -2.77364
|
|
206 5S 0.05907 0.10231 -0.00565 -0.00979 -0.06680
|
|
207 6PX 0.01678 0.05893 0.04270 -0.06375 0.00636
|
|
208 6PY 0.03955 0.01678 -0.11306 0.04270 0.00367
|
|
209 6PZ -0.00451 -0.00781 0.07131 0.12352 -0.02608
|
|
210 7PX 0.08798 -0.01648 -0.34548 0.65966 -0.00911
|
|
211 7PY -0.11808 0.08798 1.05858 -0.34548 -0.00526
|
|
212 7PZ 0.19432 0.33657 -0.61084 -1.05801 0.33856
|
|
213 8PX -6.35848 -10.53790 -0.69116 -3.08551 -2.39225
|
|
214 8PY -3.19576 -6.35848 -2.28742 -0.69116 -1.38117
|
|
215 8PZ -3.31015 -5.73334 0.47607 0.82457 -1.22620
|
|
216 9PX -2.57995 -4.45144 -0.17224 -1.17604 -1.17528
|
|
217 9PY -1.47237 -2.57995 -0.97715 -0.17224 -0.67855
|
|
218 9PZ -1.41047 -2.44301 0.07885 0.13658 -0.86616
|
|
219 10D 0 -0.02882 -0.04993 -0.00118 -0.00204 -0.06352
|
|
220 10D+1 0.06210 0.09367 -0.01985 -0.03233 -0.05387
|
|
221 10D-1 0.02196 0.06210 -0.00942 -0.01985 -0.03110
|
|
222 10D+2 0.12226 0.02624 0.02140 0.00191 -0.00017
|
|
223 10D-2 0.02624 0.15256 0.00191 0.02360 -0.00030
|
|
224 11D 0 0.42343 0.73340 0.09540 0.16524 0.57628
|
|
225 11D+1 -0.92765 -1.48203 -0.04401 -0.04096 0.24735
|
|
226 11D-1 -0.41087 -0.92765 0.00985 -0.04401 0.14281
|
|
227 11D+2 -1.10111 -0.78074 -0.33130 -0.17250 -0.11446
|
|
228 11D-2 -0.78074 -2.00262 -0.17250 -0.53049 -0.19825
|
|
229 12D 0 0.26122 0.45244 0.65355 1.13199 0.16541
|
|
230 12D+1 -1.04918 -1.92714 0.39659 0.36963 -0.63628
|
|
231 12D-1 -0.71566 -1.04918 -0.08831 0.39659 -0.36736
|
|
232 12D+2 -0.77641 -1.01731 0.80813 -1.13086 -0.14747
|
|
233 12D-2 -1.01731 -1.95109 -1.13086 -0.49768 -0.25542
|
|
234 13F 0 0.03658 0.06335 0.01869 0.03237 0.01415
|
|
235 13F+1 0.00294 0.01386 -0.01626 -0.04014 -0.04326
|
|
236 13F-1 0.01046 0.00294 -0.02136 -0.01626 -0.02498
|
|
237 13F+2 0.00063 -0.06772 -0.01730 -0.01052 -0.02216
|
|
238 13F-2 -0.06772 -0.07757 -0.01052 -0.02945 -0.03838
|
|
239 13F+3 0.07066 -0.04080 -0.00618 0.00357 0.00000
|
|
240 13F-3 -0.04903 -0.08493 -0.00975 -0.01688 -0.03187
|
|
241 14F 0 0.18494 0.32033 -0.13710 -0.23746 0.10123
|
|
242 14F+1 -0.04563 -0.15055 0.33828 0.74006 0.30935
|
|
243 14F-1 -0.09787 -0.04563 0.34945 0.33828 0.17860
|
|
244 14F+2 -0.27120 -0.19764 0.18659 -0.03542 0.01405
|
|
245 14F-2 -0.19764 -0.49942 -0.03542 0.14569 0.02433
|
|
246 14F+3 -0.46060 0.26592 0.41797 -0.24131 0.00000
|
|
247 14F-3 -0.31098 -0.53864 -0.17442 -0.30210 0.15004
|
|
248 15G 0 0.00484 0.00838 0.00303 0.00524 0.00908
|
|
249 15G+1 0.00393 0.01732 0.00620 0.00171 0.00742
|
|
250 15G-1 0.01279 0.00393 -0.00544 0.00620 0.00428
|
|
251 15G+2 0.00738 -0.01685 0.00094 0.00816 -0.00770
|
|
252 15G-2 -0.01685 -0.01207 0.00816 0.01036 -0.01333
|
|
253 15G+3 0.01572 -0.00907 0.02319 -0.01339 0.00000
|
|
254 15G-3 -0.02326 -0.04029 0.00644 0.01116 -0.00437
|
|
255 15G+4 0.01987 0.00584 0.02311 0.01239 -0.00020
|
|
256 15G-4 -0.00584 -0.02661 -0.01239 -0.03742 0.00035
|
|
131 132 133 134 135
|
|
(A2)--V (E)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 7.44360 7.46950 7.46950 8.02817 8.02817
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 0.01926 0.00000 -0.10604
|
|
8 7PY 0.00000 0.01926 0.00000 -0.10604 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 0.66955 0.00000 -2.34254
|
|
11 8PY 0.00000 0.66955 0.00000 -2.34254 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 -5.58440 0.00000 6.56402
|
|
14 9PY 0.00000 -5.58440 0.00000 6.56402 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 -7.34864 0.00000 7.84510
|
|
17 10PY 0.00000 -7.34864 0.00000 7.84510 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 -0.53961 0.00000 0.33737
|
|
20 11PY 0.00000 -0.53961 0.00000 0.33737 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.04470 0.00000 -0.08025
|
|
24 12D-1 0.00000 0.04470 0.00000 -0.08025 0.00000
|
|
25 12D+2 0.00000 0.00308 0.00000 0.01923 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00308 0.00000 0.01923
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 -1.02742 0.00000 0.78765
|
|
29 13D-1 0.00000 -1.02742 0.00000 0.78765 0.00000
|
|
30 13D+2 0.00000 -0.04248 0.00000 -0.58944 0.00000
|
|
31 13D-2 0.00000 0.00000 -0.04248 0.00000 -0.58944
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 3.77763 0.00000 -3.76583
|
|
34 14D-1 0.00000 3.77763 0.00000 -3.76583 0.00000
|
|
35 14D+2 0.00000 4.56758 0.00000 3.74778 0.00000
|
|
36 14D-2 0.00000 0.00000 4.56758 0.00000 3.74778
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 2.93242 0.00000 -2.37415
|
|
39 15D-1 0.00000 2.93242 0.00000 -2.37415 0.00000
|
|
40 15D+2 0.00000 0.48006 0.00000 0.06508 0.00000
|
|
41 15D-2 0.00000 0.00000 0.48006 0.00000 0.06508
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 -0.02728 0.00000 0.05873
|
|
44 16F-1 0.00000 -0.02728 0.00000 0.05873 0.00000
|
|
45 16F+2 0.00000 0.08353 0.00000 0.02227 0.00000
|
|
46 16F-2 0.00000 0.00000 0.08353 0.00000 0.02227
|
|
47 16F+3 -0.13406 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.46130 0.00000 -0.69531
|
|
51 17F-1 0.00000 0.46130 0.00000 -0.69531 0.00000
|
|
52 17F+2 0.00000 -0.87216 0.00000 -0.55600 0.00000
|
|
53 17F-2 0.00000 0.00000 -0.87216 0.00000 -0.55600
|
|
54 17F+3 1.21156 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 -1.38779 0.00000 -0.20311
|
|
58 18F-1 0.00000 -1.38779 0.00000 -0.20311 0.00000
|
|
59 18F+2 0.00000 0.27762 0.00000 -0.57406 0.00000
|
|
60 18F-2 0.00000 0.00000 0.27762 0.00000 -0.57406
|
|
61 18F+3 0.58933 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 -0.03414 0.00000 -0.05274
|
|
65 19G-1 0.00000 -0.03414 0.00000 -0.05274 0.00000
|
|
66 19G+2 0.00000 0.09969 0.00000 -0.00078 0.00000
|
|
67 19G-2 0.00000 0.00000 0.09969 0.00000 -0.00078
|
|
68 19G+3 -0.08287 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 -0.10151 0.00000 -0.09288 0.00000
|
|
71 19G-4 0.00000 0.00000 0.10151 0.00000 0.09288
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.02961 0.00000 0.98288
|
|
74 20G-1 0.00000 0.02961 0.00000 0.98288 0.00000
|
|
75 20G+2 0.00000 -1.20857 0.00000 0.02674 0.00000
|
|
76 20G-2 0.00000 0.00000 -1.20857 0.00000 0.02674
|
|
77 20G+3 0.35621 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 1.15229 0.00000 2.00138 0.00000
|
|
80 20G-4 0.00000 0.00000 -1.15229 0.00000 -2.00138
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.02143 0.00000 -0.05533
|
|
83 21H-1 0.00000 0.02143 0.00000 -0.05533 0.00000
|
|
84 21H+2 0.00000 0.03031 0.00000 0.01420 0.00000
|
|
85 21H-2 0.00000 0.00000 0.03031 0.00000 0.01420
|
|
86 21H+3 0.03710 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00202 0.00000 -0.20344 0.00000
|
|
89 21H-4 0.00000 0.00000 -0.00202 0.00000 0.20344
|
|
90 21H+5 0.00000 0.00000 0.04995 0.00000 0.06977
|
|
91 21H-5 0.00000 -0.04995 0.00000 -0.06977 0.00000
|
|
92 2 H 1S 0.00000 0.01613 0.00000 -0.07220 0.00000
|
|
93 2S 0.00000 -1.43987 0.00000 -1.65088 0.00000
|
|
94 3S 0.00000 11.36789 0.00000 -3.29919 0.00000
|
|
95 4S 0.00000 3.93148 0.00000 -1.90739 0.00000
|
|
96 5S 0.00000 -0.05865 0.00000 0.07078 0.00000
|
|
97 6PX 0.14381 0.00000 0.05354 0.00000 -0.00565
|
|
98 6PY 0.00000 -0.02296 0.00000 -0.17996 0.00000
|
|
99 6PZ 0.00000 -0.08758 0.00000 0.10851 0.00000
|
|
100 7PX -1.37612 0.00000 -0.41684 0.00000 0.31676
|
|
101 7PY 0.00000 0.55028 0.00000 1.80872 0.00000
|
|
102 7PZ 0.00000 0.68869 0.00000 -1.06208 0.00000
|
|
103 8PX 2.42074 0.00000 -0.18914 0.00000 -4.92803
|
|
104 8PY 0.00000 -6.08897 0.00000 -0.57591 0.00000
|
|
105 8PZ 0.00000 1.09446 0.00000 0.33824 0.00000
|
|
106 9PX 0.91325 0.00000 0.52966 0.00000 -1.31963
|
|
107 9PY 0.00000 -2.31642 0.00000 0.52031 0.00000
|
|
108 9PZ 0.00000 0.37061 0.00000 -0.21010 0.00000
|
|
109 10D 0 0.00000 0.01414 0.00000 0.03143 0.00000
|
|
110 10D+1 -0.04141 0.00000 0.12044 0.00000 0.09868
|
|
111 10D-1 0.00000 0.09145 0.00000 0.00199 0.00000
|
|
112 10D+2 0.00000 0.01962 0.00000 0.04403 0.00000
|
|
113 10D-2 0.00688 0.00000 -0.02260 0.00000 -0.17146
|
|
114 11D 0 0.00000 -0.24717 0.00000 -0.06759 0.00000
|
|
115 11D+1 0.29760 0.00000 -1.11859 0.00000 -1.09392
|
|
116 11D-1 0.00000 -1.05140 0.00000 0.36941 0.00000
|
|
117 11D+2 0.00000 -0.61576 0.00000 0.13986 0.00000
|
|
118 11D-2 -0.13798 0.00000 0.40415 0.00000 2.05519
|
|
119 12D 0 0.00000 -0.82977 0.00000 -0.22574 0.00000
|
|
120 12D+1 0.37257 0.00000 -0.66203 0.00000 -0.77622
|
|
121 12D-1 0.00000 -0.14686 0.00000 -0.64217 0.00000
|
|
122 12D+2 0.00000 -0.97047 0.00000 -0.75658 0.00000
|
|
123 12D-2 -1.95880 0.00000 -0.07513 0.00000 2.10296
|
|
124 13F 0 0.00000 -0.02950 0.00000 0.02980 0.00000
|
|
125 13F+1 -0.00267 0.00000 0.01635 0.00000 0.00504
|
|
126 13F-1 0.00000 0.02767 0.00000 -0.01191 0.00000
|
|
127 13F+2 0.00000 -0.05411 0.00000 0.02437 0.00000
|
|
128 13F-2 0.01523 0.00000 -0.02015 0.00000 0.04055
|
|
129 13F+3 0.04003 0.00000 0.02089 0.00000 0.06233
|
|
130 13F-3 0.00000 0.06656 0.00000 -0.07342 0.00000
|
|
131 14F 0 0.00000 -0.15711 0.00000 -0.17382 0.00000
|
|
132 14F+1 -0.12376 0.00000 -0.44278 0.00000 0.00688
|
|
133 14F-1 0.00000 0.07633 0.00000 0.11411 0.00000
|
|
134 14F+2 0.00000 -0.03560 0.00000 -0.14685 0.00000
|
|
135 14F-2 -0.42904 0.00000 0.94160 0.00000 0.89709
|
|
136 14F+3 -0.96516 0.00000 0.11083 0.00000 1.06461
|
|
137 14F-3 0.00000 -0.13096 0.00000 0.31451 0.00000
|
|
138 15G 0 0.00000 0.01856 0.00000 0.01302 0.00000
|
|
139 15G+1 -0.02497 0.00000 0.01090 0.00000 0.02348
|
|
140 15G-1 0.00000 0.03287 0.00000 0.00137 0.00000
|
|
141 15G+2 0.00000 0.00540 0.00000 -0.01510 0.00000
|
|
142 15G-2 -0.01882 0.00000 0.04628 0.00000 0.01959
|
|
143 15G+3 -0.02646 0.00000 0.03789 0.00000 0.08209
|
|
144 15G-3 0.00000 0.00742 0.00000 -0.01968 0.00000
|
|
145 15G+4 0.00000 -0.00097 0.00000 -0.01969 0.00000
|
|
146 15G-4 0.01296 0.00000 0.01152 0.00000 -0.08945
|
|
147 3 H 1S 0.00000 -0.00806 0.01397 0.03610 -0.06253
|
|
148 2S 0.00000 0.71993 -1.24696 0.82544 -1.42970
|
|
149 3S 0.00000 -5.68394 9.84488 1.64959 -2.85718
|
|
150 4S 0.00000 -1.96574 3.40476 0.95369 -1.65185
|
|
151 5S 0.00000 0.02932 -0.05079 -0.03539 0.06130
|
|
152 6PX -0.07191 0.03312 -0.00383 0.07548 -0.13638
|
|
153 6PY -0.12454 0.03442 0.03312 -0.04923 0.07548
|
|
154 6PZ 0.00000 0.04379 -0.07585 -0.05426 0.09397
|
|
155 7PX 0.68806 -0.41877 0.30850 -0.64604 1.43573
|
|
156 7PY 1.19175 -0.17506 -0.41877 0.68975 -0.64604
|
|
157 7PZ 0.00000 -0.34435 0.59642 0.53104 -0.91979
|
|
158 8PX -1.21037 2.55470 -4.61401 -1.88453 -1.66394
|
|
159 8PY -2.09642 -1.66409 2.55470 -3.84000 -1.88453
|
|
160 8PZ 0.00000 -0.54723 0.94783 -0.16912 0.29292
|
|
161 9PX -0.45662 1.23239 -1.60490 -0.79672 0.06032
|
|
162 9PY -0.79090 -0.18186 1.23239 -0.85965 -0.79672
|
|
163 9PZ 0.00000 -0.18530 0.32095 0.10505 -0.18195
|
|
164 10D 0 0.00000 -0.00707 0.01224 -0.01572 0.02722
|
|
165 10D+1 0.02070 0.01255 0.09870 0.04187 0.02616
|
|
166 10D-1 0.03586 0.11319 0.01255 0.07451 0.04187
|
|
167 10D+2 -0.00596 -0.01204 -0.01828 -0.11759 -0.09331
|
|
168 10D-2 -0.00344 -0.01828 0.00907 -0.09331 -0.00984
|
|
169 11D 0 0.00000 0.12358 -0.21406 0.03379 -0.05853
|
|
170 11D+1 -0.14880 -0.02910 -1.06820 -0.63364 0.00358
|
|
171 11D-1 -0.25773 -1.10179 -0.02910 -0.72809 -0.63364
|
|
172 11D+2 0.11949 0.14917 0.44163 1.57636 0.82936
|
|
173 11D-2 0.06899 0.44163 -0.36079 0.82936 0.61870
|
|
174 12D 0 0.00000 0.41489 -0.71860 0.11287 -0.19550
|
|
175 12D+1 -0.18628 -0.22308 -0.27565 -0.05804 -0.67568
|
|
176 12D-1 -0.32265 -0.53324 -0.22308 -0.74271 -0.05804
|
|
177 12D+2 1.69637 -0.29896 0.38769 1.38808 1.23822
|
|
178 12D-2 0.97940 0.38769 -0.74663 1.23822 -0.04169
|
|
179 13F 0 0.00000 0.01475 -0.02554 -0.01490 0.02581
|
|
180 13F+1 0.00134 -0.00490 0.02484 0.00734 -0.00767
|
|
181 13F-1 0.00232 0.01918 -0.00490 0.00081 0.00734
|
|
182 13F+2 -0.01319 -0.02864 0.01471 0.03650 0.00700
|
|
183 13F-2 -0.00761 0.01471 -0.04562 0.00700 0.02842
|
|
184 13F+3 0.04003 -0.01809 -0.01044 -0.05398 -0.03117
|
|
185 13F-3 0.00000 -0.03328 0.05765 0.03671 -0.06358
|
|
186 14F 0 0.00000 0.07855 -0.13606 0.08691 -0.15053
|
|
187 14F+1 0.06188 -0.22478 -0.05345 -0.04643 0.08731
|
|
188 14F-1 0.10718 -0.31301 -0.22478 0.03369 -0.04643
|
|
189 14F+2 0.37156 0.69730 0.42314 0.63610 0.45204
|
|
190 14F-2 0.21452 0.42314 0.20870 0.45204 0.11413
|
|
191 14F+3 -0.96516 -0.09598 -0.05542 -0.92198 -0.53230
|
|
192 14F-3 0.00000 0.06548 -0.11342 -0.15725 0.27237
|
|
193 15G 0 0.00000 -0.00928 0.01607 -0.00651 0.01128
|
|
194 15G+1 0.01249 -0.00951 0.02738 0.00957 0.00689
|
|
195 15G-1 0.02163 0.01640 -0.00951 0.01795 0.00957
|
|
196 15G+2 0.01630 0.03606 0.01770 0.01091 0.01502
|
|
197 15G-2 0.00941 0.01770 0.01562 0.01502 -0.00643
|
|
198 15G+3 -0.02646 -0.03282 -0.01895 -0.07109 -0.04104
|
|
199 15G-3 0.00000 -0.00371 0.00642 0.00984 -0.01705
|
|
200 15G+4 0.01123 -0.00888 -0.00457 0.06216 0.04726
|
|
201 15G-4 -0.00648 0.00457 0.00361 -0.04726 -0.00759
|
|
202 4 H 1S 0.00000 -0.00806 -0.01397 0.03610 0.06253
|
|
203 2S 0.00000 0.71993 1.24696 0.82544 1.42970
|
|
204 3S 0.00000 -5.68394 -9.84488 1.64959 2.85718
|
|
205 4S 0.00000 -1.96574 -3.40476 0.95369 1.65185
|
|
206 5S 0.00000 0.02932 0.05079 -0.03539 -0.06130
|
|
207 6PX -0.07191 -0.03312 -0.00383 -0.07548 -0.13638
|
|
208 6PY 0.12454 0.03442 -0.03312 -0.04923 -0.07548
|
|
209 6PZ 0.00000 0.04379 0.07585 -0.05426 -0.09397
|
|
210 7PX 0.68806 0.41877 0.30850 0.64604 1.43573
|
|
211 7PY -1.19175 -0.17506 0.41877 0.68975 0.64604
|
|
212 7PZ 0.00000 -0.34435 -0.59642 0.53104 0.91979
|
|
213 8PX -1.21037 -2.55470 -4.61401 1.88453 -1.66394
|
|
214 8PY 2.09642 -1.66409 -2.55470 -3.84000 1.88453
|
|
215 8PZ 0.00000 -0.54723 -0.94783 -0.16912 -0.29292
|
|
216 9PX -0.45662 -1.23239 -1.60490 0.79672 0.06032
|
|
217 9PY 0.79090 -0.18186 -1.23239 -0.85965 0.79672
|
|
218 9PZ 0.00000 -0.18530 -0.32095 0.10505 0.18195
|
|
219 10D 0 0.00000 -0.00707 -0.01224 -0.01572 -0.02722
|
|
220 10D+1 0.02070 -0.01255 0.09870 -0.04187 0.02616
|
|
221 10D-1 -0.03586 0.11319 -0.01255 0.07451 -0.04187
|
|
222 10D+2 0.00596 -0.01204 0.01828 -0.11759 0.09331
|
|
223 10D-2 -0.00344 0.01828 0.00907 0.09331 -0.00984
|
|
224 11D 0 0.00000 0.12358 0.21406 0.03379 0.05853
|
|
225 11D+1 -0.14880 0.02910 -1.06820 0.63364 0.00358
|
|
226 11D-1 0.25773 -1.10179 0.02910 -0.72809 0.63364
|
|
227 11D+2 -0.11949 0.14917 -0.44163 1.57636 -0.82936
|
|
228 11D-2 0.06899 -0.44163 -0.36079 -0.82936 0.61870
|
|
229 12D 0 0.00000 0.41489 0.71860 0.11287 0.19550
|
|
230 12D+1 -0.18628 0.22308 -0.27565 0.05804 -0.67568
|
|
231 12D-1 0.32265 -0.53324 0.22308 -0.74271 0.05804
|
|
232 12D+2 -1.69637 -0.29896 -0.38769 1.38808 -1.23822
|
|
233 12D-2 0.97940 -0.38769 -0.74663 -1.23822 -0.04169
|
|
234 13F 0 0.00000 0.01475 0.02554 -0.01490 -0.02581
|
|
235 13F+1 0.00134 0.00490 0.02484 -0.00734 -0.00767
|
|
236 13F-1 -0.00232 0.01918 0.00490 0.00081 -0.00734
|
|
237 13F+2 0.01319 -0.02864 -0.01471 0.03650 -0.00700
|
|
238 13F-2 -0.00761 -0.01471 -0.04562 -0.00700 0.02842
|
|
239 13F+3 0.04003 0.01809 -0.01044 0.05398 -0.03117
|
|
240 13F-3 0.00000 -0.03328 -0.05765 0.03671 0.06358
|
|
241 14F 0 0.00000 0.07855 0.13606 0.08691 0.15053
|
|
242 14F+1 0.06188 0.22478 -0.05345 0.04643 0.08731
|
|
243 14F-1 -0.10718 -0.31301 0.22478 0.03369 0.04643
|
|
244 14F+2 -0.37156 0.69730 -0.42314 0.63610 -0.45204
|
|
245 14F-2 0.21452 -0.42314 0.20870 -0.45204 0.11413
|
|
246 14F+3 -0.96516 0.09598 -0.05542 0.92198 -0.53230
|
|
247 14F-3 0.00000 0.06548 0.11342 -0.15725 -0.27237
|
|
248 15G 0 0.00000 -0.00928 -0.01607 -0.00651 -0.01128
|
|
249 15G+1 0.01249 0.00951 0.02738 -0.00957 0.00689
|
|
250 15G-1 -0.02163 0.01640 0.00951 0.01795 -0.00957
|
|
251 15G+2 -0.01630 0.03606 -0.01770 0.01091 -0.01502
|
|
252 15G-2 0.00941 -0.01770 0.01562 -0.01502 -0.00643
|
|
253 15G+3 -0.02646 0.03282 -0.01895 0.07109 -0.04104
|
|
254 15G-3 0.00000 -0.00371 -0.00642 0.00984 0.01705
|
|
255 15G+4 -0.01123 -0.00888 0.00457 0.06216 -0.04726
|
|
256 15G-4 -0.00648 -0.00457 0.00361 0.04726 -0.00759
|
|
136 137 138 139 140
|
|
(A1)--V (E)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 8.15764 8.50319 8.50319 8.56901 8.56901
|
|
1 1 N 1S -0.01334 0.00000 0.00000 0.00000 0.00000
|
|
2 2S -0.10457 0.00000 0.00000 0.00000 0.00000
|
|
3 3S -0.78091 0.00000 0.00000 0.00000 0.00000
|
|
4 4S -0.06891 0.00000 0.00000 0.00000 0.00000
|
|
5 5S 18.61948 0.00000 0.00000 0.00000 0.00000
|
|
6 6S 2.28754 0.00000 0.00000 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 -0.11254 0.00000 -0.04777
|
|
8 7PY 0.00000 -0.11254 0.00000 -0.04777 0.00000
|
|
9 7PZ -0.07357 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 2.17262 0.00000 0.18915
|
|
11 8PY 0.00000 2.17262 0.00000 0.18915 0.00000
|
|
12 8PZ -1.59131 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 -19.67212 0.00000 -3.06497
|
|
14 9PY 0.00000 -19.67212 0.00000 -3.06497 0.00000
|
|
15 9PZ 4.88813 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 -12.78093 0.00000 -2.46113
|
|
17 10PY 0.00000 -12.78093 0.00000 -2.46113 0.00000
|
|
18 10PZ 1.19983 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 -1.12263 0.00000 -0.25458
|
|
20 11PY 0.00000 -1.12263 0.00000 -0.25458 0.00000
|
|
21 11PZ 0.10803 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 -0.09213 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 -0.05942 0.00000 0.06008
|
|
24 12D-1 0.00000 -0.05942 0.00000 0.06008 0.00000
|
|
25 12D+2 0.00000 -0.01836 0.00000 -0.08647 0.00000
|
|
26 12D-2 0.00000 0.00000 -0.01836 0.00000 -0.08647
|
|
27 13D 0 1.43049 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.62586 0.00000 -0.99570
|
|
29 13D-1 0.00000 0.62586 0.00000 -0.99570 0.00000
|
|
30 13D+2 0.00000 0.05180 0.00000 1.07995 0.00000
|
|
31 13D-2 0.00000 0.00000 0.05180 0.00000 1.07995
|
|
32 14D 0 -8.40223 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 6.23419 0.00000 7.21660
|
|
34 14D-1 0.00000 6.23419 0.00000 7.21660 0.00000
|
|
35 14D+2 0.00000 11.39524 0.00000 -4.46897 0.00000
|
|
36 14D-2 0.00000 0.00000 11.39524 0.00000 -4.46897
|
|
37 15D 0 -2.48041 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 2.58334 0.00000 2.30007
|
|
39 15D-1 0.00000 2.58334 0.00000 2.30007 0.00000
|
|
40 15D+2 0.00000 3.66531 0.00000 -1.04157 0.00000
|
|
41 15D-2 0.00000 0.00000 3.66531 0.00000 -1.04157
|
|
42 16F 0 0.08184 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 -0.02301 0.00000 0.17997
|
|
44 16F-1 0.00000 -0.02301 0.00000 0.17997 0.00000
|
|
45 16F+2 0.00000 0.22940 0.00000 0.03766 0.00000
|
|
46 16F-2 0.00000 0.00000 0.22940 0.00000 0.03766
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.07615 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 -0.65687 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.23286 0.00000 -2.29823
|
|
51 17F-1 0.00000 0.23286 0.00000 -2.29823 0.00000
|
|
52 17F+2 0.00000 -3.14134 0.00000 -0.62541 0.00000
|
|
53 17F-2 0.00000 0.00000 -3.14134 0.00000 -0.62541
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 -1.22537 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.33734 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.51642 0.00000 -2.48254
|
|
58 18F-1 0.00000 0.51642 0.00000 -2.48254 0.00000
|
|
59 18F+2 0.00000 -2.00527 0.00000 -0.36449 0.00000
|
|
60 18F-2 0.00000 0.00000 -2.00527 0.00000 -0.36449
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 -1.66100 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 -0.05963 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 -0.04550 0.00000 -0.01196
|
|
65 19G-1 0.00000 -0.04550 0.00000 -0.01196 0.00000
|
|
66 19G+2 0.00000 -0.00182 0.00000 -0.05111 0.00000
|
|
67 19G-2 0.00000 0.00000 -0.00182 0.00000 -0.05111
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.10341 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 -0.06234 0.00000 -0.02127 0.00000
|
|
71 19G-4 0.00000 0.00000 0.06234 0.00000 0.02127
|
|
72 20G 0 1.66860 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 -0.49644 0.00000 0.24596
|
|
74 20G-1 0.00000 -0.49644 0.00000 0.24596 0.00000
|
|
75 20G+2 0.00000 0.25607 0.00000 1.42097 0.00000
|
|
76 20G-2 0.00000 0.00000 0.25607 0.00000 1.42097
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 -1.08646 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 -0.07050 0.00000 0.12760 0.00000
|
|
80 20G-4 0.00000 0.00000 0.07050 0.00000 -0.12760
|
|
81 21H 0 -0.10532 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.02945 0.00000 0.05946
|
|
83 21H-1 0.00000 0.02945 0.00000 0.05946 0.00000
|
|
84 21H+2 0.00000 0.08033 0.00000 -0.04695 0.00000
|
|
85 21H-2 0.00000 0.00000 0.08033 0.00000 -0.04695
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.18455 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.03603 0.00000 0.08913 0.00000
|
|
89 21H-4 0.00000 0.00000 -0.03603 0.00000 -0.08913
|
|
90 21H+5 0.00000 0.00000 0.10773 0.00000 -0.09875
|
|
91 21H-5 0.00000 -0.10773 0.00000 0.09875 0.00000
|
|
92 2 H 1S 0.00904 0.22027 0.00000 0.00719 0.00000
|
|
93 2S 1.25868 -1.65696 0.00000 -0.75476 0.00000
|
|
94 3S -6.95817 27.28239 0.00000 4.33620 0.00000
|
|
95 4S -1.47065 8.38890 0.00000 1.31588 0.00000
|
|
96 5S -0.03120 0.37800 0.00000 0.03070 0.00000
|
|
97 6PX 0.00000 0.00000 -0.01338 0.00000 0.03568
|
|
98 6PY 0.06266 0.17583 0.00000 -0.02661 0.00000
|
|
99 6PZ -0.04009 -0.06706 0.00000 -0.00292 0.00000
|
|
100 7PX 0.00000 0.00000 0.16391 0.00000 -0.40024
|
|
101 7PY -0.78303 -0.73502 0.00000 0.45189 0.00000
|
|
102 7PZ 0.66068 0.26065 0.00000 0.22287 0.00000
|
|
103 8PX 0.00000 0.00000 -2.15765 0.00000 2.61028
|
|
104 8PY 2.20225 -14.12641 0.00000 -4.70264 0.00000
|
|
105 8PZ -5.48075 6.11858 0.00000 -4.30212 0.00000
|
|
106 9PX 0.00000 0.00000 -0.34087 0.00000 0.74139
|
|
107 9PY 0.72530 -5.63025 0.00000 -1.27681 0.00000
|
|
108 9PZ -1.51805 2.44147 0.00000 -0.84700 0.00000
|
|
109 10D 0 0.09289 0.09279 0.00000 0.17051 0.00000
|
|
110 10D+1 0.00000 0.00000 0.03941 0.00000 -0.01593
|
|
111 10D-1 -0.14975 0.16503 0.00000 -0.14912 0.00000
|
|
112 10D+2 0.02065 0.22796 0.00000 0.13651 0.00000
|
|
113 10D-2 0.00000 0.00000 -0.12128 0.00000 0.07254
|
|
114 11D 0 -1.10455 -1.13222 0.00000 -1.81361 0.00000
|
|
115 11D+1 0.00000 0.00000 -0.35102 0.00000 0.31251
|
|
116 11D-1 1.68213 -2.35977 0.00000 1.52280 0.00000
|
|
117 11D+2 -0.38863 -2.91333 0.00000 -1.43363 0.00000
|
|
118 11D-2 0.00000 0.00000 1.19067 0.00000 -0.97324
|
|
119 12D 0 -0.87251 -1.05718 0.00000 -1.85460 0.00000
|
|
120 12D+1 0.00000 0.00000 -0.30178 0.00000 0.35155
|
|
121 12D-1 2.11291 -2.42813 0.00000 1.42533 0.00000
|
|
122 12D+2 -0.11707 -2.76074 0.00000 -1.43922 0.00000
|
|
123 12D-2 0.00000 0.00000 0.94264 0.00000 -1.21619
|
|
124 13F 0 0.01105 -0.04919 0.00000 -0.00688 0.00000
|
|
125 13F+1 0.00000 0.00000 -0.02333 0.00000 0.01824
|
|
126 13F-1 0.03243 -0.00166 0.00000 0.01101 0.00000
|
|
127 13F+2 0.03637 -0.09408 0.00000 -0.00133 0.00000
|
|
128 13F-2 0.00000 0.00000 0.01024 0.00000 -0.06855
|
|
129 13F+3 0.00000 0.00000 -0.03806 0.00000 -0.00060
|
|
130 13F-3 0.02137 0.05045 0.00000 -0.00302 0.00000
|
|
131 14F 0 0.31708 -0.58209 0.00000 0.11106 0.00000
|
|
132 14F+1 0.00000 0.00000 0.14759 0.00000 -0.04054
|
|
133 14F-1 1.06683 0.29537 0.00000 1.50767 0.00000
|
|
134 14F+2 0.62865 -0.80709 0.00000 0.53482 0.00000
|
|
135 14F-2 0.00000 0.00000 0.32426 0.00000 -0.30543
|
|
136 14F+3 0.00000 0.00000 0.82370 0.00000 -0.64311
|
|
137 14F-3 0.42373 0.80669 0.00000 0.74106 0.00000
|
|
138 15G 0 0.05588 -0.00476 0.00000 0.07028 0.00000
|
|
139 15G+1 0.00000 0.00000 0.01180 0.00000 -0.00688
|
|
140 15G-1 0.00223 0.05934 0.00000 0.02945 0.00000
|
|
141 15G+2 0.07100 -0.01167 0.00000 0.10367 0.00000
|
|
142 15G-2 0.00000 0.00000 0.01686 0.00000 0.00153
|
|
143 15G+3 0.00000 0.00000 0.04174 0.00000 -0.08862
|
|
144 15G-3 -0.03957 0.06416 0.00000 -0.01290 0.00000
|
|
145 15G+4 0.04511 0.05374 0.00000 0.03552 0.00000
|
|
146 15G-4 0.00000 0.00000 -0.03162 0.00000 0.01615
|
|
147 3 H 1S 0.00904 -0.11014 0.19076 -0.00359 0.00623
|
|
148 2S 1.25868 0.82848 -1.43497 0.37738 -0.65364
|
|
149 3S -6.95817 -13.64119 23.62724 -2.16810 3.75526
|
|
150 4S -1.47065 -4.19445 7.26500 -0.65794 1.13959
|
|
151 5S -0.03120 -0.18900 0.32736 -0.01535 0.02658
|
|
152 6PX 0.05427 -0.08193 0.12853 0.02697 -0.01104
|
|
153 6PY -0.03133 0.03392 -0.08193 0.02011 0.02697
|
|
154 6PZ -0.04009 0.03353 -0.05808 0.00146 -0.00253
|
|
155 7PX -0.67812 0.38925 -0.51029 -0.36898 0.23885
|
|
156 7PY 0.39151 -0.06082 0.38925 -0.18721 -0.36898
|
|
157 7PZ 0.66068 -0.13032 0.22573 -0.11143 0.19301
|
|
158 8PX 1.90720 5.18262 -11.13422 3.16659 -2.87441
|
|
159 8PY -1.10112 -5.14984 5.18262 0.78205 3.16659
|
|
160 8PZ -5.48075 -3.05929 5.29884 2.15106 -3.72574
|
|
161 9PX 0.62813 2.29037 -4.30790 0.87390 -0.77226
|
|
162 9PY -0.36265 -1.66322 2.29037 0.23684 0.87390
|
|
163 9PZ -1.51805 -1.22073 2.11437 0.42350 -0.73353
|
|
164 10D 0 0.09289 -0.04640 0.08036 -0.08526 0.14767
|
|
165 10D+1 -0.12969 -0.05439 0.13363 0.05767 -0.11582
|
|
166 10D-1 0.07488 0.07082 -0.05439 -0.04923 0.05767
|
|
167 10D+2 -0.01032 -0.03397 -0.15123 0.08853 -0.02770
|
|
168 10D-2 0.01788 -0.15123 0.14065 -0.02770 0.12052
|
|
169 11D 0 -1.10455 0.56611 -0.98053 0.90681 -1.57063
|
|
170 11D+1 1.45677 0.86981 -1.85758 -0.52407 1.22023
|
|
171 11D-1 -0.84107 -0.85321 0.86981 0.61508 -0.52407
|
|
172 11D+2 0.19432 0.16467 1.77708 -1.08834 0.19935
|
|
173 11D-2 -0.33657 1.77708 -1.88733 0.19935 -1.31853
|
|
174 12D 0 -0.87251 0.52859 -0.91554 0.92730 -1.60613
|
|
175 12D+1 1.82984 0.92074 -1.89654 -0.46496 1.15688
|
|
176 12D-1 -1.05646 -0.83337 0.92074 0.62000 -0.46496
|
|
177 12D+2 0.05853 0.01679 1.60361 -1.27195 0.09658
|
|
178 12D-2 -0.10138 1.60361 -1.83490 0.09658 -1.38346
|
|
179 13F 0 0.01105 0.02460 -0.04260 0.00344 -0.00596
|
|
180 13F+1 0.02808 -0.00939 -0.00708 0.00313 0.01282
|
|
181 13F-1 -0.01621 -0.01792 -0.00939 0.01643 0.00313
|
|
182 13F+2 -0.01819 -0.01584 0.04517 -0.05174 -0.02911
|
|
183 13F-2 0.03150 0.04517 -0.06800 -0.02911 -0.01813
|
|
184 13F+3 0.00000 0.03297 0.01903 0.00052 0.00030
|
|
185 13F-3 0.02137 -0.02522 0.04369 0.00151 -0.00262
|
|
186 14F 0 0.31708 0.29105 -0.50411 -0.05553 0.09618
|
|
187 14F+1 0.92390 -0.06399 0.25842 -0.67040 1.12062
|
|
188 14F-1 -0.53341 0.18453 -0.06399 0.34651 -0.67040
|
|
189 14F+2 -0.31432 0.04142 0.48989 -0.09537 -0.36384
|
|
190 14F-2 0.54442 0.48989 -0.52425 -0.36384 0.32476
|
|
191 14F+3 0.00000 -0.71335 -0.41185 0.55695 0.32155
|
|
192 14F-3 0.42373 -0.40334 0.69861 -0.37053 0.64178
|
|
193 15G 0 0.05588 0.00238 -0.00412 -0.03514 0.06087
|
|
194 15G+1 0.00193 -0.02058 0.04745 -0.01573 0.02037
|
|
195 15G-1 -0.00111 0.02369 -0.02058 0.00220 -0.01573
|
|
196 15G+2 -0.03550 0.00973 0.01235 0.02706 -0.04423
|
|
197 15G-2 0.06149 0.01235 -0.00454 -0.04423 0.07813
|
|
198 15G+3 0.00000 -0.03615 -0.02087 0.07675 0.04431
|
|
199 15G-3 -0.03957 -0.03208 0.05557 0.00645 -0.01117
|
|
200 15G+4 -0.02255 0.03715 -0.00958 -0.00323 -0.02237
|
|
201 15G-4 -0.03906 0.00958 -0.04821 0.02237 -0.02260
|
|
202 4 H 1S 0.00904 -0.11014 -0.19076 -0.00359 -0.00623
|
|
203 2S 1.25868 0.82848 1.43497 0.37738 0.65364
|
|
204 3S -6.95817 -13.64119 -23.62724 -2.16810 -3.75526
|
|
205 4S -1.47065 -4.19445 -7.26500 -0.65794 -1.13959
|
|
206 5S -0.03120 -0.18900 -0.32736 -0.01535 -0.02658
|
|
207 6PX -0.05427 0.08193 0.12853 -0.02697 -0.01104
|
|
208 6PY -0.03133 0.03392 0.08193 0.02011 -0.02697
|
|
209 6PZ -0.04009 0.03353 0.05808 0.00146 0.00253
|
|
210 7PX 0.67812 -0.38925 -0.51029 0.36898 0.23885
|
|
211 7PY 0.39151 -0.06082 -0.38925 -0.18721 0.36898
|
|
212 7PZ 0.66068 -0.13032 -0.22573 -0.11143 -0.19301
|
|
213 8PX -1.90720 -5.18262 -11.13422 -3.16659 -2.87441
|
|
214 8PY -1.10112 -5.14984 -5.18262 0.78205 -3.16659
|
|
215 8PZ -5.48075 -3.05929 -5.29884 2.15106 3.72574
|
|
216 9PX -0.62813 -2.29037 -4.30790 -0.87390 -0.77226
|
|
217 9PY -0.36265 -1.66322 -2.29037 0.23684 -0.87390
|
|
218 9PZ -1.51805 -1.22073 -2.11437 0.42350 0.73353
|
|
219 10D 0 0.09289 -0.04640 -0.08036 -0.08526 -0.14767
|
|
220 10D+1 0.12969 0.05439 0.13363 -0.05767 -0.11582
|
|
221 10D-1 0.07488 0.07082 0.05439 -0.04923 -0.05767
|
|
222 10D+2 -0.01032 -0.03397 0.15123 0.08853 0.02770
|
|
223 10D-2 -0.01788 0.15123 0.14065 0.02770 0.12052
|
|
224 11D 0 -1.10455 0.56611 0.98053 0.90681 1.57063
|
|
225 11D+1 -1.45677 -0.86981 -1.85758 0.52407 1.22023
|
|
226 11D-1 -0.84107 -0.85321 -0.86981 0.61508 0.52407
|
|
227 11D+2 0.19432 0.16467 -1.77708 -1.08834 -0.19935
|
|
228 11D-2 0.33657 -1.77708 -1.88733 -0.19935 -1.31853
|
|
229 12D 0 -0.87251 0.52859 0.91554 0.92730 1.60613
|
|
230 12D+1 -1.82984 -0.92074 -1.89654 0.46496 1.15688
|
|
231 12D-1 -1.05646 -0.83337 -0.92074 0.62000 0.46496
|
|
232 12D+2 0.05853 0.01679 -1.60361 -1.27195 -0.09658
|
|
233 12D-2 0.10138 -1.60361 -1.83490 -0.09658 -1.38346
|
|
234 13F 0 0.01105 0.02460 0.04260 0.00344 0.00596
|
|
235 13F+1 -0.02808 0.00939 -0.00708 -0.00313 0.01282
|
|
236 13F-1 -0.01621 -0.01792 0.00939 0.01643 -0.00313
|
|
237 13F+2 -0.01819 -0.01584 -0.04517 -0.05174 0.02911
|
|
238 13F-2 -0.03150 -0.04517 -0.06800 0.02911 -0.01813
|
|
239 13F+3 0.00000 -0.03297 0.01903 -0.00052 0.00030
|
|
240 13F-3 0.02137 -0.02522 -0.04369 0.00151 0.00262
|
|
241 14F 0 0.31708 0.29105 0.50411 -0.05553 -0.09618
|
|
242 14F+1 -0.92390 0.06399 0.25842 0.67040 1.12062
|
|
243 14F-1 -0.53341 0.18453 0.06399 0.34651 0.67040
|
|
244 14F+2 -0.31432 0.04142 -0.48989 -0.09537 0.36384
|
|
245 14F-2 -0.54442 -0.48989 -0.52425 0.36384 0.32476
|
|
246 14F+3 0.00000 0.71335 -0.41185 -0.55695 0.32155
|
|
247 14F-3 0.42373 -0.40334 -0.69861 -0.37053 -0.64178
|
|
248 15G 0 0.05588 0.00238 0.00412 -0.03514 -0.06087
|
|
249 15G+1 -0.00193 0.02058 0.04745 0.01573 0.02037
|
|
250 15G-1 -0.00111 0.02369 0.02058 0.00220 0.01573
|
|
251 15G+2 -0.03550 0.00973 -0.01235 0.02706 0.04423
|
|
252 15G-2 -0.06149 -0.01235 -0.00454 0.04423 0.07813
|
|
253 15G+3 0.00000 0.03615 -0.02087 -0.07675 0.04431
|
|
254 15G-3 -0.03957 -0.03208 -0.05557 0.00645 0.01117
|
|
255 15G+4 -0.02255 0.03715 0.00958 -0.00323 0.02237
|
|
256 15G-4 0.03906 -0.00958 -0.04821 -0.02237 -0.02260
|
|
141 142 143 144 145
|
|
(A2)--V (A1)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 8.69211 8.94717 9.05314 9.05314 10.98775
|
|
1 1 N 1S 0.00000 -0.03814 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.09053 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 -0.69441 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 5.86300 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 3.50360 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 2.72353 0.00000 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 0.00000 0.14421 0.06627
|
|
8 7PY 0.00000 0.00000 0.14421 0.00000 0.00000
|
|
9 7PZ 0.00000 -0.02406 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 0.00000 -0.80698 -0.05955
|
|
11 8PY 0.00000 0.00000 -0.80698 0.00000 0.00000
|
|
12 8PZ 0.00000 -0.05494 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 0.00000 14.34601 0.01709
|
|
14 9PY 0.00000 0.00000 14.34601 0.00000 0.00000
|
|
15 9PZ 0.00000 -3.66322 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 0.00000 1.39242 0.97032
|
|
17 10PY 0.00000 0.00000 1.39242 0.00000 0.00000
|
|
18 10PZ 0.00000 -1.49054 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 0.00000 0.27538 0.10666
|
|
20 11PY 0.00000 0.00000 0.27538 0.00000 0.00000
|
|
21 11PZ 0.00000 -0.37263 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.06901 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 0.08596 0.01006
|
|
24 12D-1 0.00000 0.00000 0.08596 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.12310 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.12310 0.01245
|
|
27 13D 0 0.00000 -0.79396 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 -1.05346 0.08795
|
|
29 13D-1 0.00000 0.00000 -1.05346 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 -1.66180 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 -1.66180 0.00484
|
|
32 14D 0 0.00000 2.89509 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 -1.83055 -0.64564
|
|
34 14D-1 0.00000 0.00000 -1.83055 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 0.33799 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 0.33799 -0.11109
|
|
37 15D 0 0.00000 0.44948 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 0.55339 -0.70955
|
|
39 15D-1 0.00000 0.00000 0.55339 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 1.36277 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 1.36277 -0.01107
|
|
42 16F 0 0.00000 0.06324 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.03755 0.05958
|
|
44 16F-1 0.00000 0.00000 0.03755 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.05775 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.05775 0.00334
|
|
47 16F+3 -0.19162 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 -0.11591 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 -0.55031 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 -0.74177 0.16779
|
|
51 17F-1 0.00000 0.00000 -0.74177 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 -0.53948 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 -0.53948 0.16023
|
|
54 17F+3 3.04242 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 1.55415 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 -0.08625 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 -0.59719 0.71456
|
|
58 18F-1 0.00000 0.00000 -0.59719 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 -1.84783 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 -1.84783 -0.11436
|
|
61 18F+3 3.42460 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 1.77362 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00235 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.06301 -0.08335
|
|
65 19G-1 0.00000 0.00000 0.06301 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 -0.00878 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 -0.00878 -0.05107
|
|
68 19G+3 0.06391 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.09539 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.03502 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 -0.03502 -0.03429
|
|
72 20G 0 0.00000 -0.43675 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 -0.08345 -0.29164
|
|
74 20G-1 0.00000 0.00000 -0.08345 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.75633 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.75633 -0.06943
|
|
77 20G+3 -2.15262 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 -1.14466 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.43036 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 -0.43036 0.06889
|
|
81 21H 0 0.00000 -0.03041 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 -0.03640 -0.24690
|
|
83 21H-1 0.00000 0.00000 -0.03640 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 -0.01361 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 -0.01361 0.58423
|
|
86 21H+3 0.02980 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 -0.06865 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 -0.03700 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.03700 0.02911
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00448 -0.41945
|
|
91 21H-5 0.00000 0.00000 -0.00448 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.11794 -0.01268 0.00000 0.00000
|
|
93 2S 0.00000 2.12571 2.95784 0.00000 0.00000
|
|
94 3S 0.00000 -1.69858 -9.56191 0.00000 0.00000
|
|
95 4S 0.00000 -2.22665 -2.25704 0.00000 0.00000
|
|
96 5S 0.00000 0.10722 -0.17964 0.00000 0.00000
|
|
97 6PX -0.03206 0.00000 0.00000 -0.01626 -0.00378
|
|
98 6PY 0.00000 0.19855 0.15296 0.00000 0.00000
|
|
99 6PZ 0.00000 -0.07183 -0.05110 0.00000 0.00000
|
|
100 7PX 0.11531 0.00000 0.00000 0.17147 0.13416
|
|
101 7PY 0.00000 -1.72917 -1.67958 0.00000 0.00000
|
|
102 7PZ 0.00000 0.63971 0.64221 0.00000 0.00000
|
|
103 8PX 3.72833 0.00000 0.00000 -2.71777 -0.18558
|
|
104 8PY 0.00000 2.91271 7.63261 0.00000 0.00000
|
|
105 8PZ 0.00000 0.35142 -4.91460 0.00000 0.00000
|
|
106 9PX 0.72667 0.00000 0.00000 -0.50265 -0.18768
|
|
107 9PY 0.00000 1.19718 2.28557 0.00000 0.00000
|
|
108 9PZ 0.00000 -0.17442 -1.21432 0.00000 0.00000
|
|
109 10D 0 0.00000 -0.06905 0.00100 0.00000 0.00000
|
|
110 10D+1 -0.09007 0.00000 0.00000 0.01414 -0.02182
|
|
111 10D-1 0.00000 0.02270 -0.20489 0.00000 0.00000
|
|
112 10D+2 0.00000 -0.04630 -0.12514 0.00000 0.00000
|
|
113 10D-2 0.20598 0.00000 0.00000 -0.10943 0.03853
|
|
114 11D 0 0.00000 0.60390 0.05215 0.00000 0.00000
|
|
115 11D+1 0.73627 0.00000 0.00000 -0.18736 0.10944
|
|
116 11D-1 0.00000 -0.33234 1.85038 0.00000 0.00000
|
|
117 11D+2 0.00000 0.31650 1.24379 0.00000 0.00000
|
|
118 11D-2 -1.82038 0.00000 0.00000 1.24127 -0.08080
|
|
119 12D 0 0.00000 0.89823 0.55316 0.00000 0.00000
|
|
120 12D+1 0.78847 0.00000 0.00000 -0.55811 0.16827
|
|
121 12D-1 0.00000 0.39331 2.54069 0.00000 0.00000
|
|
122 12D+2 0.00000 1.05367 2.16443 0.00000 0.00000
|
|
123 12D-2 -1.35903 0.00000 0.00000 1.06607 0.22445
|
|
124 13F 0 0.00000 -0.03599 -0.03817 0.00000 0.00000
|
|
125 13F+1 -0.01095 0.00000 0.00000 -0.02534 -0.12128
|
|
126 13F-1 0.00000 0.03778 0.00746 0.00000 0.00000
|
|
127 13F+2 0.00000 -0.05567 -0.08787 0.00000 0.00000
|
|
128 13F-2 0.04695 0.00000 0.00000 0.04283 -0.05126
|
|
129 13F+3 -0.00045 0.00000 0.00000 -0.02592 0.04747
|
|
130 13F-3 0.00000 0.02459 0.03320 0.00000 0.00000
|
|
131 14F 0 0.00000 0.24571 0.64434 0.00000 0.00000
|
|
132 14F+1 -0.02469 0.00000 0.00000 0.15493 0.18714
|
|
133 14F-1 0.00000 -0.53904 0.15271 0.00000 0.00000
|
|
134 14F+2 0.00000 0.13939 1.16134 0.00000 0.00000
|
|
135 14F-2 -0.66687 0.00000 0.00000 0.33602 -0.07249
|
|
136 14F+3 -0.86967 0.00000 0.00000 0.68616 0.01434
|
|
137 14F-3 0.00000 -0.29912 -0.68536 0.00000 0.00000
|
|
138 15G 0 0.00000 -0.01199 0.04555 0.00000 0.00000
|
|
139 15G+1 -0.01266 0.00000 0.00000 0.00424 -0.14341
|
|
140 15G-1 0.00000 0.01515 -0.03015 0.00000 0.00000
|
|
141 15G+2 0.00000 -0.04057 0.02313 0.00000 0.00000
|
|
142 15G-2 0.03059 0.00000 0.00000 0.01274 0.11996
|
|
143 15G+3 -0.03741 0.00000 0.00000 0.05059 -0.09731
|
|
144 15G-3 0.00000 -0.00796 -0.01607 0.00000 0.00000
|
|
145 15G+4 0.00000 -0.00653 -0.04545 0.00000 0.00000
|
|
146 15G-4 0.07384 0.00000 0.00000 -0.04756 -0.10594
|
|
147 3 H 1S 0.00000 0.11794 0.00634 -0.01098 0.01184
|
|
148 2S 0.00000 2.12571 -1.47892 2.56156 0.16759
|
|
149 3S 0.00000 -1.69858 4.78095 -8.28086 -0.86990
|
|
150 4S 0.00000 -2.22665 1.12852 -1.95465 -0.28720
|
|
151 5S 0.00000 0.10722 0.08982 -0.15557 0.00377
|
|
152 6PX 0.01603 0.17195 -0.07327 0.11066 -0.00064
|
|
153 6PY 0.02777 -0.09927 0.02605 -0.07327 -0.00181
|
|
154 6PZ 0.00000 -0.07183 0.02555 -0.04425 -0.01618
|
|
155 7PX -0.05765 -1.49750 0.80153 -1.21682 0.02347
|
|
156 7PY -0.09986 0.86458 -0.29129 0.80153 0.06391
|
|
157 7PZ 0.00000 0.63971 -0.32111 0.55617 0.08159
|
|
158 8PX -1.86417 2.52248 -4.48185 5.04501 0.39894
|
|
159 8PY -3.22883 -1.45636 -0.13018 -4.48185 -0.33747
|
|
160 8PZ 0.00000 0.35142 2.45730 -4.25617 0.39300
|
|
161 9PX -0.36333 1.03679 -1.20733 1.58852 0.06197
|
|
162 9PY -0.62931 -0.59859 0.19441 -1.20733 -0.14414
|
|
163 9PZ 0.00000 -0.17442 0.60716 -1.05163 0.11333
|
|
164 10D 0 0.00000 -0.06905 -0.00050 0.00086 0.00070
|
|
165 10D+1 0.04504 0.01966 0.09484 -0.15013 0.08284
|
|
166 10D-1 0.07800 -0.01135 -0.04062 0.09484 -0.06042
|
|
167 10D+2 -0.17839 0.02315 -0.11335 0.00680 0.04785
|
|
168 10D-2 -0.10299 -0.04009 0.00680 -0.12121 -0.04434
|
|
169 11D 0 0.00000 0.60390 -0.02607 0.04516 0.05108
|
|
170 11D+1 -0.36814 -0.28781 -0.88237 1.34094 -0.23264
|
|
171 11D-1 -0.63763 0.16617 0.32207 -0.88237 0.19750
|
|
172 11D+2 1.57650 -0.15825 1.24190 -0.00109 -0.17284
|
|
173 11D-2 0.91019 0.27410 -0.00109 1.24316 0.21857
|
|
174 12D 0 0.00000 0.89823 -0.27658 0.47905 0.01878
|
|
175 12D+1 -0.39424 0.34062 -1.34182 1.76599 -0.09585
|
|
176 12D-1 -0.68284 -0.19665 0.21659 -1.34182 0.15249
|
|
177 12D+2 1.17695 -0.52683 1.34066 -0.47560 0.04184
|
|
178 12D-2 0.67951 0.91250 -0.47560 1.88984 0.15199
|
|
179 13F 0 0.00000 -0.03599 0.01909 -0.03306 0.19936
|
|
180 13F+1 0.00547 0.03272 -0.01420 -0.00074 -0.05489
|
|
181 13F-1 0.00948 -0.01889 -0.01714 -0.01420 -0.03833
|
|
182 13F+2 -0.04066 0.02784 0.01016 0.05659 -0.03564
|
|
183 13F-2 -0.02347 -0.04821 0.05659 -0.05519 0.01047
|
|
184 13F+3 -0.00045 0.00000 0.02245 0.01296 -0.02374
|
|
185 13F-3 0.00000 0.02459 -0.01660 0.02876 0.12623
|
|
186 14F 0 0.00000 0.24571 -0.32217 0.55802 -0.27654
|
|
187 14F+1 0.01234 -0.46682 0.00097 0.15326 0.04635
|
|
188 14F-1 0.02138 0.26952 0.15438 0.00097 0.08128
|
|
189 14F+2 0.57752 -0.06970 0.54235 -0.35738 0.00722
|
|
190 14F-2 0.33343 0.12072 -0.35738 0.95501 -0.08499
|
|
191 14F+3 -0.86967 0.00000 -0.59423 -0.34308 -0.00717
|
|
192 14F-3 0.00000 -0.29912 0.34268 -0.59354 -0.21142
|
|
193 15G 0 0.00000 -0.01199 -0.02277 0.03945 0.05934
|
|
194 15G+1 0.00633 0.01312 0.01489 -0.02156 -0.10275
|
|
195 15G-1 0.01097 -0.00757 -0.00436 0.01489 -0.02348
|
|
196 15G+2 -0.02649 0.02029 0.01534 -0.00450 0.08581
|
|
197 15G-2 -0.01530 -0.03514 -0.00450 0.02054 -0.02867
|
|
198 15G+3 -0.03741 0.00000 -0.04381 -0.02529 0.04866
|
|
199 15G-3 0.00000 -0.00796 0.00803 -0.01392 0.04107
|
|
200 15G+4 0.06395 0.00326 0.02431 0.04027 0.04374
|
|
201 15G-4 -0.03692 0.00565 -0.04027 0.02220 -0.03018
|
|
202 4 H 1S 0.00000 0.11794 0.00634 0.01098 -0.01184
|
|
203 2S 0.00000 2.12571 -1.47892 -2.56156 -0.16759
|
|
204 3S 0.00000 -1.69858 4.78095 8.28086 0.86990
|
|
205 4S 0.00000 -2.22665 1.12852 1.95465 0.28720
|
|
206 5S 0.00000 0.10722 0.08982 0.15557 -0.00377
|
|
207 6PX 0.01603 -0.17195 0.07327 0.11066 -0.00064
|
|
208 6PY -0.02777 -0.09927 0.02605 0.07327 0.00181
|
|
209 6PZ 0.00000 -0.07183 0.02555 0.04425 0.01618
|
|
210 7PX -0.05765 1.49750 -0.80153 -1.21682 0.02347
|
|
211 7PY 0.09986 0.86458 -0.29129 -0.80153 -0.06391
|
|
212 7PZ 0.00000 0.63971 -0.32111 -0.55617 -0.08159
|
|
213 8PX -1.86417 -2.52248 4.48185 5.04501 0.39894
|
|
214 8PY 3.22883 -1.45636 -0.13018 4.48185 0.33747
|
|
215 8PZ 0.00000 0.35142 2.45730 4.25617 -0.39300
|
|
216 9PX -0.36333 -1.03679 1.20733 1.58852 0.06197
|
|
217 9PY 0.62931 -0.59859 0.19441 1.20733 0.14414
|
|
218 9PZ 0.00000 -0.17442 0.60716 1.05163 -0.11333
|
|
219 10D 0 0.00000 -0.06905 -0.00050 -0.00086 -0.00070
|
|
220 10D+1 0.04504 -0.01966 -0.09484 -0.15013 0.08284
|
|
221 10D-1 -0.07800 -0.01135 -0.04062 -0.09484 0.06042
|
|
222 10D+2 0.17839 0.02315 -0.11335 -0.00680 -0.04785
|
|
223 10D-2 -0.10299 0.04009 -0.00680 -0.12121 -0.04434
|
|
224 11D 0 0.00000 0.60390 -0.02607 -0.04516 -0.05108
|
|
225 11D+1 -0.36814 0.28781 0.88237 1.34094 -0.23264
|
|
226 11D-1 0.63763 0.16617 0.32207 0.88237 -0.19750
|
|
227 11D+2 -1.57650 -0.15825 1.24190 0.00109 0.17284
|
|
228 11D-2 0.91019 -0.27410 0.00109 1.24316 0.21857
|
|
229 12D 0 0.00000 0.89823 -0.27658 -0.47905 -0.01878
|
|
230 12D+1 -0.39424 -0.34062 1.34182 1.76599 -0.09585
|
|
231 12D-1 0.68284 -0.19665 0.21659 1.34182 -0.15249
|
|
232 12D+2 -1.17695 -0.52683 1.34066 0.47560 -0.04184
|
|
233 12D-2 0.67951 -0.91250 0.47560 1.88984 0.15199
|
|
234 13F 0 0.00000 -0.03599 0.01909 0.03306 -0.19936
|
|
235 13F+1 0.00547 -0.03272 0.01420 -0.00074 -0.05489
|
|
236 13F-1 -0.00948 -0.01889 -0.01714 0.01420 0.03833
|
|
237 13F+2 0.04066 0.02784 0.01016 -0.05659 0.03564
|
|
238 13F-2 -0.02347 0.04821 -0.05659 -0.05519 0.01047
|
|
239 13F+3 -0.00045 0.00000 -0.02245 0.01296 -0.02374
|
|
240 13F-3 0.00000 0.02459 -0.01660 -0.02876 -0.12623
|
|
241 14F 0 0.00000 0.24571 -0.32217 -0.55802 0.27654
|
|
242 14F+1 0.01234 0.46682 -0.00097 0.15326 0.04635
|
|
243 14F-1 -0.02138 0.26952 0.15438 -0.00097 -0.08128
|
|
244 14F+2 -0.57752 -0.06970 0.54235 0.35738 -0.00722
|
|
245 14F-2 0.33343 -0.12072 0.35738 0.95501 -0.08499
|
|
246 14F+3 -0.86967 0.00000 0.59423 -0.34308 -0.00717
|
|
247 14F-3 0.00000 -0.29912 0.34268 0.59354 0.21142
|
|
248 15G 0 0.00000 -0.01199 -0.02277 -0.03945 -0.05934
|
|
249 15G+1 0.00633 -0.01312 -0.01489 -0.02156 -0.10275
|
|
250 15G-1 -0.01097 -0.00757 -0.00436 -0.01489 0.02348
|
|
251 15G+2 0.02649 0.02029 0.01534 0.00450 -0.08581
|
|
252 15G-2 -0.01530 0.03514 0.00450 0.02054 -0.02867
|
|
253 15G+3 -0.03741 0.00000 0.04381 -0.02529 0.04866
|
|
254 15G-3 0.00000 -0.00796 0.00803 0.01392 -0.04107
|
|
255 15G+4 -0.06395 0.00326 0.02431 -0.04027 -0.04374
|
|
256 15G-4 -0.03692 -0.00565 0.04027 0.02220 -0.03018
|
|
146 147 148 149 150
|
|
(E)--V (E)--V (E)--V (A1)--V (A2)--V
|
|
Eigenvalues -- 10.98775 11.11638 11.11638 11.11682 11.45050
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.04425 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 -1.70138 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 -8.08571 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 12.90898 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 32.76657 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 9.65270 0.00000
|
|
7 7PX 0.00000 0.14918 0.00000 0.00000 0.00000
|
|
8 7PY -0.06627 0.00000 0.14918 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 -0.26100 0.00000
|
|
10 8PX 0.00000 -0.08155 0.00000 0.00000 0.00000
|
|
11 8PY 0.05955 0.00000 -0.08155 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.91809 0.00000
|
|
13 9PX 0.00000 -1.19738 0.00000 0.00000 0.00000
|
|
14 9PY -0.01709 0.00000 -1.19738 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 -9.99740 0.00000
|
|
16 10PX 0.00000 1.20260 0.00000 0.00000 0.00000
|
|
17 10PY -0.97032 0.00000 1.20260 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 -5.68695 0.00000
|
|
19 11PX 0.00000 0.11726 0.00000 0.00000 0.00000
|
|
20 11PY -0.10666 0.00000 0.11726 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 -0.80327 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.03471 0.00000
|
|
23 12D+1 0.00000 0.02664 0.00000 0.00000 0.00000
|
|
24 12D-1 -0.01006 0.00000 0.02664 0.00000 0.00000
|
|
25 12D+2 -0.01245 0.00000 0.00864 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00864 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 -0.42859 0.00000
|
|
28 13D+1 0.00000 0.19151 0.00000 0.00000 0.00000
|
|
29 13D-1 -0.08795 0.00000 0.19151 0.00000 0.00000
|
|
30 13D+2 -0.00484 0.00000 0.13083 0.00000 0.00000
|
|
31 13D-2 0.00000 0.13083 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 -1.98790 0.00000
|
|
33 14D+1 0.00000 -0.69570 0.00000 0.00000 0.00000
|
|
34 14D-1 0.64564 0.00000 -0.69570 0.00000 0.00000
|
|
35 14D+2 0.11109 0.00000 -0.48067 0.00000 0.00000
|
|
36 14D-2 0.00000 -0.48067 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 -0.50745 0.00000
|
|
38 15D+1 0.00000 -0.76459 0.00000 0.00000 0.00000
|
|
39 15D-1 0.70955 0.00000 -0.76459 0.00000 0.00000
|
|
40 15D+2 0.01107 0.00000 -0.44767 0.00000 0.00000
|
|
41 15D-2 0.00000 -0.44767 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 -0.01789 0.00000
|
|
43 16F+1 0.00000 0.04775 0.00000 0.00000 0.00000
|
|
44 16F-1 -0.05958 0.00000 0.04775 0.00000 0.00000
|
|
45 16F+2 -0.00334 0.00000 0.06490 0.00000 0.00000
|
|
46 16F-2 0.00000 0.06490 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 -0.06770
|
|
48 16F-3 0.00000 0.00000 0.00000 0.03460 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.93300 0.00000
|
|
50 17F+1 0.00000 0.25821 0.00000 0.00000 0.00000
|
|
51 17F-1 -0.16779 0.00000 0.25821 0.00000 0.00000
|
|
52 17F+2 -0.16023 0.00000 0.29094 0.00000 0.00000
|
|
53 17F-2 0.00000 0.29094 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 -0.02591
|
|
55 17F-3 0.00000 0.00000 0.00000 -1.19847 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.66185 0.00000
|
|
57 18F+1 0.00000 0.52253 0.00000 0.00000 0.00000
|
|
58 18F-1 -0.71456 0.00000 0.52253 0.00000 0.00000
|
|
59 18F+2 0.11436 0.00000 0.55909 0.00000 0.00000
|
|
60 18F-2 0.00000 0.55909 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 1.20349
|
|
62 18F-3 0.00000 0.00000 0.00000 -0.31311 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 -0.00289 0.00000
|
|
64 19G+1 0.00000 0.07532 0.00000 0.00000 0.00000
|
|
65 19G-1 0.08335 0.00000 0.07532 0.00000 0.00000
|
|
66 19G+2 0.05107 0.00000 -0.02086 0.00000 0.00000
|
|
67 19G-2 0.00000 -0.02086 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.17026
|
|
69 19G-3 0.00000 0.00000 0.00000 0.06337 0.00000
|
|
70 19G+4 -0.03429 0.00000 -0.13040 0.00000 0.00000
|
|
71 19G-4 0.00000 0.13040 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 -0.13406 0.00000
|
|
73 20G+1 0.00000 -0.03391 0.00000 0.00000 0.00000
|
|
74 20G-1 0.29164 0.00000 -0.03391 0.00000 0.00000
|
|
75 20G+2 0.06943 0.00000 -0.29601 0.00000 0.00000
|
|
76 20G-2 0.00000 -0.29601 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 -0.05245
|
|
78 20G-3 0.00000 0.00000 0.00000 0.07404 0.00000
|
|
79 20G+4 0.06889 0.00000 -0.35275 0.00000 0.00000
|
|
80 20G-4 0.00000 0.35275 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 -0.13213 0.00000
|
|
82 21H+1 0.00000 -0.67075 0.00000 0.00000 0.00000
|
|
83 21H-1 0.24690 0.00000 -0.67075 0.00000 0.00000
|
|
84 21H+2 -0.58423 0.00000 -0.15515 0.00000 0.00000
|
|
85 21H-2 0.00000 -0.15515 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 -0.70639
|
|
87 21H-3 0.00000 0.00000 0.00000 0.08243 0.00000
|
|
88 21H+4 0.02911 0.00000 0.30911 0.00000 0.00000
|
|
89 21H-4 0.00000 -0.30911 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00157 0.00000 0.00000 0.00000
|
|
91 21H-5 -0.41945 0.00000 -0.00157 0.00000 0.00000
|
|
92 2 H 1S -0.01367 0.00000 0.00319 -0.31578 0.00000
|
|
93 2S -0.19352 0.00000 -0.16453 2.36653 0.00000
|
|
94 3S 1.00448 0.00000 -0.91188 -13.14994 0.00000
|
|
95 4S 0.33163 0.00000 -0.27071 -5.26064 0.00000
|
|
96 5S -0.00435 0.00000 -0.00530 -0.17256 0.00000
|
|
97 6PX 0.00000 -0.00928 0.00000 0.00000 0.00720
|
|
98 6PY -0.00040 0.00000 -0.03235 -0.01081 0.00000
|
|
99 6PZ 0.01869 0.00000 -0.01307 0.01853 0.00000
|
|
100 7PX 0.00000 0.15525 0.00000 0.00000 -0.06131
|
|
101 7PY 0.01343 0.00000 0.23533 -0.61732 0.00000
|
|
102 7PZ -0.09422 0.00000 0.10918 0.16376 0.00000
|
|
103 8PX 0.00000 0.44765 0.00000 0.00000 0.57105
|
|
104 8PY -0.59378 0.00000 0.18550 7.81895 0.00000
|
|
105 8PZ -0.45380 0.00000 0.79730 -2.86998 0.00000
|
|
106 9PX 0.00000 -0.05033 0.00000 0.00000 0.09531
|
|
107 9PY -0.14519 0.00000 -0.01003 3.55442 0.00000
|
|
108 9PZ -0.13086 0.00000 0.13031 -1.25189 0.00000
|
|
109 10D 0 -0.00081 0.00000 -0.15693 -0.01385 0.00000
|
|
110 10D+1 0.00000 -0.07197 0.00000 0.00000 -0.05391
|
|
111 10D-1 -0.11772 0.00000 0.10131 -0.10790 0.00000
|
|
112 10D+2 0.07197 0.00000 0.00237 -0.08241 0.00000
|
|
113 10D-2 0.00000 0.12266 0.00000 0.00000 -0.12620
|
|
114 11D 0 -0.05898 0.00000 0.52956 0.54669 0.00000
|
|
115 11D+1 0.00000 0.21884 0.00000 0.00000 0.19730
|
|
116 11D-1 0.34667 0.00000 -0.39546 1.11144 0.00000
|
|
117 11D+2 -0.31836 0.00000 0.07146 1.28895 0.00000
|
|
118 11D-2 0.00000 -0.42722 0.00000 0.00000 0.12458
|
|
119 12D 0 -0.02169 0.00000 0.00997 0.98262 0.00000
|
|
120 12D+1 0.00000 0.13494 0.00000 0.00000 0.32279
|
|
121 12D-1 0.18389 0.00000 -0.30241 1.56803 0.00000
|
|
122 12D+2 -0.12783 0.00000 -0.13640 2.13588 0.00000
|
|
123 12D-2 0.00000 -0.05092 0.00000 0.00000 -0.06826
|
|
124 13F 0 -0.23020 0.00000 -0.05022 0.00959 0.00000
|
|
125 13F+1 0.00000 -0.05696 0.00000 0.00000 -0.12286
|
|
126 13F-1 0.03276 0.00000 0.21533 0.00024 0.00000
|
|
127 13F+2 -0.03105 0.00000 -0.03391 -0.04720 0.00000
|
|
128 13F-2 0.00000 0.07632 0.00000 0.00000 0.16191
|
|
129 13F+3 0.00000 0.08376 0.00000 0.00000 -0.23314
|
|
130 13F-3 -0.14576 0.00000 -0.21403 -0.02988 0.00000
|
|
131 14F 0 0.31932 0.00000 -0.00087 0.50905 0.00000
|
|
132 14F+1 0.00000 0.01369 0.00000 0.00000 0.23874
|
|
133 14F-1 0.00057 0.00000 -0.30620 -0.23800 0.00000
|
|
134 14F+2 0.08916 0.00000 -0.09658 0.66534 0.00000
|
|
135 14F-2 0.00000 -0.20214 0.00000 0.00000 -0.26393
|
|
136 14F+3 0.00000 -0.14577 0.00000 0.00000 0.27141
|
|
137 14F-3 0.24413 0.00000 0.20520 -0.64049 0.00000
|
|
138 15G 0 -0.06852 0.00000 0.10339 0.02849 0.00000
|
|
139 15G+1 0.00000 0.07089 0.00000 0.00000 0.06831
|
|
140 15G-1 0.08919 0.00000 -0.00605 -0.07596 0.00000
|
|
141 15G+2 0.07821 0.00000 -0.06813 -0.01819 0.00000
|
|
142 15G-2 0.00000 0.04646 0.00000 0.00000 0.08356
|
|
143 15G+3 0.00000 -0.03430 0.00000 0.00000 0.04342
|
|
144 15G-3 -0.04743 0.00000 0.10648 -0.12358 0.00000
|
|
145 15G+4 -0.00493 0.00000 -0.16562 -0.08155 0.00000
|
|
146 15G-4 0.00000 0.01654 0.00000 0.00000 0.09060
|
|
147 3 H 1S 0.00684 0.00277 -0.00160 -0.31578 0.00000
|
|
148 2S 0.09676 -0.14249 0.08226 2.36653 0.00000
|
|
149 3S -0.50224 -0.78971 0.45594 -13.14994 0.00000
|
|
150 4S -0.16582 -0.23444 0.13536 -5.26064 0.00000
|
|
151 5S 0.00218 -0.00459 0.00265 -0.17256 0.00000
|
|
152 6PX 0.00181 -0.02658 0.00999 -0.00936 -0.00360
|
|
153 6PY 0.00273 0.00999 -0.01505 0.00540 -0.00623
|
|
154 6PZ -0.00934 -0.01132 0.00653 0.01853 0.00000
|
|
155 7PX -0.06391 0.21531 -0.03468 -0.53461 0.03066
|
|
156 7PY -0.09726 -0.03468 0.17527 0.30866 0.05310
|
|
157 7PZ 0.04711 0.09455 -0.05459 0.16376 0.00000
|
|
158 8PX 0.33747 0.25104 0.11351 6.77141 -0.28552
|
|
159 8PY -0.00926 0.11351 0.38211 -3.90947 -0.49454
|
|
160 8PZ 0.22690 0.69048 -0.39865 -2.86998 0.00000
|
|
161 9PX 0.14414 -0.02010 -0.01745 3.07822 -0.04766
|
|
162 9PY 0.10446 -0.01745 -0.04025 -1.77721 -0.08254
|
|
163 9PZ 0.06543 0.11285 -0.06515 -1.25189 0.00000
|
|
164 10D 0 0.00040 -0.13590 0.07846 -0.01385 0.00000
|
|
165 10D+1 0.06042 0.05799 -0.07503 -0.09345 0.02695
|
|
166 10D-1 -0.01307 -0.07503 -0.02865 0.05395 0.04669
|
|
167 10D+2 -0.01091 0.05209 0.09259 0.04120 0.10929
|
|
168 10D-2 -0.04785 0.03244 0.05209 -0.07137 0.06310
|
|
169 11D 0 0.02949 0.45862 -0.26478 0.54669 0.00000
|
|
170 11D+1 -0.19750 -0.24188 0.26600 0.96253 -0.09865
|
|
171 11D-1 0.00459 0.26600 0.06526 -0.55572 -0.17087
|
|
172 11D+2 -0.01899 -0.21593 -0.30255 -0.64448 -0.10789
|
|
173 11D-2 0.17284 -0.05321 -0.21593 1.11626 -0.06229
|
|
174 12D 0 0.01084 0.00864 -0.00499 0.98262 0.00000
|
|
175 12D+1 -0.15249 -0.19307 0.18938 1.35795 -0.16140
|
|
176 12D-1 -0.08023 0.18938 0.02560 -0.78402 -0.27955
|
|
177 12D+2 -0.20030 0.03702 -0.07229 -1.06794 0.05912
|
|
178 12D-2 -0.04184 -0.11503 0.03702 1.84972 0.03413
|
|
179 13F 0 0.11510 -0.04350 0.02511 0.00959 0.00000
|
|
180 13F+1 0.03833 0.14726 -0.11790 0.00021 0.06143
|
|
181 13F-1 0.09915 -0.11790 0.01111 -0.00012 0.10640
|
|
182 13F+2 0.03068 0.04773 0.04876 0.02360 -0.14022
|
|
183 13F-2 0.03564 -0.00636 0.04773 -0.04087 -0.08096
|
|
184 13F+3 0.04111 -0.04188 -0.07254 0.00000 -0.23314
|
|
185 13F-3 0.07288 -0.18536 0.10702 -0.02988 0.00000
|
|
186 14F 0 -0.15966 -0.00075 0.00044 0.50905 0.00000
|
|
187 14F+1 -0.08128 -0.22623 0.13851 -0.20611 -0.11937
|
|
188 14F-1 -0.14021 0.13851 -0.06629 0.11900 -0.20676
|
|
189 14F+2 0.07666 -0.04571 -0.17575 -0.33267 0.22857
|
|
190 14F-2 -0.00722 -0.12297 -0.04571 0.57620 0.13197
|
|
191 14F+3 0.01242 0.07288 0.12624 0.00000 0.27141
|
|
192 14F-3 -0.12206 0.17771 -0.10260 -0.64049 0.00000
|
|
193 15G 0 0.03426 0.08954 -0.05169 0.02849 0.00000
|
|
194 15G+1 0.02348 0.01319 0.03332 -0.06579 -0.03415
|
|
195 15G-1 0.12985 0.03332 0.05166 0.03798 -0.05916
|
|
196 15G+2 -0.07041 0.04962 0.01781 0.00909 -0.07236
|
|
197 15G-2 -0.08581 -0.03948 0.04962 -0.01575 -0.04178
|
|
198 15G+3 -0.08427 0.01715 0.02971 0.00000 0.04342
|
|
199 15G-3 0.02371 0.09222 -0.05324 -0.12358 0.00000
|
|
200 15G+4 -0.08069 0.06456 -0.05381 0.04077 0.07846
|
|
201 15G-4 0.04374 0.12835 -0.06456 0.07062 -0.04530
|
|
202 4 H 1S 0.00684 -0.00277 -0.00160 -0.31578 0.00000
|
|
203 2S 0.09676 0.14249 0.08226 2.36653 0.00000
|
|
204 3S -0.50224 0.78971 0.45594 -13.14994 0.00000
|
|
205 4S -0.16582 0.23444 0.13536 -5.26064 0.00000
|
|
206 5S 0.00218 0.00459 0.00265 -0.17256 0.00000
|
|
207 6PX -0.00181 -0.02658 -0.00999 0.00936 -0.00360
|
|
208 6PY 0.00273 -0.00999 -0.01505 0.00540 0.00623
|
|
209 6PZ -0.00934 0.01132 0.00653 0.01853 0.00000
|
|
210 7PX 0.06391 0.21531 0.03468 0.53461 0.03066
|
|
211 7PY -0.09726 0.03468 0.17527 0.30866 -0.05310
|
|
212 7PZ 0.04711 -0.09455 -0.05459 0.16376 0.00000
|
|
213 8PX -0.33747 0.25104 -0.11351 -6.77141 -0.28552
|
|
214 8PY -0.00926 -0.11351 0.38211 -3.90947 0.49454
|
|
215 8PZ 0.22690 -0.69048 -0.39865 -2.86998 0.00000
|
|
216 9PX -0.14414 -0.02010 0.01745 -3.07822 -0.04766
|
|
217 9PY 0.10446 0.01745 -0.04025 -1.77721 0.08254
|
|
218 9PZ 0.06543 -0.11285 -0.06515 -1.25189 0.00000
|
|
219 10D 0 0.00040 0.13590 0.07846 -0.01385 0.00000
|
|
220 10D+1 -0.06042 0.05799 0.07503 0.09345 0.02695
|
|
221 10D-1 -0.01307 0.07503 -0.02865 0.05395 -0.04669
|
|
222 10D+2 -0.01091 -0.05209 0.09259 0.04120 -0.10929
|
|
223 10D-2 0.04785 0.03244 -0.05209 0.07137 0.06310
|
|
224 11D 0 0.02949 -0.45862 -0.26478 0.54669 0.00000
|
|
225 11D+1 0.19750 -0.24188 -0.26600 -0.96253 -0.09865
|
|
226 11D-1 0.00459 -0.26600 0.06526 -0.55572 0.17087
|
|
227 11D+2 -0.01899 0.21593 -0.30255 -0.64448 0.10789
|
|
228 11D-2 -0.17284 -0.05321 0.21593 -1.11626 -0.06229
|
|
229 12D 0 0.01084 -0.00864 -0.00499 0.98262 0.00000
|
|
230 12D+1 0.15249 -0.19307 -0.18938 -1.35795 -0.16140
|
|
231 12D-1 -0.08023 -0.18938 0.02560 -0.78402 0.27955
|
|
232 12D+2 -0.20030 -0.03702 -0.07229 -1.06794 -0.05912
|
|
233 12D-2 0.04184 -0.11503 -0.03702 -1.84972 0.03413
|
|
234 13F 0 0.11510 0.04350 0.02511 0.00959 0.00000
|
|
235 13F+1 -0.03833 0.14726 0.11790 -0.00021 0.06143
|
|
236 13F-1 0.09915 0.11790 0.01111 -0.00012 -0.10640
|
|
237 13F+2 0.03068 -0.04773 0.04876 0.02360 0.14022
|
|
238 13F-2 -0.03564 -0.00636 -0.04773 0.04087 -0.08096
|
|
239 13F+3 -0.04111 -0.04188 0.07254 0.00000 -0.23314
|
|
240 13F-3 0.07288 0.18536 0.10702 -0.02988 0.00000
|
|
241 14F 0 -0.15966 0.00075 0.00044 0.50905 0.00000
|
|
242 14F+1 0.08128 -0.22623 -0.13851 0.20611 -0.11937
|
|
243 14F-1 -0.14021 -0.13851 -0.06629 0.11900 0.20676
|
|
244 14F+2 0.07666 0.04571 -0.17575 -0.33267 -0.22857
|
|
245 14F-2 0.00722 -0.12297 0.04571 -0.57620 0.13197
|
|
246 14F+3 -0.01242 0.07288 -0.12624 0.00000 0.27141
|
|
247 14F-3 -0.12206 -0.17771 -0.10260 -0.64049 0.00000
|
|
248 15G 0 0.03426 -0.08954 -0.05169 0.02849 0.00000
|
|
249 15G+1 -0.02348 0.01319 -0.03332 0.06579 -0.03415
|
|
250 15G-1 0.12985 -0.03332 0.05166 0.03798 0.05916
|
|
251 15G+2 -0.07041 -0.04962 0.01781 0.00909 0.07236
|
|
252 15G-2 0.08581 -0.03948 -0.04962 0.01575 -0.04178
|
|
253 15G+3 0.08427 0.01715 -0.02971 0.00000 0.04342
|
|
254 15G-3 0.02371 -0.09222 -0.05324 -0.12358 0.00000
|
|
255 15G+4 -0.08069 -0.06456 -0.05381 0.04077 -0.07846
|
|
256 15G-4 -0.04374 0.12835 0.06456 -0.07062 -0.04530
|
|
151 152 153 154 155
|
|
(A1)--V (E)--V (E)--V (A1)--V (E)--V
|
|
Eigenvalues -- 11.54136 11.91831 11.91831 11.93247 12.10863
|
|
1 1 N 1S -0.01199 0.00000 0.00000 0.02699 0.00000
|
|
2 2S -0.04683 0.00000 0.00000 -0.37695 0.00000
|
|
3 3S -0.46202 0.00000 0.00000 -1.89097 0.00000
|
|
4 4S 0.41493 0.00000 0.00000 5.03666 0.00000
|
|
5 5S 11.78209 0.00000 0.00000 -1.63888 0.00000
|
|
6 6S 3.74142 0.00000 0.00000 0.53278 0.00000
|
|
7 7PX 0.00000 -0.19394 0.00000 0.00000 0.00000
|
|
8 7PY 0.00000 0.00000 -0.19394 0.00000 0.63637
|
|
9 7PZ -0.13393 0.00000 0.00000 0.39185 0.00000
|
|
10 8PX 0.00000 0.27524 0.00000 0.00000 0.00000
|
|
11 8PY 0.00000 0.00000 0.27524 0.00000 -0.96442
|
|
12 8PZ 0.15155 0.00000 0.00000 -0.37437 0.00000
|
|
13 9PX 0.00000 1.29734 0.00000 0.00000 0.00000
|
|
14 9PY 0.00000 0.00000 1.29734 0.00000 1.77578
|
|
15 9PZ -1.60777 0.00000 0.00000 -2.33961 0.00000
|
|
16 10PX 0.00000 -0.66533 0.00000 0.00000 0.00000
|
|
17 10PY 0.00000 0.00000 -0.66533 0.00000 1.37943
|
|
18 10PZ -2.03763 0.00000 0.00000 0.25841 0.00000
|
|
19 11PX 0.00000 -0.19183 0.00000 0.00000 0.00000
|
|
20 11PY 0.00000 0.00000 -0.19183 0.00000 0.06373
|
|
21 11PZ -0.33310 0.00000 0.00000 -0.17866 0.00000
|
|
22 12D 0 0.01450 0.00000 0.00000 -0.08316 0.00000
|
|
23 12D+1 0.00000 0.00337 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00337 0.00000 0.01501
|
|
25 12D+2 0.00000 0.00000 -0.06654 0.00000 0.07873
|
|
26 12D-2 0.00000 -0.06654 0.00000 0.00000 0.00000
|
|
27 13D 0 -0.06029 0.00000 0.00000 -0.42764 0.00000
|
|
28 13D+1 0.00000 0.06102 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.06102 0.00000 -0.32503
|
|
30 13D+2 0.00000 0.00000 -0.45714 0.00000 -0.15537
|
|
31 13D-2 0.00000 -0.45714 0.00000 0.00000 0.00000
|
|
32 14D 0 -0.62750 0.00000 0.00000 2.14964 0.00000
|
|
33 14D+1 0.00000 -1.33565 0.00000 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 -1.33565 0.00000 1.08078
|
|
35 14D+2 0.00000 0.00000 3.00198 0.00000 -0.49536
|
|
36 14D-2 0.00000 3.00198 0.00000 0.00000 0.00000
|
|
37 15D 0 -0.05401 0.00000 0.00000 0.42616 0.00000
|
|
38 15D+1 0.00000 0.20722 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.20722 0.00000 0.20280
|
|
40 15D+2 0.00000 0.00000 0.73973 0.00000 0.02318
|
|
41 15D-2 0.00000 0.73973 0.00000 0.00000 0.00000
|
|
42 16F 0 -0.12072 0.00000 0.00000 0.07021 0.00000
|
|
43 16F+1 0.00000 0.14442 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.14442 0.00000 0.00208
|
|
45 16F+2 0.00000 0.00000 -0.05859 0.00000 -0.07200
|
|
46 16F-2 0.00000 -0.05859 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.04303 0.00000 0.00000 0.06953 0.00000
|
|
49 17F 0 0.01556 0.00000 0.00000 0.12525 0.00000
|
|
50 17F+1 0.00000 0.28729 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.28729 0.00000 -0.28538
|
|
52 17F+2 0.00000 0.00000 -0.39878 0.00000 -0.10697
|
|
53 17F-2 0.00000 -0.39878 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 -0.03507 0.00000 0.00000 0.22043 0.00000
|
|
56 18F 0 -0.60712 0.00000 0.00000 -0.57725 0.00000
|
|
57 18F+1 0.00000 0.33327 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.33327 0.00000 -0.77826
|
|
59 18F+2 0.00000 0.00000 -0.56231 0.00000 -0.39941
|
|
60 18F-2 0.00000 -0.56231 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 -0.87568 0.00000 0.00000 0.51784 0.00000
|
|
63 19G 0 0.02459 0.00000 0.00000 -0.13736 0.00000
|
|
64 19G+1 0.00000 0.02845 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.02845 0.00000 -0.06766
|
|
66 19G+2 0.00000 0.00000 -0.20054 0.00000 -0.05988
|
|
67 19G-2 0.00000 -0.20054 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 -0.02889 0.00000 0.00000 0.08901 0.00000
|
|
70 19G+4 0.00000 0.00000 0.03575 0.00000 -0.07539
|
|
71 19G-4 0.00000 -0.03575 0.00000 0.00000 0.00000
|
|
72 20G 0 0.32380 0.00000 0.00000 -0.35621 0.00000
|
|
73 20G+1 0.00000 -0.11447 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 -0.11447 0.00000 -0.05806
|
|
75 20G+2 0.00000 0.00000 -0.12743 0.00000 0.31079
|
|
76 20G-2 0.00000 -0.12743 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 -0.32261 0.00000 0.00000 -0.03477 0.00000
|
|
79 20G+4 0.00000 0.00000 0.13014 0.00000 -0.03641
|
|
80 20G-4 0.00000 -0.13014 0.00000 0.00000 0.00000
|
|
81 21H 0 0.74654 0.00000 0.00000 0.47185 0.00000
|
|
82 21H+1 0.00000 -0.17252 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 -0.17252 0.00000 0.35624
|
|
84 21H+2 0.00000 0.00000 0.40668 0.00000 0.17431
|
|
85 21H-2 0.00000 0.40668 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.44589 0.00000 0.00000 -0.54331 0.00000
|
|
88 21H+4 0.00000 0.00000 -0.07924 0.00000 0.49045
|
|
89 21H-4 0.00000 0.07924 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.61624 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 -0.61624 0.00000 -0.12687
|
|
92 2 H 1S 0.02615 0.00000 0.09460 -0.03439 0.06662
|
|
93 2S 0.95056 0.00000 0.66548 0.52404 0.77278
|
|
94 3S -3.90049 0.00000 0.38042 0.13996 -1.62422
|
|
95 4S -2.21158 0.00000 0.21808 -0.52639 -1.01579
|
|
96 5S -0.01002 0.00000 0.10461 0.01539 0.09164
|
|
97 6PX 0.00000 0.02253 0.00000 0.00000 0.00000
|
|
98 6PY 0.07946 0.00000 0.10935 0.02033 0.14361
|
|
99 6PZ -0.03209 0.00000 -0.07679 -0.03405 -0.04260
|
|
100 7PX 0.00000 -0.11916 0.00000 0.00000 0.00000
|
|
101 7PY -0.65853 0.00000 -0.58769 -0.12241 -0.62982
|
|
102 7PZ 0.19633 0.00000 0.34496 0.26093 0.26225
|
|
103 8PX 0.00000 -1.48032 0.00000 0.00000 0.00000
|
|
104 8PY 2.16502 0.00000 0.86589 0.78562 0.73960
|
|
105 8PZ -1.23376 0.00000 0.51202 0.49327 -1.58905
|
|
106 9PX 0.00000 -0.17319 0.00000 0.00000 0.00000
|
|
107 9PY 1.26419 0.00000 0.08603 0.37379 0.44785
|
|
108 9PZ -0.45504 0.00000 0.15454 -0.02242 -0.52982
|
|
109 10D 0 0.08072 0.00000 -0.15889 -0.17234 0.08714
|
|
110 10D+1 0.00000 0.17301 0.00000 0.00000 0.00000
|
|
111 10D-1 0.01719 0.00000 0.15503 0.15279 0.09554
|
|
112 10D+2 0.04216 0.00000 -0.05159 -0.16888 0.15573
|
|
113 10D-2 0.00000 -0.15303 0.00000 0.00000 0.00000
|
|
114 11D 0 -0.20314 0.00000 0.46462 0.50076 -0.33127
|
|
115 11D+1 0.00000 -0.50688 0.00000 0.00000 0.00000
|
|
116 11D-1 0.18364 0.00000 -0.43414 -0.41596 0.22140
|
|
117 11D+2 0.09418 0.00000 0.19570 0.56418 -0.27106
|
|
118 11D-2 0.00000 0.88591 0.00000 0.00000 0.00000
|
|
119 12D 0 -0.04791 0.00000 0.35643 0.19188 -0.16009
|
|
120 12D+1 0.00000 -0.20327 0.00000 0.00000 0.00000
|
|
121 12D-1 0.43564 0.00000 -0.00683 0.05031 0.70458
|
|
122 12D+2 0.81953 0.00000 0.40580 0.48339 0.10046
|
|
123 12D-2 0.00000 0.55511 0.00000 0.00000 0.00000
|
|
124 13F 0 0.13773 0.00000 -0.19648 0.04421 0.09824
|
|
125 13F+1 0.00000 0.10105 0.00000 0.00000 0.00000
|
|
126 13F-1 -0.03791 0.00000 0.18766 0.13200 -0.06284
|
|
127 13F+2 -0.07920 0.00000 0.06480 0.05169 0.18792
|
|
128 13F-2 0.00000 -0.33319 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 -0.02517 0.00000 0.00000 0.00000
|
|
130 13F-3 -0.00588 0.00000 0.13347 0.26595 -0.08118
|
|
131 14F 0 -0.17056 0.00000 0.13786 -0.04142 -0.00499
|
|
132 14F+1 0.00000 -0.05113 0.00000 0.00000 0.00000
|
|
133 14F-1 0.15348 0.00000 -0.43409 -0.34189 0.24493
|
|
134 14F+2 0.11366 0.00000 -0.07529 -0.01918 0.00158
|
|
135 14F-2 0.00000 0.49279 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.43979 0.00000 0.00000 0.00000
|
|
137 14F-3 -0.21519 0.00000 -0.19247 -0.49188 0.17551
|
|
138 15G 0 0.03206 0.00000 -0.12564 -0.07701 0.09633
|
|
139 15G+1 0.00000 0.09727 0.00000 0.00000 0.00000
|
|
140 15G-1 -0.12154 0.00000 0.00882 -0.03781 -0.04316
|
|
141 15G+2 0.06528 0.00000 0.01450 -0.02779 0.03668
|
|
142 15G-2 0.00000 0.02664 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 -0.01381 0.00000 0.00000 0.00000
|
|
144 15G-3 0.10653 0.00000 -0.01850 -0.00601 -0.15402
|
|
145 15G+4 -0.07033 0.00000 -0.00397 0.01266 -0.05423
|
|
146 15G-4 0.00000 -0.17220 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.02615 0.08193 -0.04730 -0.03439 -0.03331
|
|
148 2S 0.95056 0.57632 -0.33274 0.52404 -0.38639
|
|
149 3S -3.90049 0.32945 -0.19021 0.13996 0.81211
|
|
150 4S -2.21158 0.18886 -0.10904 -0.52639 0.50790
|
|
151 5S -0.01002 0.09060 -0.05231 0.01539 -0.04582
|
|
152 6PX 0.06882 0.08765 -0.03759 0.01761 -0.06763
|
|
153 6PY -0.03973 -0.03759 0.04424 -0.01017 0.02647
|
|
154 6PZ -0.03209 -0.06650 0.03839 -0.03405 0.02130
|
|
155 7PX -0.57030 -0.47056 0.20288 -0.10601 0.34260
|
|
156 7PY 0.32927 0.20288 -0.23630 0.06120 -0.03642
|
|
157 7PZ 0.19633 0.29874 -0.17248 0.26093 -0.13112
|
|
158 8PX 1.87496 0.27934 -1.01594 0.68037 -0.40326
|
|
159 8PY -1.08251 -1.01594 -0.89377 -0.39281 0.04113
|
|
160 8PZ -1.23376 0.44342 -0.25601 0.49327 0.79452
|
|
161 9PX 1.09482 0.02123 -0.11225 0.32371 -0.26053
|
|
162 9PY -0.63209 -0.11225 -0.10838 -0.18690 -0.00341
|
|
163 9PZ -0.45504 0.13383 -0.07727 -0.02242 0.26491
|
|
164 10D 0 0.08072 -0.13760 0.07944 -0.17234 -0.04357
|
|
165 10D+1 0.01489 0.15952 0.00779 0.13232 -0.03193
|
|
166 10D-1 -0.00859 0.00779 0.16852 -0.07639 0.04023
|
|
167 10D+2 -0.02108 -0.04392 -0.12767 0.08444 0.21663
|
|
168 10D-2 0.03651 -0.07695 -0.04392 -0.14625 0.03516
|
|
169 11D 0 -0.20314 0.40237 -0.23231 0.50076 0.16564
|
|
170 11D+1 0.15904 -0.45232 -0.03150 -0.36023 -0.08643
|
|
171 11D-1 -0.09182 -0.03150 -0.48870 0.20798 0.07170
|
|
172 11D+2 -0.04709 0.29887 0.71335 -0.28209 -0.31309
|
|
173 11D-2 0.08157 0.36825 0.29887 0.48860 -0.02427
|
|
174 12D 0 -0.04791 0.30868 -0.17822 0.19188 0.08005
|
|
175 12D+1 0.37727 -0.05594 -0.08506 0.04357 -0.39380
|
|
176 12D-1 -0.21782 -0.08506 -0.15416 -0.02516 0.02250
|
|
177 12D+2 -0.40977 0.06465 0.51779 -0.24170 0.13589
|
|
178 12D-2 0.70974 0.44313 0.06465 0.41863 0.02046
|
|
179 13F 0 0.13773 -0.17016 0.09824 0.04421 -0.04912
|
|
180 13F+1 -0.03283 0.16600 -0.03750 0.11432 0.14049
|
|
181 13F-1 0.01895 -0.03750 0.12270 -0.06600 0.18049
|
|
182 13F+2 0.03960 -0.17233 -0.23369 -0.02584 0.08742
|
|
183 13F-2 -0.06859 -0.03470 -0.17233 0.04476 -0.05802
|
|
184 13F+3 0.00000 0.01259 0.02180 0.00000 -0.14238
|
|
185 13F-3 -0.00588 0.11558 -0.06673 0.26595 0.04059
|
|
186 14F 0 -0.17056 0.11939 -0.06893 -0.04142 0.00249
|
|
187 14F+1 0.13292 -0.33835 0.16583 -0.29609 -0.17708
|
|
188 14F-1 -0.07674 0.16583 -0.14687 0.17095 -0.06179
|
|
189 14F+2 -0.05683 0.24598 0.35077 0.00959 0.03172
|
|
190 14F-2 0.09843 0.06673 0.24598 -0.01661 0.01740
|
|
191 14F+3 0.00000 -0.21989 -0.38087 0.00000 0.15910
|
|
192 14F-3 -0.21519 -0.16668 0.09624 -0.49188 -0.08775
|
|
193 15G 0 0.03206 -0.10881 0.06282 -0.07701 -0.04817
|
|
194 15G+1 -0.10525 0.03093 0.03830 -0.03275 0.04421
|
|
195 15G-1 0.06077 0.03830 0.07515 0.01891 0.03342
|
|
196 15G+2 -0.03264 0.00526 0.02360 0.01389 -0.00761
|
|
197 15G-2 0.05653 0.01753 0.00526 -0.02407 -0.02557
|
|
198 15G+3 0.00000 0.00691 0.01196 0.00000 0.03133
|
|
199 15G-3 0.10653 -0.01602 0.00925 -0.00601 0.07701
|
|
200 15G+4 0.03517 0.07629 0.12816 -0.00633 0.01926
|
|
201 15G-4 0.06091 -0.04007 -0.07629 -0.01096 -0.04243
|
|
202 4 H 1S 0.02615 -0.08193 -0.04730 -0.03439 -0.03331
|
|
203 2S 0.95056 -0.57632 -0.33274 0.52404 -0.38639
|
|
204 3S -3.90049 -0.32945 -0.19021 0.13996 0.81211
|
|
205 4S -2.21158 -0.18886 -0.10904 -0.52639 0.50790
|
|
206 5S -0.01002 -0.09060 -0.05231 0.01539 -0.04582
|
|
207 6PX -0.06882 0.08765 0.03759 -0.01761 0.06763
|
|
208 6PY -0.03973 0.03759 0.04424 -0.01017 0.02647
|
|
209 6PZ -0.03209 0.06650 0.03839 -0.03405 0.02130
|
|
210 7PX 0.57030 -0.47056 -0.20288 0.10601 -0.34260
|
|
211 7PY 0.32927 -0.20288 -0.23630 0.06120 -0.03642
|
|
212 7PZ 0.19633 -0.29874 -0.17248 0.26093 -0.13112
|
|
213 8PX -1.87496 0.27934 1.01594 -0.68037 0.40326
|
|
214 8PY -1.08251 1.01594 -0.89377 -0.39281 0.04113
|
|
215 8PZ -1.23376 -0.44342 -0.25601 0.49327 0.79452
|
|
216 9PX -1.09482 0.02123 0.11225 -0.32371 0.26053
|
|
217 9PY -0.63209 0.11225 -0.10838 -0.18690 -0.00341
|
|
218 9PZ -0.45504 -0.13383 -0.07727 -0.02242 0.26491
|
|
219 10D 0 0.08072 0.13760 0.07944 -0.17234 -0.04357
|
|
220 10D+1 -0.01489 0.15952 -0.00779 -0.13232 0.03193
|
|
221 10D-1 -0.00859 -0.00779 0.16852 -0.07639 0.04023
|
|
222 10D+2 -0.02108 0.04392 -0.12767 0.08444 0.21663
|
|
223 10D-2 -0.03651 -0.07695 0.04392 0.14625 -0.03516
|
|
224 11D 0 -0.20314 -0.40237 -0.23231 0.50076 0.16564
|
|
225 11D+1 -0.15904 -0.45232 0.03150 0.36023 0.08643
|
|
226 11D-1 -0.09182 0.03150 -0.48870 0.20798 0.07170
|
|
227 11D+2 -0.04709 -0.29887 0.71335 -0.28209 -0.31309
|
|
228 11D-2 -0.08157 0.36825 -0.29887 -0.48860 0.02427
|
|
229 12D 0 -0.04791 -0.30868 -0.17822 0.19188 0.08005
|
|
230 12D+1 -0.37727 -0.05594 0.08506 -0.04357 0.39380
|
|
231 12D-1 -0.21782 0.08506 -0.15416 -0.02516 0.02250
|
|
232 12D+2 -0.40977 -0.06465 0.51779 -0.24170 0.13589
|
|
233 12D-2 -0.70974 0.44313 -0.06465 -0.41863 -0.02046
|
|
234 13F 0 0.13773 0.17016 0.09824 0.04421 -0.04912
|
|
235 13F+1 0.03283 0.16600 0.03750 -0.11432 -0.14049
|
|
236 13F-1 0.01895 0.03750 0.12270 -0.06600 0.18049
|
|
237 13F+2 0.03960 0.17233 -0.23369 -0.02584 0.08742
|
|
238 13F-2 0.06859 -0.03470 0.17233 -0.04476 0.05802
|
|
239 13F+3 0.00000 0.01259 -0.02180 0.00000 0.14238
|
|
240 13F-3 -0.00588 -0.11558 -0.06673 0.26595 0.04059
|
|
241 14F 0 -0.17056 -0.11939 -0.06893 -0.04142 0.00249
|
|
242 14F+1 -0.13292 -0.33835 -0.16583 0.29609 0.17708
|
|
243 14F-1 -0.07674 -0.16583 -0.14687 0.17095 -0.06179
|
|
244 14F+2 -0.05683 -0.24598 0.35077 0.00959 0.03172
|
|
245 14F-2 -0.09843 0.06673 -0.24598 0.01661 -0.01740
|
|
246 14F+3 0.00000 -0.21989 0.38087 0.00000 -0.15910
|
|
247 14F-3 -0.21519 0.16668 0.09624 -0.49188 -0.08775
|
|
248 15G 0 0.03206 0.10881 0.06282 -0.07701 -0.04817
|
|
249 15G+1 0.10525 0.03093 -0.03830 0.03275 -0.04421
|
|
250 15G-1 0.06077 -0.03830 0.07515 0.01891 0.03342
|
|
251 15G+2 -0.03264 -0.00526 0.02360 0.01389 -0.00761
|
|
252 15G-2 -0.05653 0.01753 -0.00526 0.02407 0.02557
|
|
253 15G+3 0.00000 0.00691 -0.01196 0.00000 -0.03133
|
|
254 15G-3 0.10653 0.01602 0.00925 -0.00601 0.07701
|
|
255 15G+4 0.03517 -0.07629 0.12816 -0.00633 0.01926
|
|
256 15G-4 -0.06091 -0.04007 0.07629 0.01096 0.04243
|
|
156 157 158 159 160
|
|
(E)--V (A1)--V (E)--V (E)--V (A2)--V
|
|
Eigenvalues -- 12.10863 12.50084 12.55434 12.55434 12.62665
|
|
1 1 N 1S 0.00000 -0.04103 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.00797 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 0.08886 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 -1.43312 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 3.80198 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 1.11865 0.00000 0.00000 0.00000
|
|
7 7PX 0.63637 0.00000 -0.10794 0.00000 0.00000
|
|
8 7PY 0.00000 0.00000 0.00000 -0.10794 0.00000
|
|
9 7PZ 0.00000 -0.22300 0.00000 0.00000 0.00000
|
|
10 8PX -0.96442 0.00000 0.07081 0.00000 0.00000
|
|
11 8PY 0.00000 0.00000 0.00000 0.07081 0.00000
|
|
12 8PZ 0.00000 0.60400 0.00000 0.00000 0.00000
|
|
13 9PX 1.77578 0.00000 -0.53730 0.00000 0.00000
|
|
14 9PY 0.00000 0.00000 0.00000 -0.53730 0.00000
|
|
15 9PZ 0.00000 -1.20465 0.00000 0.00000 0.00000
|
|
16 10PX 1.37943 0.00000 0.90803 0.00000 0.00000
|
|
17 10PY 0.00000 0.00000 0.00000 0.90803 0.00000
|
|
18 10PZ 0.00000 -0.60801 0.00000 0.00000 0.00000
|
|
19 11PX 0.06373 0.00000 0.15328 0.00000 0.00000
|
|
20 11PY 0.00000 0.00000 0.00000 0.15328 0.00000
|
|
21 11PZ 0.00000 -0.02647 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 -0.00301 0.00000 0.00000 0.00000
|
|
23 12D+1 0.01501 0.00000 0.01029 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.01029 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 -0.01615 0.00000
|
|
26 12D-2 0.07873 0.00000 -0.01615 0.00000 0.00000
|
|
27 13D 0 0.00000 -0.09233 0.00000 0.00000 0.00000
|
|
28 13D+1 -0.32503 0.00000 0.12436 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.12436 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 0.03844 0.00000
|
|
31 13D-2 -0.15537 0.00000 0.03844 0.00000 0.00000
|
|
32 14D 0 0.00000 0.14087 0.00000 0.00000 0.00000
|
|
33 14D+1 1.08078 0.00000 -0.47430 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 -0.47430 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.44237 0.00000
|
|
36 14D-2 -0.49536 0.00000 0.44237 0.00000 0.00000
|
|
37 15D 0 0.00000 -0.18974 0.00000 0.00000 0.00000
|
|
38 15D+1 0.20280 0.00000 -0.61150 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 -0.61150 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.04256 0.00000
|
|
41 15D-2 0.02318 0.00000 0.04256 0.00000 0.00000
|
|
42 16F 0 0.00000 -0.17223 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00208 0.00000 0.00178 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00178 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 -0.00512 0.00000
|
|
46 16F-2 -0.07200 0.00000 -0.00512 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 -0.01494
|
|
48 16F-3 0.00000 0.29031 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.33181 0.00000 0.00000 0.00000
|
|
50 17F+1 -0.28538 0.00000 0.03325 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.03325 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 -0.00775 0.00000
|
|
53 17F-2 -0.10697 0.00000 -0.00775 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.07702
|
|
55 17F-3 0.00000 -0.42225 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.03081 0.00000 0.00000 0.00000
|
|
57 18F+1 -0.77826 0.00000 0.34798 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.34798 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.15761 0.00000
|
|
60 18F-2 -0.39941 0.00000 0.15761 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.65918
|
|
62 18F-3 0.00000 -0.03153 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 -0.13644 0.00000 0.00000 0.00000
|
|
64 19G+1 -0.06766 0.00000 -0.11049 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 -0.11049 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.04381 0.00000
|
|
67 19G-2 -0.05988 0.00000 0.04381 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.02409
|
|
69 19G-3 0.00000 0.00535 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 -0.10617 0.00000
|
|
71 19G-4 0.07539 0.00000 0.10617 0.00000 0.00000
|
|
72 20G 0 0.00000 -0.09559 0.00000 0.00000 0.00000
|
|
73 20G+1 -0.05806 0.00000 0.08285 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.08285 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 -0.17067 0.00000
|
|
76 20G-2 0.31079 0.00000 -0.17067 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 -0.20023
|
|
78 20G-3 0.00000 0.17184 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.19384 0.00000
|
|
80 20G-4 0.03641 0.00000 -0.19384 0.00000 0.00000
|
|
81 21H 0 0.00000 -0.01817 0.00000 0.00000 0.00000
|
|
82 21H+1 0.35624 0.00000 -0.13625 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 -0.13625 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 -0.04290 0.00000
|
|
85 21H-2 0.17431 0.00000 -0.04290 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 -0.07870
|
|
87 21H-3 0.00000 -0.09451 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 -0.12276 0.00000
|
|
89 21H-4 -0.49045 0.00000 0.12276 0.00000 0.00000
|
|
90 21H+5 0.12687 0.00000 0.02726 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 -0.02726 0.00000
|
|
92 2 H 1S 0.00000 -0.30543 0.00000 0.04726 0.00000
|
|
93 2S 0.00000 0.22867 0.00000 -0.43259 0.00000
|
|
94 3S 0.00000 -1.04527 0.00000 0.21558 0.00000
|
|
95 4S 0.00000 -0.50705 0.00000 -0.15421 0.00000
|
|
96 5S 0.00000 -0.04969 0.00000 0.00392 0.00000
|
|
97 6PX -0.01257 0.00000 0.02114 0.00000 -0.01403
|
|
98 6PY 0.00000 -0.05567 0.00000 -0.02054 0.00000
|
|
99 6PZ 0.00000 0.02358 0.00000 -0.00810 0.00000
|
|
100 7PX 0.16137 0.00000 -0.02422 0.00000 -0.02869
|
|
101 7PY 0.00000 0.24943 0.00000 0.20373 0.00000
|
|
102 7PZ 0.00000 -0.06270 0.00000 -0.07353 0.00000
|
|
103 8PX -0.19169 0.00000 -0.28724 0.00000 0.49067
|
|
104 8PY 0.00000 0.22856 0.00000 -0.27259 0.00000
|
|
105 8PZ 0.00000 0.05269 0.00000 0.64320 0.00000
|
|
106 9PX -0.15383 0.00000 -0.29343 0.00000 0.15563
|
|
107 9PY 0.00000 0.36711 0.00000 -0.10726 0.00000
|
|
108 9PZ 0.00000 -0.20153 0.00000 0.13254 0.00000
|
|
109 10D 0 0.00000 -0.09963 0.00000 -0.03204 0.00000
|
|
110 10D+1 0.02180 0.00000 -0.09979 0.00000 0.01754
|
|
111 10D-1 0.00000 0.14531 0.00000 0.05390 0.00000
|
|
112 10D+2 0.00000 0.06525 0.00000 0.02359 0.00000
|
|
113 10D-2 0.23693 0.00000 -0.08865 0.00000 -0.02159
|
|
114 11D 0 0.00000 0.14021 0.00000 0.10708 0.00000
|
|
115 11D+1 0.02180 0.00000 -0.00654 0.00000 0.04088
|
|
116 11D-1 0.00000 -0.16851 0.00000 -0.19963 0.00000
|
|
117 11D+2 0.00000 0.02291 0.00000 0.00959 0.00000
|
|
118 11D-2 -0.32711 0.00000 0.15310 0.00000 -0.06600
|
|
119 12D 0 0.00000 0.00066 0.00000 0.00839 0.00000
|
|
120 12D+1 -0.20486 0.00000 -0.02391 0.00000 0.13881
|
|
121 12D-1 0.00000 0.02652 0.00000 -0.25694 0.00000
|
|
122 12D+2 0.00000 0.06569 0.00000 -0.11652 0.00000
|
|
123 12D-2 0.14770 0.00000 0.21328 0.00000 -0.22661
|
|
124 13F 0 0.00000 0.38824 0.00000 -0.13097 0.00000
|
|
125 13F+1 0.26160 0.00000 0.16435 0.00000 -0.37480
|
|
126 13F-1 0.00000 0.12953 0.00000 -0.09866 0.00000
|
|
127 13F+2 0.00000 0.12090 0.00000 0.26628 0.00000
|
|
128 13F-2 0.05392 0.00000 0.40489 0.00000 -0.17663
|
|
129 13F+3 0.16441 0.00000 -0.23671 0.00000 0.16163
|
|
130 13F-3 0.00000 -0.36902 0.00000 0.20978 0.00000
|
|
131 14F 0 0.00000 -0.20965 0.00000 0.02707 0.00000
|
|
132 14F+1 -0.16403 0.00000 -0.07311 0.00000 0.19081
|
|
133 14F-1 0.00000 -0.08528 0.00000 -0.01612 0.00000
|
|
134 14F+2 0.00000 -0.13047 0.00000 -0.17874 0.00000
|
|
135 14F-2 0.04176 0.00000 -0.14078 0.00000 0.03074
|
|
136 14F+3 -0.18371 0.00000 0.17681 0.00000 -0.12490
|
|
137 14F-3 0.00000 0.14772 0.00000 -0.10710 0.00000
|
|
138 15G 0 0.00000 -0.00361 0.00000 0.10242 0.00000
|
|
139 15G+1 0.05894 0.00000 0.25893 0.00000 0.10122
|
|
140 15G-1 0.00000 0.06506 0.00000 0.18233 0.00000
|
|
141 15G+2 0.00000 -0.07942 0.00000 -0.28975 0.00000
|
|
142 15G-2 -0.02237 0.00000 0.21683 0.00000 0.26279
|
|
143 15G+3 -0.03617 0.00000 -0.17385 0.00000 -0.27313
|
|
144 15G-3 0.00000 -0.09569 0.00000 -0.20831 0.00000
|
|
145 15G+4 0.00000 0.11665 0.00000 0.15151 0.00000
|
|
146 15G-4 -0.04375 0.00000 -0.10507 0.00000 -0.19905
|
|
147 3 H 1S 0.05769 -0.30543 0.04093 -0.02363 0.00000
|
|
148 2S 0.66925 0.22867 -0.37463 0.21629 0.00000
|
|
149 3S -1.40662 -1.04527 0.18670 -0.10779 0.00000
|
|
150 4S -0.87970 -0.50705 -0.13355 0.07710 0.00000
|
|
151 5S 0.07937 -0.04969 0.00340 -0.00196 0.00000
|
|
152 6PX 0.10456 -0.04821 -0.01012 0.01805 0.00702
|
|
153 6PY -0.06763 0.02784 0.01805 0.01072 0.01215
|
|
154 6PZ -0.03689 0.02358 -0.00702 0.00405 0.00000
|
|
155 7PX -0.43202 0.21601 0.14674 -0.09870 0.01435
|
|
156 7PY 0.34260 -0.12472 -0.09870 0.03277 0.02485
|
|
157 7PZ 0.22711 -0.06270 -0.06368 0.03676 0.00000
|
|
158 8PX 0.50678 0.19794 -0.27625 -0.00635 -0.24533
|
|
159 8PY -0.40326 -0.11428 -0.00635 -0.28358 -0.42493
|
|
160 8PZ -1.37616 0.05269 0.55703 -0.32160 0.00000
|
|
161 9PX 0.29743 0.31793 -0.15381 -0.08061 -0.07781
|
|
162 9PY -0.26053 -0.18356 -0.08061 -0.24689 -0.13478
|
|
163 9PZ -0.45883 -0.20153 0.11478 -0.06627 0.00000
|
|
164 10D 0 0.07547 -0.09963 -0.02775 0.01602 0.00000
|
|
165 10D+1 0.07710 0.12585 0.01547 -0.06655 -0.00877
|
|
166 10D-1 -0.03193 -0.07266 -0.06655 -0.06137 -0.01519
|
|
167 10D+2 0.03516 -0.03263 -0.04860 -0.06059 0.01870
|
|
168 10D-2 0.17603 0.05651 -0.00447 -0.04860 0.01079
|
|
169 11D 0 -0.28689 0.14021 0.09273 -0.05354 0.00000
|
|
170 11D+1 0.17150 -0.14593 -0.15136 0.08361 -0.02044
|
|
171 11D-1 -0.08643 0.08425 0.08361 -0.05481 -0.03540
|
|
172 11D+2 -0.02427 -0.01145 0.06214 0.11722 0.05716
|
|
173 11D-2 -0.28507 0.01984 0.04546 0.06214 0.03300
|
|
174 12D 0 -0.13864 0.00066 0.00727 -0.00419 0.00000
|
|
175 12D+1 0.47722 0.02297 -0.19868 0.10091 -0.06940
|
|
176 12D-1 -0.39380 -0.01326 0.10091 -0.08217 -0.12021
|
|
177 12D+2 0.02046 -0.03285 0.14281 0.13083 0.19625
|
|
178 12D-2 0.11227 0.05689 -0.03407 0.14281 0.11331
|
|
179 13F 0 0.08508 0.38824 -0.11342 0.06549 0.00000
|
|
180 13F+1 0.01827 0.11217 -0.03291 0.11389 0.18740
|
|
181 13F-1 0.14049 -0.06476 0.11389 0.09860 0.32459
|
|
182 13F+2 -0.05802 -0.06045 0.06002 0.37024 0.15297
|
|
183 13F-2 0.15442 0.10470 0.30093 0.06002 0.08831
|
|
184 13F+3 -0.08221 0.00000 0.11835 0.20499 0.16163
|
|
185 13F-3 -0.07031 -0.36902 0.18168 -0.10489 0.00000
|
|
186 14F 0 -0.00432 -0.20965 0.02344 -0.01353 0.00000
|
|
187 14F+1 0.14269 -0.07386 -0.03036 -0.02468 -0.09540
|
|
188 14F-1 -0.17708 0.04264 -0.02468 -0.05886 -0.16524
|
|
189 14F+2 0.01740 0.06523 0.01643 -0.15027 -0.02662
|
|
190 14F-2 0.01163 -0.11299 -0.16925 0.01643 -0.01537
|
|
191 14F+3 0.09186 0.00000 -0.08841 -0.15312 -0.12490
|
|
192 14F-3 0.15199 0.14772 -0.09275 0.05355 0.00000
|
|
193 15G 0 0.08343 -0.00361 0.08869 -0.05121 0.00000
|
|
194 15G+1 -0.01764 0.05634 0.20148 0.03317 -0.05061
|
|
195 15G-1 0.04421 -0.03253 0.03317 0.23978 -0.08766
|
|
196 15G+2 -0.02557 0.03971 0.21936 0.09019 -0.22759
|
|
197 15G-2 0.02192 -0.06878 -0.16310 0.21936 -0.13140
|
|
198 15G+3 0.01809 0.00000 0.08693 0.15056 -0.27313
|
|
199 15G-3 -0.13338 -0.09569 -0.18040 0.10415 0.00000
|
|
200 15G+4 0.04243 -0.05832 -0.02011 0.11668 -0.17238
|
|
201 15G-4 0.02973 -0.10102 -0.13990 0.02011 0.09952
|
|
202 4 H 1S -0.05769 -0.30543 -0.04093 -0.02363 0.00000
|
|
203 2S -0.66925 0.22867 0.37463 0.21629 0.00000
|
|
204 3S 1.40662 -1.04527 -0.18670 -0.10779 0.00000
|
|
205 4S 0.87970 -0.50705 0.13355 0.07710 0.00000
|
|
206 5S -0.07937 -0.04969 -0.00340 -0.00196 0.00000
|
|
207 6PX 0.10456 0.04821 -0.01012 -0.01805 0.00702
|
|
208 6PY 0.06763 0.02784 -0.01805 0.01072 -0.01215
|
|
209 6PZ 0.03689 0.02358 0.00702 0.00405 0.00000
|
|
210 7PX -0.43202 -0.21601 0.14674 0.09870 0.01435
|
|
211 7PY -0.34260 -0.12472 0.09870 0.03277 -0.02485
|
|
212 7PZ -0.22711 -0.06270 0.06368 0.03676 0.00000
|
|
213 8PX 0.50678 -0.19794 -0.27625 0.00635 -0.24533
|
|
214 8PY 0.40326 -0.11428 0.00635 -0.28358 0.42493
|
|
215 8PZ 1.37616 0.05269 -0.55703 -0.32160 0.00000
|
|
216 9PX 0.29743 -0.31793 -0.15381 0.08061 -0.07781
|
|
217 9PY 0.26053 -0.18356 0.08061 -0.24689 0.13478
|
|
218 9PZ 0.45883 -0.20153 -0.11478 -0.06627 0.00000
|
|
219 10D 0 -0.07547 -0.09963 0.02775 0.01602 0.00000
|
|
220 10D+1 0.07710 -0.12585 0.01547 0.06655 -0.00877
|
|
221 10D-1 0.03193 -0.07266 0.06655 -0.06137 0.01519
|
|
222 10D+2 -0.03516 -0.03263 0.04860 -0.06059 -0.01870
|
|
223 10D-2 0.17603 -0.05651 -0.00447 0.04860 0.01079
|
|
224 11D 0 0.28689 0.14021 -0.09273 -0.05354 0.00000
|
|
225 11D+1 0.17150 0.14593 -0.15136 -0.08361 -0.02044
|
|
226 11D-1 0.08643 0.08425 -0.08361 -0.05481 0.03540
|
|
227 11D+2 0.02427 -0.01145 -0.06214 0.11722 -0.05716
|
|
228 11D-2 -0.28507 -0.01984 0.04546 -0.06214 0.03300
|
|
229 12D 0 0.13864 0.00066 -0.00727 -0.00419 0.00000
|
|
230 12D+1 0.47722 -0.02297 -0.19868 -0.10091 -0.06940
|
|
231 12D-1 0.39380 -0.01326 -0.10091 -0.08217 0.12021
|
|
232 12D+2 -0.02046 -0.03285 -0.14281 0.13083 -0.19625
|
|
233 12D-2 0.11227 -0.05689 -0.03407 -0.14281 0.11331
|
|
234 13F 0 -0.08508 0.38824 0.11342 0.06549 0.00000
|
|
235 13F+1 0.01827 -0.11217 -0.03291 -0.11389 0.18740
|
|
236 13F-1 -0.14049 -0.06476 -0.11389 0.09860 -0.32459
|
|
237 13F+2 0.05802 -0.06045 -0.06002 0.37024 -0.15297
|
|
238 13F-2 0.15442 -0.10470 0.30093 -0.06002 0.08831
|
|
239 13F+3 -0.08221 0.00000 0.11835 -0.20499 0.16163
|
|
240 13F-3 0.07031 -0.36902 -0.18168 -0.10489 0.00000
|
|
241 14F 0 0.00432 -0.20965 -0.02344 -0.01353 0.00000
|
|
242 14F+1 0.14269 0.07386 -0.03036 0.02468 -0.09540
|
|
243 14F-1 0.17708 0.04264 0.02468 -0.05886 0.16524
|
|
244 14F+2 -0.01740 0.06523 -0.01643 -0.15027 0.02662
|
|
245 14F-2 0.01163 0.11299 -0.16925 -0.01643 -0.01537
|
|
246 14F+3 0.09186 0.00000 -0.08841 0.15312 -0.12490
|
|
247 14F-3 -0.15199 0.14772 0.09275 0.05355 0.00000
|
|
248 15G 0 -0.08343 -0.00361 -0.08869 -0.05121 0.00000
|
|
249 15G+1 -0.01764 -0.05634 0.20148 -0.03317 -0.05061
|
|
250 15G-1 -0.04421 -0.03253 -0.03317 0.23978 0.08766
|
|
251 15G+2 0.02557 0.03971 -0.21936 0.09019 0.22759
|
|
252 15G-2 0.02192 0.06878 -0.16310 -0.21936 -0.13140
|
|
253 15G+3 0.01809 0.00000 0.08693 -0.15056 -0.27313
|
|
254 15G-3 0.13338 -0.09569 0.18040 0.10415 0.00000
|
|
255 15G+4 -0.04243 -0.05832 0.02011 0.11668 0.17238
|
|
256 15G-4 0.02973 0.10102 -0.13990 -0.02011 0.09952
|
|
161 162 163 164 165
|
|
(E)--V (E)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 12.64239 12.64239 12.67431 12.67431 12.71009
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 -0.02036
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 -0.12434
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 -0.56915
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 -0.16194
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 6.52934
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 3.74312
|
|
7 7PX 0.00000 0.11234 0.00000 0.25825 0.00000
|
|
8 7PY -0.11234 0.00000 0.25825 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.03213
|
|
10 8PX 0.00000 -0.33967 0.00000 -0.54134 0.00000
|
|
11 8PY 0.33967 0.00000 -0.54134 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.52236
|
|
13 9PX 0.00000 0.79217 0.00000 1.58834 0.00000
|
|
14 9PY -0.79217 0.00000 1.58834 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 -2.47674
|
|
16 10PX 0.00000 0.55530 0.00000 0.44033 0.00000
|
|
17 10PY -0.55530 0.00000 0.44033 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 -2.89009
|
|
19 11PX 0.00000 0.10709 0.00000 0.11488 0.00000
|
|
20 11PY -0.10709 0.00000 0.11488 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.43429
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00809
|
|
23 12D+1 0.00000 0.04197 0.00000 0.04242 0.00000
|
|
24 12D-1 -0.04197 0.00000 0.04242 0.00000 0.00000
|
|
25 12D+2 0.01175 0.00000 -0.00970 0.00000 0.00000
|
|
26 12D-2 0.00000 -0.01175 0.00000 -0.00970 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.15798
|
|
28 13D+1 0.00000 0.05833 0.00000 -0.06014 0.00000
|
|
29 13D-1 -0.05833 0.00000 -0.06014 0.00000 0.00000
|
|
30 13D+2 0.04212 0.00000 -0.16716 0.00000 0.00000
|
|
31 13D-2 0.00000 -0.04212 0.00000 -0.16716 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.59151
|
|
33 14D+1 0.00000 -0.74053 0.00000 -0.67850 0.00000
|
|
34 14D-1 0.74053 0.00000 -0.67850 0.00000 0.00000
|
|
35 14D+2 -0.09707 0.00000 0.48745 0.00000 0.00000
|
|
36 14D-2 0.00000 0.09707 0.00000 0.48745 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.38142
|
|
38 15D+1 0.00000 -0.31061 0.00000 -0.03514 0.00000
|
|
39 15D-1 0.31061 0.00000 -0.03514 0.00000 0.00000
|
|
40 15D+2 0.22340 0.00000 0.03319 0.00000 0.00000
|
|
41 15D-2 0.00000 -0.22340 0.00000 0.03319 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 -0.14701
|
|
43 16F+1 0.00000 0.00537 0.00000 0.02114 0.00000
|
|
44 16F-1 -0.00537 0.00000 0.02114 0.00000 0.00000
|
|
45 16F+2 0.04519 0.00000 -0.12441 0.00000 0.00000
|
|
46 16F-2 0.00000 -0.04519 0.00000 -0.12441 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.18156
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.45212
|
|
50 17F+1 0.00000 -0.00625 0.00000 0.11979 0.00000
|
|
51 17F-1 0.00625 0.00000 0.11979 0.00000 0.00000
|
|
52 17F+2 -0.06347 0.00000 0.16566 0.00000 0.00000
|
|
53 17F-2 0.00000 0.06347 0.00000 0.16566 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 -0.40002
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.31119
|
|
57 18F+1 0.00000 0.29578 0.00000 0.06196 0.00000
|
|
58 18F-1 -0.29578 0.00000 0.06196 0.00000 0.00000
|
|
59 18F+2 -0.10771 0.00000 -0.17453 0.00000 0.00000
|
|
60 18F-2 0.00000 0.10771 0.00000 -0.17453 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.43802
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.12068
|
|
64 19G+1 0.00000 -0.03717 0.00000 0.12434 0.00000
|
|
65 19G-1 0.03717 0.00000 0.12434 0.00000 0.00000
|
|
66 19G+2 0.11941 0.00000 0.06548 0.00000 0.00000
|
|
67 19G-2 0.00000 -0.11941 0.00000 0.06548 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 -0.21989
|
|
70 19G+4 -0.12758 0.00000 0.11405 0.00000 0.00000
|
|
71 19G-4 0.00000 -0.12758 0.00000 -0.11405 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 -0.45038
|
|
73 20G+1 0.00000 0.13502 0.00000 -0.08638 0.00000
|
|
74 20G-1 -0.13502 0.00000 -0.08638 0.00000 0.00000
|
|
75 20G+2 -0.10144 0.00000 -0.09914 0.00000 0.00000
|
|
76 20G-2 0.00000 0.10144 0.00000 -0.09914 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.31763
|
|
79 20G+4 0.06307 0.00000 0.04287 0.00000 0.00000
|
|
80 20G-4 0.00000 0.06307 0.00000 -0.04287 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 -0.03343
|
|
82 21H+1 0.00000 -0.11068 0.00000 -0.10467 0.00000
|
|
83 21H-1 0.11068 0.00000 -0.10467 0.00000 0.00000
|
|
84 21H+2 0.10625 0.00000 0.13029 0.00000 0.00000
|
|
85 21H-2 0.00000 -0.10625 0.00000 0.13029 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 -0.32789
|
|
88 21H+4 0.17699 0.00000 -0.05327 0.00000 0.00000
|
|
89 21H-4 0.00000 0.17699 0.00000 0.05327 0.00000
|
|
90 21H+5 0.00000 0.00036 0.00000 0.08795 0.00000
|
|
91 21H-5 0.00036 0.00000 -0.08795 0.00000 0.00000
|
|
92 2 H 1S 0.13639 0.00000 -0.20298 0.00000 -0.07313
|
|
93 2S 0.00283 0.00000 0.45659 0.00000 0.10438
|
|
94 3S 0.84068 0.00000 -1.06966 0.00000 -1.87673
|
|
95 4S 0.35995 0.00000 -0.56153 0.00000 -1.85761
|
|
96 5S 0.06111 0.00000 -0.07238 0.00000 -0.02113
|
|
97 6PX 0.00000 0.00896 0.00000 0.00688 0.00000
|
|
98 6PY 0.07028 0.00000 -0.04033 0.00000 -0.01859
|
|
99 6PZ -0.02161 0.00000 0.00383 0.00000 -0.02238
|
|
100 7PX 0.00000 -0.03142 0.00000 -0.02964 0.00000
|
|
101 7PY -0.23795 0.00000 0.05792 0.00000 0.11945
|
|
102 7PZ 0.14282 0.00000 0.04524 0.00000 -0.01074
|
|
103 8PX 0.00000 -0.14364 0.00000 -0.40625 0.00000
|
|
104 8PY -0.27324 0.00000 0.59451 0.00000 1.21043
|
|
105 8PZ -0.27677 0.00000 -0.04592 0.00000 0.33326
|
|
106 9PX 0.00000 0.01686 0.00000 -0.04054 0.00000
|
|
107 9PY -0.23434 0.00000 0.44928 0.00000 0.96558
|
|
108 9PZ 0.01074 0.00000 -0.15891 0.00000 0.05676
|
|
109 10D 0 0.04366 0.00000 -0.06988 0.00000 0.06906
|
|
110 10D+1 0.00000 0.03559 0.00000 0.06831 0.00000
|
|
111 10D-1 -0.03356 0.00000 0.03091 0.00000 0.14412
|
|
112 10D+2 0.03886 0.00000 -0.00286 0.00000 0.12728
|
|
113 10D-2 0.00000 -0.11098 0.00000 -0.21745 0.00000
|
|
114 11D 0 -0.14340 0.00000 0.17162 0.00000 0.20415
|
|
115 11D+1 0.00000 -0.01823 0.00000 -0.14224 0.00000
|
|
116 11D-1 0.01787 0.00000 -0.06961 0.00000 -0.18092
|
|
117 11D+2 -0.11302 0.00000 0.15567 0.00000 0.13842
|
|
118 11D-2 0.00000 0.22241 0.00000 0.36017 0.00000
|
|
119 12D 0 -0.12809 0.00000 0.10118 0.00000 0.39723
|
|
120 12D+1 0.00000 0.04823 0.00000 -0.08402 0.00000
|
|
121 12D-1 0.11805 0.00000 0.07895 0.00000 -0.06666
|
|
122 12D+2 0.00334 0.00000 0.16688 0.00000 0.35160
|
|
123 12D-2 0.00000 0.05884 0.00000 0.11723 0.00000
|
|
124 13F 0 -0.44919 0.00000 -0.10170 0.00000 -0.15284
|
|
125 13F+1 0.00000 0.61255 0.00000 -0.02191 0.00000
|
|
126 13F-1 -0.15703 0.00000 -0.00167 0.00000 -0.09990
|
|
127 13F+2 0.06394 0.00000 0.15693 0.00000 0.25617
|
|
128 13F-2 0.00000 0.22295 0.00000 -0.00587 0.00000
|
|
129 13F+3 0.00000 -0.33440 0.00000 -0.21679 0.00000
|
|
130 13F-3 0.03925 0.00000 -0.28589 0.00000 -0.18434
|
|
131 14F 0 0.17778 0.00000 0.03409 0.00000 0.10621
|
|
132 14F+1 0.00000 -0.23115 0.00000 0.00231 0.00000
|
|
133 14F-1 0.17266 0.00000 -0.08201 0.00000 -0.12905
|
|
134 14F+2 0.00126 0.00000 -0.10051 0.00000 -0.15688
|
|
135 14F-2 0.00000 -0.09879 0.00000 0.12105 0.00000
|
|
136 14F+3 0.00000 0.27050 0.00000 0.21784 0.00000
|
|
137 14F-3 -0.05148 0.00000 0.09834 0.00000 0.00944
|
|
138 15G 0 0.06793 0.00000 0.25971 0.00000 -0.33729
|
|
139 15G+1 0.00000 -0.09326 0.00000 -0.39631 0.00000
|
|
140 15G-1 0.06254 0.00000 0.09037 0.00000 -0.12091
|
|
141 15G+2 -0.11535 0.00000 -0.30642 0.00000 0.21740
|
|
142 15G-2 0.00000 -0.06057 0.00000 -0.23774 0.00000
|
|
143 15G+3 0.00000 -0.00755 0.00000 0.21323 0.00000
|
|
144 15G-3 -0.15220 0.00000 -0.16077 0.00000 0.05526
|
|
145 15G+4 0.12788 0.00000 0.06279 0.00000 -0.08985
|
|
146 15G-4 0.00000 -0.04508 0.00000 0.04707 0.00000
|
|
147 3 H 1S -0.06819 -0.11811 0.10149 -0.17578 -0.07313
|
|
148 2S -0.00142 -0.00245 -0.22829 0.39541 0.10438
|
|
149 3S -0.42034 -0.72805 0.53483 -0.92635 -1.87673
|
|
150 4S -0.17998 -0.31173 0.28076 -0.48630 -1.85761
|
|
151 5S -0.03056 -0.05292 0.03619 -0.06268 -0.02113
|
|
152 6PX -0.03431 -0.05047 0.02044 -0.02852 -0.01610
|
|
153 6PY 0.01085 0.03431 -0.00492 0.02044 0.00930
|
|
154 6PZ 0.01080 0.01871 -0.00192 0.00332 -0.02238
|
|
155 7PX 0.11664 0.17061 -0.03792 0.03603 0.10344
|
|
156 7PY -0.03592 -0.11664 -0.00775 -0.03792 -0.05972
|
|
157 7PZ -0.07141 -0.12368 -0.02262 0.03918 -0.01074
|
|
158 8PX 0.18052 0.16902 -0.43334 0.34432 1.04826
|
|
159 8PY 0.03942 -0.18052 -0.15606 -0.43334 -0.60521
|
|
160 8PZ 0.13839 0.23969 0.02296 -0.03977 0.33326
|
|
161 9PX 0.09417 0.17997 -0.21210 0.32683 0.83621
|
|
162 9PY -0.07123 -0.09417 0.08192 -0.21210 -0.48279
|
|
163 9PZ -0.00537 -0.00930 0.07946 -0.13762 0.05676
|
|
164 10D 0 -0.02183 -0.03781 0.03494 -0.06052 0.06906
|
|
165 10D+1 -0.00088 0.03407 0.01619 0.04026 0.12481
|
|
166 10D-1 -0.03508 0.00088 0.05896 0.01619 -0.07206
|
|
167 10D+2 0.09295 -0.03123 -0.16380 -0.09292 -0.06364
|
|
168 10D-2 0.03123 -0.05689 -0.09292 -0.05650 0.11023
|
|
169 11D 0 0.07170 0.12419 -0.08581 0.14863 0.20415
|
|
170 11D+1 0.00016 -0.01796 -0.03145 -0.08777 -0.15668
|
|
171 11D-1 0.01814 -0.00016 -0.12409 -0.03145 0.09046
|
|
172 11D+2 -0.19506 0.04737 0.30904 0.08855 -0.06921
|
|
173 11D-2 -0.04737 0.14037 0.08855 0.20680 0.11988
|
|
174 12D 0 0.06404 0.11093 -0.05059 0.08762 0.39723
|
|
175 12D+1 -0.07200 -0.07648 -0.07057 0.03821 -0.05773
|
|
176 12D-1 -0.00666 0.07200 -0.04328 -0.07057 0.03333
|
|
177 12D+2 -0.04329 0.02692 0.12965 -0.02150 -0.17580
|
|
178 12D-2 -0.02692 0.01221 -0.02150 0.15447 0.30449
|
|
179 13F 0 0.22460 0.38901 0.05085 -0.08808 -0.15284
|
|
180 13F+1 -0.19725 0.27091 -0.00877 -0.00673 -0.08651
|
|
181 13F-1 -0.49867 0.19725 -0.01685 -0.00877 0.04995
|
|
182 13F+2 -0.15123 0.12423 0.03483 -0.07049 -0.12808
|
|
183 13F-2 -0.12423 0.00778 -0.07049 0.11623 0.22185
|
|
184 13F+3 -0.28960 0.16720 0.18775 0.10840 0.00000
|
|
185 13F-3 -0.01963 -0.03399 0.14294 -0.24759 -0.18434
|
|
186 14F 0 -0.08889 -0.15397 -0.01705 0.02953 0.10621
|
|
187 14F+1 0.02533 -0.18728 0.03651 -0.06093 -0.11176
|
|
188 14F-1 0.21653 -0.02533 -0.01877 0.03651 0.06452
|
|
189 14F+2 0.07441 -0.04223 0.06566 0.09594 0.07844
|
|
190 14F-2 0.04223 -0.02564 0.09594 -0.04512 -0.13586
|
|
191 14F+3 0.23426 -0.13525 -0.18865 -0.10892 0.00000
|
|
192 14F-3 0.02574 0.04458 -0.04917 0.08516 0.00944
|
|
193 15G 0 -0.03397 -0.05883 -0.12985 0.22491 -0.33729
|
|
194 15G+1 0.01330 -0.07022 -0.21074 -0.03130 -0.10471
|
|
195 15G-1 0.08558 -0.01330 -0.27464 -0.21074 0.06046
|
|
196 15G+2 0.01659 -0.07617 -0.25491 0.02974 -0.10870
|
|
197 15G-2 0.07617 0.07137 0.02974 -0.28925 0.18828
|
|
198 15G+3 -0.00654 0.00378 -0.18466 -0.10661 0.00000
|
|
199 15G-3 0.07610 0.13181 0.08039 -0.13923 0.05526
|
|
200 15G+4 -0.00184 0.07490 -0.01961 -0.04757 0.04493
|
|
201 15G-4 0.07490 0.08464 0.04757 -0.03532 0.07782
|
|
202 4 H 1S -0.06819 0.11811 0.10149 0.17578 -0.07313
|
|
203 2S -0.00142 0.00245 -0.22829 -0.39541 0.10438
|
|
204 3S -0.42034 0.72805 0.53483 0.92635 -1.87673
|
|
205 4S -0.17998 0.31173 0.28076 0.48630 -1.85761
|
|
206 5S -0.03056 0.05292 0.03619 0.06268 -0.02113
|
|
207 6PX 0.03431 -0.05047 -0.02044 -0.02852 0.01610
|
|
208 6PY 0.01085 -0.03431 -0.00492 -0.02044 0.00930
|
|
209 6PZ 0.01080 -0.01871 -0.00192 -0.00332 -0.02238
|
|
210 7PX -0.11664 0.17061 0.03792 0.03603 -0.10344
|
|
211 7PY -0.03592 0.11664 -0.00775 0.03792 -0.05972
|
|
212 7PZ -0.07141 0.12368 -0.02262 -0.03918 -0.01074
|
|
213 8PX -0.18052 0.16902 0.43334 0.34432 -1.04826
|
|
214 8PY 0.03942 0.18052 -0.15606 0.43334 -0.60521
|
|
215 8PZ 0.13839 -0.23969 0.02296 0.03977 0.33326
|
|
216 9PX -0.09417 0.17997 0.21210 0.32683 -0.83621
|
|
217 9PY -0.07123 0.09417 0.08192 0.21210 -0.48279
|
|
218 9PZ -0.00537 0.00930 0.07946 0.13762 0.05676
|
|
219 10D 0 -0.02183 0.03781 0.03494 0.06052 0.06906
|
|
220 10D+1 0.00088 0.03407 -0.01619 0.04026 -0.12481
|
|
221 10D-1 -0.03508 -0.00088 0.05896 -0.01619 -0.07206
|
|
222 10D+2 0.09295 0.03123 -0.16380 0.09292 -0.06364
|
|
223 10D-2 -0.03123 -0.05689 0.09292 -0.05650 -0.11023
|
|
224 11D 0 0.07170 -0.12419 -0.08581 -0.14863 0.20415
|
|
225 11D+1 -0.00016 -0.01796 0.03145 -0.08777 0.15668
|
|
226 11D-1 0.01814 0.00016 -0.12409 0.03145 0.09046
|
|
227 11D+2 -0.19506 -0.04737 0.30904 -0.08855 -0.06921
|
|
228 11D-2 0.04737 0.14037 -0.08855 0.20680 -0.11988
|
|
229 12D 0 0.06404 -0.11093 -0.05059 -0.08762 0.39723
|
|
230 12D+1 0.07200 -0.07648 0.07057 0.03821 0.05773
|
|
231 12D-1 -0.00666 -0.07200 -0.04328 0.07057 0.03333
|
|
232 12D+2 -0.04329 -0.02692 0.12965 0.02150 -0.17580
|
|
233 12D-2 0.02692 0.01221 0.02150 0.15447 -0.30449
|
|
234 13F 0 0.22460 -0.38901 0.05085 0.08808 -0.15284
|
|
235 13F+1 0.19725 0.27091 0.00877 -0.00673 0.08651
|
|
236 13F-1 -0.49867 -0.19725 -0.01685 0.00877 0.04995
|
|
237 13F+2 -0.15123 -0.12423 0.03483 0.07049 -0.12808
|
|
238 13F-2 0.12423 0.00778 0.07049 0.11623 -0.22185
|
|
239 13F+3 0.28960 0.16720 -0.18775 0.10840 0.00000
|
|
240 13F-3 -0.01963 0.03399 0.14294 0.24759 -0.18434
|
|
241 14F 0 -0.08889 0.15397 -0.01705 -0.02953 0.10621
|
|
242 14F+1 -0.02533 -0.18728 -0.03651 -0.06093 0.11176
|
|
243 14F-1 0.21653 0.02533 -0.01877 -0.03651 0.06452
|
|
244 14F+2 0.07441 0.04223 0.06566 -0.09594 0.07844
|
|
245 14F-2 -0.04223 -0.02564 -0.09594 -0.04512 0.13586
|
|
246 14F+3 -0.23426 -0.13525 0.18865 -0.10892 0.00000
|
|
247 14F-3 0.02574 -0.04458 -0.04917 -0.08516 0.00944
|
|
248 15G 0 -0.03397 0.05883 -0.12985 -0.22491 -0.33729
|
|
249 15G+1 -0.01330 -0.07022 0.21074 -0.03130 0.10471
|
|
250 15G-1 0.08558 0.01330 -0.27464 0.21074 0.06046
|
|
251 15G+2 0.01659 0.07617 -0.25491 -0.02974 -0.10870
|
|
252 15G-2 -0.07617 0.07137 -0.02974 -0.28925 -0.18828
|
|
253 15G+3 0.00654 0.00378 0.18466 -0.10661 0.00000
|
|
254 15G-3 0.07610 -0.13181 0.08039 0.13923 0.05526
|
|
255 15G+4 -0.00184 -0.07490 -0.01961 0.04757 0.04493
|
|
256 15G-4 -0.07490 0.08464 -0.04757 -0.03532 -0.07782
|
|
166 167 168 169 170
|
|
(E)--V (E)--V (A1)--V (A2)--V (E)--V
|
|
Eigenvalues -- 12.76369 12.76369 12.77835 12.79805 12.95010
|
|
1 1 N 1S 0.00000 0.00000 -0.02441 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 -0.01373 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 -0.07109 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 -1.04996 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 5.59924 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 2.85108 0.00000 0.00000
|
|
7 7PX 0.00000 0.55086 0.00000 0.00000 0.00000
|
|
8 7PY 0.55086 0.00000 0.00000 0.00000 0.32606
|
|
9 7PZ 0.00000 0.00000 -0.19810 0.00000 0.00000
|
|
10 8PX 0.00000 -1.43824 0.00000 0.00000 0.00000
|
|
11 8PY -1.43824 0.00000 0.00000 0.00000 -0.62305
|
|
12 8PZ 0.00000 0.00000 0.68310 0.00000 0.00000
|
|
13 9PX 0.00000 2.90939 0.00000 0.00000 0.00000
|
|
14 9PY 2.90939 0.00000 0.00000 0.00000 2.25642
|
|
15 9PZ 0.00000 0.00000 -2.08958 0.00000 0.00000
|
|
16 10PX 0.00000 3.50182 0.00000 0.00000 0.00000
|
|
17 10PY 3.50182 0.00000 0.00000 0.00000 -0.27905
|
|
18 10PZ 0.00000 0.00000 -2.47852 0.00000 0.00000
|
|
19 11PX 0.00000 0.42918 0.00000 0.00000 0.00000
|
|
20 11PY 0.42918 0.00000 0.00000 0.00000 0.05475
|
|
21 11PZ 0.00000 0.00000 -0.36252 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 -0.01201 0.00000 0.00000
|
|
23 12D+1 0.00000 0.06723 0.00000 0.00000 0.00000
|
|
24 12D-1 0.06723 0.00000 0.00000 0.00000 0.03731
|
|
25 12D+2 0.01670 0.00000 0.00000 0.00000 0.00866
|
|
26 12D-2 0.00000 0.01670 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 -0.12255 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00634 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00634 0.00000 0.00000 0.00000 -0.05020
|
|
30 13D+2 -0.22369 0.00000 0.00000 0.00000 -0.16994
|
|
31 13D-2 0.00000 -0.22369 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.63175 0.00000 0.00000
|
|
33 14D+1 0.00000 -1.43650 0.00000 0.00000 0.00000
|
|
34 14D-1 -1.43650 0.00000 0.00000 0.00000 -0.91217
|
|
35 14D+2 0.75974 0.00000 0.00000 0.00000 0.15225
|
|
36 14D-2 0.00000 0.75974 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.52315 0.00000 0.00000
|
|
38 15D+1 0.00000 -1.09377 0.00000 0.00000 0.00000
|
|
39 15D-1 -1.09377 0.00000 0.00000 0.00000 0.10226
|
|
40 15D+2 0.06429 0.00000 0.00000 0.00000 0.13570
|
|
41 15D-2 0.00000 0.06429 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 -0.07290 0.00000 0.00000
|
|
43 16F+1 0.00000 -0.00457 0.00000 0.00000 0.00000
|
|
44 16F-1 -0.00457 0.00000 0.00000 0.00000 -0.02741
|
|
45 16F+2 -0.20442 0.00000 0.00000 0.00000 -0.03748
|
|
46 16F-2 0.00000 -0.20442 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 -0.02378 0.00000
|
|
48 16F-3 0.00000 0.00000 0.16246 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.34543 0.00000 0.00000
|
|
50 17F+1 0.00000 0.05121 0.00000 0.00000 0.00000
|
|
51 17F-1 0.05121 0.00000 0.00000 0.00000 0.15681
|
|
52 17F+2 0.34779 0.00000 0.00000 0.00000 0.18270
|
|
53 17F-2 0.00000 0.34779 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.23703 0.00000
|
|
55 17F-3 0.00000 0.00000 -0.27283 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 -0.13517 0.00000 0.00000
|
|
57 18F+1 0.00000 -0.02775 0.00000 0.00000 0.00000
|
|
58 18F-1 -0.02775 0.00000 0.00000 0.00000 0.12752
|
|
59 18F+2 -0.28880 0.00000 0.00000 0.00000 -0.19800
|
|
60 18F-2 0.00000 -0.28880 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 -0.33304 0.00000
|
|
62 18F-3 0.00000 0.00000 -0.00096 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.12098 0.00000 0.00000
|
|
64 19G+1 0.00000 0.02813 0.00000 0.00000 0.00000
|
|
65 19G-1 0.02813 0.00000 0.00000 0.00000 0.05058
|
|
66 19G+2 0.12101 0.00000 0.00000 0.00000 0.10021
|
|
67 19G-2 0.00000 0.12101 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.16036 0.00000
|
|
69 19G-3 0.00000 0.00000 -0.06881 0.00000 0.00000
|
|
70 19G+4 0.10731 0.00000 0.00000 0.00000 0.21511
|
|
71 19G-4 0.00000 -0.10731 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 -0.28059 0.00000 0.00000
|
|
73 20G+1 0.00000 0.24662 0.00000 0.00000 0.00000
|
|
74 20G-1 0.24662 0.00000 0.00000 0.00000 0.03113
|
|
75 20G+2 -0.22844 0.00000 0.00000 0.00000 -0.16455
|
|
76 20G-2 0.00000 -0.22844 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 -0.12901 0.00000
|
|
78 20G-3 0.00000 0.00000 0.30731 0.00000 0.00000
|
|
79 20G+4 0.35999 0.00000 0.00000 0.00000 -0.16389
|
|
80 20G-4 0.00000 -0.35999 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.09652 0.00000 0.00000
|
|
82 21H+1 0.00000 -0.15807 0.00000 0.00000 0.00000
|
|
83 21H-1 -0.15807 0.00000 0.00000 0.00000 -0.03152
|
|
84 21H+2 -0.11110 0.00000 0.00000 0.00000 -0.01066
|
|
85 21H-2 0.00000 -0.11110 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.23716 0.00000
|
|
87 21H-3 0.00000 0.00000 -0.06385 0.00000 0.00000
|
|
88 21H+4 -0.23218 0.00000 0.00000 0.00000 -0.05479
|
|
89 21H-4 0.00000 0.23218 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00910 0.00000 0.00000 0.00000
|
|
91 21H-5 -0.00910 0.00000 0.00000 0.00000 -0.09128
|
|
92 2 H 1S -0.35808 0.00000 -0.08825 0.00000 -0.14929
|
|
93 2S 0.09634 0.00000 0.12512 0.00000 0.48268
|
|
94 3S -2.48572 0.00000 -1.59596 0.00000 -1.34962
|
|
95 4S -1.44974 0.00000 -1.38287 0.00000 -0.48808
|
|
96 5S -0.08823 0.00000 -0.01991 0.00000 -0.08956
|
|
97 6PX 0.00000 0.04717 0.00000 -0.00791 0.00000
|
|
98 6PY -0.13306 0.00000 -0.01225 0.00000 -0.05864
|
|
99 6PZ 0.06001 0.00000 -0.00147 0.00000 0.02439
|
|
100 7PX 0.00000 0.07106 0.00000 0.02956 0.00000
|
|
101 7PY 0.59168 0.00000 0.06832 0.00000 0.01097
|
|
102 7PZ -0.20944 0.00000 -0.06100 0.00000 0.01783
|
|
103 8PX 0.00000 -1.33718 0.00000 -0.05727 0.00000
|
|
104 8PY 0.50501 0.00000 0.94060 0.00000 1.08937
|
|
105 8PZ 0.03342 0.00000 0.28350 0.00000 -0.12537
|
|
106 9PX 0.00000 -0.69787 0.00000 0.03419 0.00000
|
|
107 9PY 0.64280 0.00000 0.74803 0.00000 0.59814
|
|
108 9PZ -0.25840 0.00000 0.13534 0.00000 -0.07090
|
|
109 10D 0 0.04180 0.00000 0.16801 0.00000 0.05191
|
|
110 10D+1 0.00000 -0.10803 0.00000 0.10473 0.00000
|
|
111 10D-1 0.01379 0.00000 0.08019 0.00000 -0.05119
|
|
112 10D+2 0.05239 0.00000 0.05566 0.00000 0.04218
|
|
113 10D-2 0.00000 -0.14925 0.00000 -0.03705 0.00000
|
|
114 11D 0 0.15101 0.00000 0.02762 0.00000 0.13713
|
|
115 11D+1 0.00000 -0.11565 0.00000 -0.09823 0.00000
|
|
116 11D-1 0.02293 0.00000 -0.12043 0.00000 0.07929
|
|
117 11D+2 0.18307 0.00000 0.12624 0.00000 0.15214
|
|
118 11D-2 0.00000 0.45586 0.00000 -0.02635 0.00000
|
|
119 12D 0 0.00639 0.00000 0.21032 0.00000 0.30099
|
|
120 12D+1 0.00000 -0.31399 0.00000 -0.06961 0.00000
|
|
121 12D-1 -0.12873 0.00000 -0.22140 0.00000 0.10744
|
|
122 12D+2 -0.11315 0.00000 0.33713 0.00000 0.37301
|
|
123 12D-2 0.00000 0.76292 0.00000 -0.08383 0.00000
|
|
124 13F 0 0.03652 0.00000 -0.03817 0.00000 0.46107
|
|
125 13F+1 0.00000 -0.28856 0.00000 0.30765 0.00000
|
|
126 13F-1 -0.21701 0.00000 -0.27366 0.00000 0.09370
|
|
127 13F+2 0.57987 0.00000 0.45377 0.00000 -0.40330
|
|
128 13F-2 0.00000 -0.03481 0.00000 0.00410 0.00000
|
|
129 13F+3 0.00000 -0.19174 0.00000 -0.19308 0.00000
|
|
130 13F-3 -0.21497 0.00000 0.15780 0.00000 -0.25812
|
|
131 14F 0 -0.05749 0.00000 -0.04368 0.00000 -0.18292
|
|
132 14F+1 0.00000 0.14900 0.00000 -0.21704 0.00000
|
|
133 14F-1 0.02819 0.00000 0.03004 0.00000 -0.18608
|
|
134 14F+2 -0.36751 0.00000 -0.30253 0.00000 0.22211
|
|
135 14F-2 0.00000 0.26638 0.00000 0.03669 0.00000
|
|
136 14F+3 0.00000 0.36828 0.00000 0.01341 0.00000
|
|
137 14F-3 0.14984 0.00000 -0.16894 0.00000 0.09084
|
|
138 15G 0 -0.19286 0.00000 0.13602 0.00000 0.03949
|
|
139 15G+1 0.00000 0.10810 0.00000 0.44458 0.00000
|
|
140 15G-1 -0.14684 0.00000 0.03268 0.00000 0.01996
|
|
141 15G+2 0.16296 0.00000 -0.24492 0.00000 -0.14767
|
|
142 15G-2 0.00000 0.07951 0.00000 0.08697 0.00000
|
|
143 15G+3 0.00000 -0.02179 0.00000 -0.12558 0.00000
|
|
144 15G-3 0.13494 0.00000 -0.10194 0.00000 -0.25927
|
|
145 15G+4 -0.12694 0.00000 -0.00654 0.00000 0.03813
|
|
146 15G-4 0.00000 -0.10395 0.00000 -0.00122 0.00000
|
|
147 3 H 1S 0.17904 -0.31010 -0.08825 0.00000 0.07464
|
|
148 2S -0.04817 0.08343 0.12512 0.00000 -0.24134
|
|
149 3S 1.24286 -2.15269 -1.59596 0.00000 0.67481
|
|
150 4S 0.72487 -1.25551 -1.38287 0.00000 0.24404
|
|
151 5S 0.04411 -0.07641 -0.01991 0.00000 0.04478
|
|
152 6PX 0.07804 -0.08800 -0.01060 0.00396 0.02471
|
|
153 6PY 0.00212 0.07804 0.00612 0.00685 -0.01583
|
|
154 6PZ -0.03001 0.05197 -0.00147 0.00000 -0.01219
|
|
155 7PX -0.22543 0.46153 0.05916 -0.01478 -0.00774
|
|
156 7PY 0.20122 -0.22543 -0.03416 -0.02560 -0.00243
|
|
157 7PZ 0.10472 -0.18138 -0.06100 0.00000 -0.00892
|
|
158 8PX -0.79769 0.04447 0.81458 0.02864 -0.58760
|
|
159 8PY -0.87663 -0.79769 -0.47030 0.04960 0.07161
|
|
160 8PZ -0.01671 0.02894 0.28350 0.00000 0.06269
|
|
161 9PX -0.58053 0.30763 0.64781 -0.01709 -0.20629
|
|
162 9PY -0.36270 -0.58053 -0.37402 -0.02961 0.24084
|
|
163 9PZ 0.12920 -0.22378 0.13534 0.00000 0.03545
|
|
164 10D 0 -0.02090 0.03620 0.16801 0.00000 -0.02595
|
|
165 10D+1 -0.05275 -0.01667 0.06945 -0.05237 0.06879
|
|
166 10D-1 -0.07758 -0.05275 -0.04009 -0.09070 0.06795
|
|
167 10D+2 -0.09884 -0.08731 -0.02783 0.03209 -0.09797
|
|
168 10D-2 -0.08731 0.00198 0.04820 0.01853 -0.08091
|
|
169 11D 0 -0.07551 0.13078 0.02762 0.00000 -0.06856
|
|
170 11D+1 -0.06000 -0.01172 -0.10429 0.04912 -0.08788
|
|
171 11D-1 -0.08100 -0.06000 0.06021 0.08507 -0.07291
|
|
172 11D+2 0.38766 0.11812 -0.06312 0.02282 0.23924
|
|
173 11D-2 0.11812 0.25126 0.10933 0.01317 0.05028
|
|
174 12D 0 -0.00319 0.00553 0.21032 0.00000 -0.15049
|
|
175 12D+1 -0.08022 -0.17505 -0.19173 0.03480 -0.06366
|
|
176 12D-1 -0.26768 -0.08022 0.11070 0.06028 -0.00281
|
|
177 12D+2 0.54390 0.37935 -0.16856 0.07260 0.10959
|
|
178 12D-2 0.37935 0.10587 0.29196 0.04191 -0.15209
|
|
179 13F 0 -0.01826 0.03163 -0.03817 0.00000 -0.23054
|
|
180 13F+1 -0.03098 -0.23490 -0.23699 -0.15383 -0.16284
|
|
181 13F-1 -0.27068 -0.03098 0.13683 -0.26643 -0.18835
|
|
182 13F+2 0.11886 -0.26617 -0.22688 -0.00355 -0.21185
|
|
183 13F-2 -0.26617 0.42620 0.39297 -0.00205 0.11054
|
|
184 13F+3 0.16605 0.09587 0.00000 -0.19308 0.10204
|
|
185 13F-3 0.10749 -0.18617 0.15780 0.00000 0.12906
|
|
186 14F 0 0.02874 -0.04979 -0.04368 0.00000 0.09146
|
|
187 14F+1 0.05231 0.05839 0.02601 0.10852 0.15310
|
|
188 14F-1 0.11879 0.05231 -0.01502 0.18796 0.07911
|
|
189 14F+2 0.10791 0.27448 0.15127 -0.03178 0.17840
|
|
190 14F-2 0.27448 -0.20904 -0.26200 -0.01835 -0.02523
|
|
191 14F+3 -0.31894 -0.18414 0.00000 0.01341 -0.13619
|
|
192 14F-3 -0.07492 0.12976 -0.16894 0.00000 -0.04542
|
|
193 15G 0 0.09643 -0.16702 0.13602 0.00000 -0.01975
|
|
194 15G+1 0.11039 -0.08310 0.02830 -0.22229 0.12334
|
|
195 15G-1 0.04436 0.11039 -0.01634 -0.38501 0.23360
|
|
196 15G+2 0.10037 -0.03614 0.12246 -0.07531 -0.01038
|
|
197 15G-2 -0.03614 0.14210 -0.21211 -0.04348 0.07926
|
|
198 15G+3 0.01887 0.01090 0.00000 -0.12558 0.12226
|
|
199 15G-3 -0.06747 0.11686 -0.10194 0.00000 0.12964
|
|
200 15G+4 0.04623 0.09998 0.00327 -0.00106 0.08323
|
|
201 15G-4 -0.09998 0.06922 0.00566 0.00061 -0.02604
|
|
202 4 H 1S 0.17904 0.31010 -0.08825 0.00000 0.07464
|
|
203 2S -0.04817 -0.08343 0.12512 0.00000 -0.24134
|
|
204 3S 1.24286 2.15269 -1.59596 0.00000 0.67481
|
|
205 4S 0.72487 1.25551 -1.38287 0.00000 0.24404
|
|
206 5S 0.04411 0.07641 -0.01991 0.00000 0.04478
|
|
207 6PX -0.07804 -0.08800 0.01060 0.00396 -0.02471
|
|
208 6PY 0.00212 -0.07804 0.00612 -0.00685 -0.01583
|
|
209 6PZ -0.03001 -0.05197 -0.00147 0.00000 -0.01219
|
|
210 7PX 0.22543 0.46153 -0.05916 -0.01478 0.00774
|
|
211 7PY 0.20122 0.22543 -0.03416 0.02560 -0.00243
|
|
212 7PZ 0.10472 0.18138 -0.06100 0.00000 -0.00892
|
|
213 8PX 0.79769 0.04447 -0.81458 0.02864 0.58760
|
|
214 8PY -0.87663 0.79769 -0.47030 -0.04960 0.07161
|
|
215 8PZ -0.01671 -0.02894 0.28350 0.00000 0.06269
|
|
216 9PX 0.58053 0.30763 -0.64781 -0.01709 0.20629
|
|
217 9PY -0.36270 0.58053 -0.37402 0.02961 0.24084
|
|
218 9PZ 0.12920 0.22378 0.13534 0.00000 0.03545
|
|
219 10D 0 -0.02090 -0.03620 0.16801 0.00000 -0.02595
|
|
220 10D+1 0.05275 -0.01667 -0.06945 -0.05237 -0.06879
|
|
221 10D-1 -0.07758 0.05275 -0.04009 0.09070 0.06795
|
|
222 10D+2 -0.09884 0.08731 -0.02783 -0.03209 -0.09797
|
|
223 10D-2 0.08731 0.00198 -0.04820 0.01853 0.08091
|
|
224 11D 0 -0.07551 -0.13078 0.02762 0.00000 -0.06856
|
|
225 11D+1 0.06000 -0.01172 0.10429 0.04912 0.08788
|
|
226 11D-1 -0.08100 0.06000 0.06021 -0.08507 -0.07291
|
|
227 11D+2 0.38766 -0.11812 -0.06312 -0.02282 0.23924
|
|
228 11D-2 -0.11812 0.25126 -0.10933 0.01317 -0.05028
|
|
229 12D 0 -0.00319 -0.00553 0.21032 0.00000 -0.15049
|
|
230 12D+1 0.08022 -0.17505 0.19173 0.03480 0.06366
|
|
231 12D-1 -0.26768 0.08022 0.11070 -0.06028 -0.00281
|
|
232 12D+2 0.54390 -0.37935 -0.16856 -0.07260 0.10959
|
|
233 12D-2 -0.37935 0.10587 -0.29196 0.04191 0.15209
|
|
234 13F 0 -0.01826 -0.03163 -0.03817 0.00000 -0.23054
|
|
235 13F+1 0.03098 -0.23490 0.23699 -0.15383 0.16284
|
|
236 13F-1 -0.27068 0.03098 0.13683 0.26643 -0.18835
|
|
237 13F+2 0.11886 0.26617 -0.22688 0.00355 -0.21185
|
|
238 13F-2 0.26617 0.42620 -0.39297 -0.00205 -0.11054
|
|
239 13F+3 -0.16605 0.09587 0.00000 -0.19308 -0.10204
|
|
240 13F-3 0.10749 0.18617 0.15780 0.00000 0.12906
|
|
241 14F 0 0.02874 0.04979 -0.04368 0.00000 0.09146
|
|
242 14F+1 -0.05231 0.05839 -0.02601 0.10852 -0.15310
|
|
243 14F-1 0.11879 -0.05231 -0.01502 -0.18796 0.07911
|
|
244 14F+2 0.10791 -0.27448 0.15127 0.03178 0.17840
|
|
245 14F-2 -0.27448 -0.20904 0.26200 -0.01835 0.02523
|
|
246 14F+3 0.31894 -0.18414 0.00000 0.01341 0.13619
|
|
247 14F-3 -0.07492 -0.12976 -0.16894 0.00000 -0.04542
|
|
248 15G 0 0.09643 0.16702 0.13602 0.00000 -0.01975
|
|
249 15G+1 -0.11039 -0.08310 -0.02830 -0.22229 -0.12334
|
|
250 15G-1 0.04436 -0.11039 -0.01634 0.38501 0.23360
|
|
251 15G+2 0.10037 0.03614 0.12246 0.07531 -0.01038
|
|
252 15G-2 0.03614 0.14210 0.21211 -0.04348 -0.07926
|
|
253 15G+3 -0.01887 0.01090 0.00000 -0.12558 -0.12226
|
|
254 15G-3 -0.06747 -0.11686 -0.10194 0.00000 0.12964
|
|
255 15G+4 0.04623 -0.09998 0.00327 0.00106 0.08323
|
|
256 15G-4 0.09998 0.06922 -0.00566 0.00061 0.02604
|
|
171 172 173 174 175
|
|
(E)--V (E)--V (E)--V (A2)--V (A1)--V
|
|
Eigenvalues -- 12.95010 13.18240 13.18240 13.26171 13.31804
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 -0.01154
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 0.01794
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 -0.10728
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 0.04766
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 4.42175
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 1.78356
|
|
7 7PX 0.32606 0.00000 -0.10544 0.00000 0.00000
|
|
8 7PY 0.00000 -0.10544 0.00000 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.34044
|
|
10 8PX -0.62305 0.00000 -0.22593 0.00000 0.00000
|
|
11 8PY 0.00000 -0.22593 0.00000 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.29879
|
|
13 9PX 2.25642 0.00000 -0.78250 0.00000 0.00000
|
|
14 9PY 0.00000 -0.78250 0.00000 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 -0.38068
|
|
16 10PX -0.27905 0.00000 -0.23728 0.00000 0.00000
|
|
17 10PY 0.00000 -0.23728 0.00000 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 -0.37694
|
|
19 11PX 0.05475 0.00000 -0.26551 0.00000 0.00000
|
|
20 11PY 0.00000 -0.26551 0.00000 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.21034
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.01781
|
|
23 12D+1 0.03731 0.00000 -0.02417 0.00000 0.00000
|
|
24 12D-1 0.00000 -0.02417 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 -0.06435 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00866 0.00000 -0.06435 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.03910
|
|
28 13D+1 -0.05020 0.00000 0.08225 0.00000 0.00000
|
|
29 13D-1 0.00000 0.08225 0.00000 0.00000 0.00000
|
|
30 13D+2 0.00000 0.06724 0.00000 0.00000 0.00000
|
|
31 13D-2 -0.16994 0.00000 0.06724 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 -1.19928
|
|
33 14D+1 -0.91217 0.00000 0.51754 0.00000 0.00000
|
|
34 14D-1 0.00000 0.51754 0.00000 0.00000 0.00000
|
|
35 14D+2 0.00000 1.27924 0.00000 0.00000 0.00000
|
|
36 14D-2 0.15225 0.00000 1.27924 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 -0.46772
|
|
38 15D+1 0.10226 0.00000 0.32944 0.00000 0.00000
|
|
39 15D-1 0.00000 0.32944 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 0.58150 0.00000 0.00000 0.00000
|
|
41 15D-2 0.13570 0.00000 0.58150 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 -0.07930
|
|
43 16F+1 -0.02741 0.00000 0.07026 0.00000 0.00000
|
|
44 16F-1 0.00000 0.07026 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.04106 0.00000 0.00000 0.00000
|
|
46 16F-2 -0.03748 0.00000 0.04106 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 -0.07166 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.03034
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 -0.01292
|
|
50 17F+1 0.15681 0.00000 -0.41046 0.00000 0.00000
|
|
51 17F-1 0.00000 -0.41046 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 -0.50795 0.00000 0.00000 0.00000
|
|
53 17F-2 0.18270 0.00000 -0.50795 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.33194 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 -0.36813
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.18423
|
|
57 18F+1 0.12752 0.00000 -0.36183 0.00000 0.00000
|
|
58 18F-1 0.00000 -0.36183 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 -0.81125 0.00000 0.00000 0.00000
|
|
60 18F-2 -0.19800 0.00000 -0.81125 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.53863 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.30602
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 -0.52800
|
|
64 19G+1 0.05058 0.00000 -0.23881 0.00000 0.00000
|
|
65 19G-1 0.00000 -0.23881 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 -0.15570 0.00000 0.00000 0.00000
|
|
67 19G-2 0.10021 0.00000 -0.15570 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.08309 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.13090
|
|
70 19G+4 0.00000 -0.38974 0.00000 0.00000 0.00000
|
|
71 19G-4 -0.21511 0.00000 0.38974 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.80818
|
|
73 20G+1 0.03113 0.00000 0.38418 0.00000 0.00000
|
|
74 20G-1 0.00000 0.38418 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.40730 0.00000 0.00000 0.00000
|
|
76 20G-2 -0.16455 0.00000 0.40730 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 -0.14671 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 -0.27408
|
|
79 20G+4 0.00000 0.92027 0.00000 0.00000 0.00000
|
|
80 20G-4 0.16389 0.00000 -0.92027 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 -0.05107
|
|
82 21H+1 -0.03152 0.00000 0.07349 0.00000 0.00000
|
|
83 21H-1 0.00000 0.07349 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.04535 0.00000 0.00000 0.00000
|
|
85 21H-2 -0.01066 0.00000 0.04535 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.10934 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.39261
|
|
88 21H+4 0.00000 -0.16747 0.00000 0.00000 0.00000
|
|
89 21H-4 0.05479 0.00000 0.16747 0.00000 0.00000
|
|
90 21H+5 0.09128 0.00000 0.11015 0.00000 0.00000
|
|
91 21H-5 0.00000 -0.11015 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.25007 0.00000 0.00000 -0.07141
|
|
93 2S 0.00000 -1.15774 0.00000 0.00000 0.49808
|
|
94 3S 0.00000 3.34986 0.00000 0.00000 -1.56692
|
|
95 4S 0.00000 0.70259 0.00000 0.00000 -0.91927
|
|
96 5S 0.00000 0.23786 0.00000 0.00000 -0.02242
|
|
97 6PX -0.00157 0.00000 -0.01601 -0.00800 0.00000
|
|
98 6PY 0.00000 0.08047 0.00000 0.00000 -0.05211
|
|
99 6PZ 0.00000 -0.07594 0.00000 0.00000 -0.01398
|
|
100 7PX -0.00690 0.00000 -0.14403 -0.04529 0.00000
|
|
101 7PY 0.00000 0.19844 0.00000 0.00000 -0.14631
|
|
102 7PZ 0.00000 -0.13368 0.00000 0.00000 -0.11153
|
|
103 8PX -0.26765 0.00000 -1.11399 0.53721 0.00000
|
|
104 8PY 0.00000 -2.00618 0.00000 0.00000 0.63322
|
|
105 8PZ 0.00000 -0.08314 0.00000 0.00000 -0.73017
|
|
106 9PX 0.12174 0.00000 -0.21804 0.20724 0.00000
|
|
107 9PY 0.00000 -0.78228 0.00000 0.00000 0.48447
|
|
108 9PZ 0.00000 0.12993 0.00000 0.00000 -0.22771
|
|
109 10D 0 0.00000 -0.15109 0.00000 0.00000 -0.18848
|
|
110 10D+1 0.10767 0.00000 -0.21701 0.22988 0.00000
|
|
111 10D-1 0.00000 0.36952 0.00000 0.00000 -0.03337
|
|
112 10D+2 0.00000 0.01767 0.00000 0.00000 0.02908
|
|
113 10D-2 -0.14469 0.00000 -0.06946 -0.10195 0.00000
|
|
114 11D 0 0.00000 -0.21479 0.00000 0.00000 -0.07900
|
|
115 11D+1 -0.12365 0.00000 -0.09783 -0.13427 0.00000
|
|
116 11D-1 0.00000 -0.22324 0.00000 0.00000 0.37762
|
|
117 11D+2 0.00000 -0.33723 0.00000 0.00000 -0.08302
|
|
118 11D-2 0.26827 0.00000 0.56522 -0.04042 0.00000
|
|
119 12D 0 0.00000 -0.48138 0.00000 0.00000 0.17904
|
|
120 12D+1 -0.03957 0.00000 -0.12248 0.19935 0.00000
|
|
121 12D-1 0.00000 -0.07976 0.00000 0.00000 0.24343
|
|
122 12D+2 0.00000 -0.60167 0.00000 0.00000 0.05228
|
|
123 12D-2 0.02178 0.00000 0.37215 -0.35170 0.00000
|
|
124 13F 0 0.00000 0.25616 0.00000 0.00000 -0.34146
|
|
125 13F+1 -0.28237 0.00000 -0.37656 -0.32596 0.00000
|
|
126 13F-1 0.00000 0.20124 0.00000 0.00000 0.33138
|
|
127 13F+2 0.00000 0.05044 0.00000 0.00000 0.24873
|
|
128 13F-2 -0.14803 0.00000 0.37820 -0.17297 0.00000
|
|
129 13F+3 -0.11782 0.00000 -0.02678 0.17755 0.00000
|
|
130 13F-3 0.00000 -0.03623 0.00000 0.00000 -0.07747
|
|
131 14F 0 0.00000 -0.27207 0.00000 0.00000 0.31755
|
|
132 14F+1 0.16750 0.00000 0.22640 0.19884 0.00000
|
|
133 14F-1 0.00000 0.10288 0.00000 0.00000 -0.08632
|
|
134 14F+2 0.00000 -0.03392 0.00000 0.00000 -0.09589
|
|
135 14F-2 0.16384 0.00000 -0.05065 0.04163 0.00000
|
|
136 14F+3 0.15726 0.00000 0.24205 -0.24229 0.00000
|
|
137 14F-3 0.00000 0.18836 0.00000 0.00000 0.12229
|
|
138 15G 0 0.00000 -0.14145 0.00000 0.00000 0.19644
|
|
139 15G+1 0.30481 0.00000 -0.03467 0.23107 0.00000
|
|
140 15G-1 0.00000 0.14268 0.00000 0.00000 -0.09761
|
|
141 15G+2 0.00000 0.21247 0.00000 0.00000 0.07192
|
|
142 15G-2 0.03538 0.00000 -0.20933 -0.23862 0.00000
|
|
143 15G+3 -0.14118 0.00000 0.18989 0.09978 0.00000
|
|
144 15G-3 0.00000 -0.09013 0.00000 0.00000 0.02159
|
|
145 15G+4 0.00000 0.16399 0.00000 0.00000 -0.04066
|
|
146 15G-4 -0.09827 0.00000 -0.09001 0.29483 0.00000
|
|
147 3 H 1S -0.12929 -0.12503 0.21656 0.00000 -0.07141
|
|
148 2S 0.41802 0.57887 -1.00263 0.00000 0.49808
|
|
149 3S -1.16880 -1.67493 2.90107 0.00000 -1.56692
|
|
150 4S -0.42269 -0.35129 0.60846 0.00000 -0.91927
|
|
151 5S -0.07756 -0.11893 0.20600 0.00000 -0.02242
|
|
152 6PX -0.04437 -0.04178 0.05635 0.00400 -0.04513
|
|
153 6PY 0.02471 0.00811 -0.04178 0.00693 0.02605
|
|
154 6PZ 0.02112 0.03797 -0.06577 0.00000 -0.01398
|
|
155 7PX 0.00650 -0.14830 0.11282 0.02265 -0.12671
|
|
156 7PY -0.00774 -0.05842 -0.14830 0.03922 0.07315
|
|
157 7PZ 0.01544 0.06684 -0.11577 0.00000 -0.11153
|
|
158 8PX 0.75011 0.38633 -1.78314 -0.26860 0.54839
|
|
159 8PY -0.58760 -1.33704 0.38633 -0.46523 -0.31661
|
|
160 8PZ -0.10857 0.04157 -0.07200 0.00000 -0.73017
|
|
161 9PX 0.47904 0.24432 -0.64122 -0.10362 0.41956
|
|
162 9PY -0.20629 -0.35910 0.24432 -0.17947 -0.24223
|
|
163 9PZ -0.06140 -0.06497 0.11253 0.00000 -0.22771
|
|
164 10D 0 0.04495 0.07554 -0.13084 0.00000 -0.18848
|
|
165 10D+1 -0.01148 -0.25398 0.22289 -0.11494 -0.02890
|
|
166 10D-1 0.06879 -0.07037 -0.25398 -0.19909 0.01668
|
|
167 10D+2 -0.08091 -0.04768 -0.03773 0.08829 -0.01454
|
|
168 10D-2 -0.00454 -0.03773 -0.00411 0.05097 0.02518
|
|
169 11D 0 0.11876 0.10740 -0.18601 0.00000 -0.07900
|
|
170 11D+1 0.02856 0.05430 -0.19189 0.06713 0.32703
|
|
171 11D-1 -0.08788 -0.12919 0.05430 0.11628 -0.18881
|
|
172 11D+2 0.05028 0.33961 0.39077 0.03501 0.04151
|
|
173 11D-2 0.18118 0.39077 -0.11162 0.02021 -0.07190
|
|
174 12D 0 0.26066 0.24069 -0.41689 0.00000 0.17904
|
|
175 12D+1 0.07069 -0.01850 -0.09044 -0.09968 0.21082
|
|
176 12D-1 -0.06366 -0.11180 -0.01850 -0.17265 -0.12171
|
|
177 12D+2 -0.15209 0.12870 0.42168 0.30458 -0.02614
|
|
178 12D-2 0.28520 0.42168 -0.35821 0.17585 0.04528
|
|
179 13F 0 0.39930 -0.12808 0.22184 0.00000 -0.34146
|
|
180 13F+1 -0.00032 -0.25020 0.05679 0.16298 0.28698
|
|
181 13F-1 -0.16284 -0.23211 -0.25020 0.28229 -0.16569
|
|
182 13F+2 0.11054 0.29626 0.14192 0.14980 -0.12437
|
|
183 13F-2 -0.33949 0.14192 0.13238 0.08649 0.21541
|
|
184 13F+3 0.05891 0.02319 0.01339 0.17755 0.00000
|
|
185 13F-3 -0.22354 0.01811 -0.03137 0.00000 -0.07747
|
|
186 14F 0 -0.15841 0.13603 -0.23562 0.00000 0.31755
|
|
187 14F+1 -0.09768 0.05348 0.13376 -0.09942 -0.07475
|
|
188 14F-1 0.15310 0.19552 0.05348 -0.17220 0.04316
|
|
189 14F+2 -0.02523 -0.04647 -0.00725 -0.03605 0.04794
|
|
190 14F-2 0.20754 -0.00725 -0.03810 -0.02081 -0.08304
|
|
191 14F+3 -0.07863 -0.20962 -0.12102 -0.24229 0.00000
|
|
192 14F-3 0.07867 -0.09418 0.16312 0.00000 0.12229
|
|
193 15G 0 0.03420 0.07072 -0.12250 0.00000 0.19644
|
|
194 15G+1 0.09117 -0.07680 0.09834 -0.11554 -0.08454
|
|
195 15G-1 0.12334 0.00966 -0.07680 -0.20011 0.04881
|
|
196 15G+2 0.07926 -0.10388 -0.18264 0.20665 -0.03596
|
|
197 15G-2 -0.10191 -0.18264 0.10702 0.11931 0.06229
|
|
198 15G+3 0.07059 -0.16445 -0.09494 0.09978 0.00000
|
|
199 15G-3 -0.22454 0.04506 -0.07805 0.00000 0.02159
|
|
200 15G+4 0.02604 0.10851 -0.03203 0.25533 0.02033
|
|
201 15G-4 -0.05316 0.03203 -0.14550 -0.14742 0.03521
|
|
202 4 H 1S 0.12929 -0.12503 -0.21656 0.00000 -0.07141
|
|
203 2S -0.41802 0.57887 1.00263 0.00000 0.49808
|
|
204 3S 1.16880 -1.67493 -2.90107 0.00000 -1.56692
|
|
205 4S 0.42269 -0.35129 -0.60846 0.00000 -0.91927
|
|
206 5S 0.07756 -0.11893 -0.20600 0.00000 -0.02242
|
|
207 6PX -0.04437 0.04178 0.05635 0.00400 0.04513
|
|
208 6PY -0.02471 0.00811 0.04178 -0.00693 0.02605
|
|
209 6PZ -0.02112 0.03797 0.06577 0.00000 -0.01398
|
|
210 7PX 0.00650 0.14830 0.11282 0.02265 0.12671
|
|
211 7PY 0.00774 -0.05842 0.14830 -0.03922 0.07315
|
|
212 7PZ -0.01544 0.06684 0.11577 0.00000 -0.11153
|
|
213 8PX 0.75011 -0.38633 -1.78314 -0.26860 -0.54839
|
|
214 8PY 0.58760 -1.33704 -0.38633 0.46523 -0.31661
|
|
215 8PZ 0.10857 0.04157 0.07200 0.00000 -0.73017
|
|
216 9PX 0.47904 -0.24432 -0.64122 -0.10362 -0.41956
|
|
217 9PY 0.20629 -0.35910 -0.24432 0.17947 -0.24223
|
|
218 9PZ 0.06140 -0.06497 -0.11253 0.00000 -0.22771
|
|
219 10D 0 -0.04495 0.07554 0.13084 0.00000 -0.18848
|
|
220 10D+1 -0.01148 0.25398 0.22289 -0.11494 0.02890
|
|
221 10D-1 -0.06879 -0.07037 0.25398 0.19909 0.01668
|
|
222 10D+2 0.08091 -0.04768 0.03773 -0.08829 -0.01454
|
|
223 10D-2 -0.00454 0.03773 -0.00411 0.05097 -0.02518
|
|
224 11D 0 -0.11876 0.10740 0.18601 0.00000 -0.07900
|
|
225 11D+1 0.02856 -0.05430 -0.19189 0.06713 -0.32703
|
|
226 11D-1 0.08788 -0.12919 -0.05430 -0.11628 -0.18881
|
|
227 11D+2 -0.05028 0.33961 -0.39077 -0.03501 0.04151
|
|
228 11D-2 0.18118 -0.39077 -0.11162 0.02021 0.07190
|
|
229 12D 0 -0.26066 0.24069 0.41689 0.00000 0.17904
|
|
230 12D+1 0.07069 0.01850 -0.09044 -0.09968 -0.21082
|
|
231 12D-1 0.06366 -0.11180 0.01850 0.17265 -0.12171
|
|
232 12D+2 0.15209 0.12870 -0.42168 -0.30458 -0.02614
|
|
233 12D-2 0.28520 -0.42168 -0.35821 0.17585 -0.04528
|
|
234 13F 0 -0.39930 -0.12808 -0.22184 0.00000 -0.34146
|
|
235 13F+1 -0.00032 0.25020 0.05679 0.16298 -0.28698
|
|
236 13F-1 0.16284 -0.23211 0.25020 -0.28229 -0.16569
|
|
237 13F+2 -0.11054 0.29626 -0.14192 -0.14980 -0.12437
|
|
238 13F-2 -0.33949 -0.14192 0.13238 0.08649 -0.21541
|
|
239 13F+3 0.05891 -0.02319 0.01339 0.17755 0.00000
|
|
240 13F-3 0.22354 0.01811 0.03137 0.00000 -0.07747
|
|
241 14F 0 0.15841 0.13603 0.23562 0.00000 0.31755
|
|
242 14F+1 -0.09768 -0.05348 0.13376 -0.09942 0.07475
|
|
243 14F-1 -0.15310 0.19552 -0.05348 0.17220 0.04316
|
|
244 14F+2 0.02523 -0.04647 0.00725 0.03605 0.04794
|
|
245 14F-2 0.20754 0.00725 -0.03810 -0.02081 0.08304
|
|
246 14F+3 -0.07863 0.20962 -0.12102 -0.24229 0.00000
|
|
247 14F-3 -0.07867 -0.09418 -0.16312 0.00000 0.12229
|
|
248 15G 0 -0.03420 0.07072 0.12250 0.00000 0.19644
|
|
249 15G+1 0.09117 0.07680 0.09834 -0.11554 0.08454
|
|
250 15G-1 -0.12334 0.00966 0.07680 0.20011 0.04881
|
|
251 15G+2 -0.07926 -0.10388 0.18264 -0.20665 -0.03596
|
|
252 15G-2 -0.10191 0.18264 0.10702 0.11931 -0.06229
|
|
253 15G+3 0.07059 0.16445 -0.09494 0.09978 0.00000
|
|
254 15G-3 0.22454 0.04506 0.07805 0.00000 0.02159
|
|
255 15G+4 -0.02604 0.10851 0.03203 -0.25533 0.02033
|
|
256 15G-4 -0.05316 -0.03203 -0.14550 -0.14742 -0.03521
|
|
176 177 178 179 180
|
|
(A2)--V (A1)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 13.35418 13.36779 13.42382 13.42382 13.57610
|
|
1 1 N 1S 0.00000 -0.02571 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.21269 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 0.78991 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 -2.45811 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 7.53732 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 2.05454 0.00000 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 0.00000 0.05799 0.00000
|
|
8 7PY 0.00000 0.00000 0.05799 0.00000 0.05236
|
|
9 7PZ 0.00000 -0.97970 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 0.00000 -0.46213 0.00000
|
|
11 8PY 0.00000 0.00000 -0.46213 0.00000 -0.41593
|
|
12 8PZ 0.00000 2.00888 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 0.00000 1.04913 0.00000
|
|
14 9PY 0.00000 0.00000 1.04913 0.00000 1.16039
|
|
15 9PZ 0.00000 -4.28208 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 0.00000 1.78514 0.00000
|
|
17 10PY 0.00000 0.00000 1.78514 0.00000 0.73232
|
|
18 10PZ 0.00000 -2.64737 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 0.00000 0.04762 0.00000
|
|
20 11PY 0.00000 0.00000 0.04762 0.00000 0.01608
|
|
21 11PZ 0.00000 -0.26048 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.04202 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 0.00936 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00936 0.00000 -0.03329
|
|
25 12D+2 0.00000 0.00000 -0.01590 0.00000 0.01096
|
|
26 12D-2 0.00000 0.00000 0.00000 -0.01590 0.00000
|
|
27 13D 0 0.00000 -0.05689 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 0.03813 0.00000
|
|
29 13D-1 0.00000 0.00000 0.03813 0.00000 0.08181
|
|
30 13D+2 0.00000 0.00000 0.09017 0.00000 0.00909
|
|
31 13D-2 0.00000 0.00000 0.00000 0.09017 0.00000
|
|
32 14D 0 0.00000 1.06483 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 0.14318 0.00000
|
|
34 14D-1 0.00000 0.00000 0.14318 0.00000 -0.32910
|
|
35 14D+2 0.00000 0.00000 -0.55680 0.00000 1.38021
|
|
36 14D-2 0.00000 0.00000 0.00000 -0.55680 0.00000
|
|
37 15D 0 0.00000 0.26389 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 -0.21579 0.00000
|
|
39 15D-1 0.00000 0.00000 -0.21579 0.00000 0.03565
|
|
40 15D+2 0.00000 0.00000 -0.36368 0.00000 0.37533
|
|
41 15D-2 0.00000 0.00000 0.00000 -0.36368 0.00000
|
|
42 16F 0 0.00000 0.21655 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.06026 0.00000
|
|
44 16F-1 0.00000 0.00000 0.06026 0.00000 0.13194
|
|
45 16F+2 0.00000 0.00000 -0.01569 0.00000 0.06158
|
|
46 16F-2 0.00000 0.00000 0.00000 -0.01569 0.00000
|
|
47 16F+3 0.08552 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 -0.03212 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 -0.05468 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 -0.45508 0.00000
|
|
51 17F-1 0.00000 0.00000 -0.45508 0.00000 -0.08116
|
|
52 17F+2 0.00000 0.00000 -0.08536 0.00000 -0.14303
|
|
53 17F-2 0.00000 0.00000 0.00000 -0.08536 0.00000
|
|
54 17F+3 -1.02922 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.18135 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.38310 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 -0.53258 0.00000
|
|
58 18F-1 0.00000 0.00000 -0.53258 0.00000 -0.07067
|
|
59 18F+2 0.00000 0.00000 -0.15311 0.00000 0.15744
|
|
60 18F-2 0.00000 0.00000 0.00000 -0.15311 0.00000
|
|
61 18F+3 -1.10631 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 -0.41583 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 -0.08500 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 -0.12592 0.00000
|
|
65 19G-1 0.00000 0.00000 -0.12592 0.00000 0.01602
|
|
66 19G+2 0.00000 0.00000 -0.25458 0.00000 0.28196
|
|
67 19G-2 0.00000 0.00000 0.00000 -0.25458 0.00000
|
|
68 19G+3 -0.59209 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.41591 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00061 0.00000 -0.21776
|
|
71 19G-4 0.00000 0.00000 0.00000 -0.00061 0.00000
|
|
72 20G 0 0.00000 -0.20262 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.41939 0.00000
|
|
74 20G-1 0.00000 0.00000 0.41939 0.00000 0.00937
|
|
75 20G+2 0.00000 0.00000 0.49590 0.00000 -0.56933
|
|
76 20G-2 0.00000 0.00000 0.00000 0.49590 0.00000
|
|
77 20G+3 1.52288 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 -0.13510 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.04115 0.00000 0.74505
|
|
80 20G-4 0.00000 0.00000 0.00000 -0.04115 0.00000
|
|
81 21H 0 0.00000 -0.07407 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.08357 0.00000
|
|
83 21H-1 0.00000 0.00000 0.08357 0.00000 -0.09965
|
|
84 21H+2 0.00000 0.00000 -0.20326 0.00000 0.09511
|
|
85 21H-2 0.00000 0.00000 0.00000 -0.20326 0.00000
|
|
86 21H+3 -0.18431 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 -0.01575 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 -0.32314 0.00000 -0.25782
|
|
89 21H-4 0.00000 0.00000 0.00000 0.32314 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 -0.11260 0.00000
|
|
91 21H-5 0.00000 0.00000 0.11260 0.00000 -0.15545
|
|
92 2 H 1S 0.00000 -0.09247 -0.06500 0.00000 0.04465
|
|
93 2S 0.00000 0.33181 -0.34167 0.00000 -0.56051
|
|
94 3S 0.00000 -2.74789 -0.91608 0.00000 0.70331
|
|
95 4S 0.00000 -0.75589 -0.40732 0.00000 -0.13267
|
|
96 5S 0.00000 -0.06192 0.04176 0.00000 0.05957
|
|
97 6PX -0.03050 0.00000 0.00000 0.05111 0.00000
|
|
98 6PY 0.00000 -0.12025 -0.09814 0.00000 -0.00960
|
|
99 6PZ 0.00000 0.02630 0.01585 0.00000 0.00862
|
|
100 7PX -0.09232 0.00000 0.00000 -0.01177 0.00000
|
|
101 7PY 0.00000 -0.01508 0.39581 0.00000 0.26404
|
|
102 7PZ 0.00000 -0.12292 -0.21300 0.00000 -0.01155
|
|
103 8PX -1.41452 0.00000 0.00000 -0.29849 0.00000
|
|
104 8PY 0.00000 1.37808 -0.38938 0.00000 -0.41304
|
|
105 8PZ 0.00000 0.37478 -0.81637 0.00000 0.33013
|
|
106 9PX -0.42852 0.00000 0.00000 -0.16241 0.00000
|
|
107 9PY 0.00000 0.60980 -0.03007 0.00000 -0.06683
|
|
108 9PZ 0.00000 0.27049 -0.28725 0.00000 -0.02857
|
|
109 10D 0 0.00000 0.12829 0.29155 0.00000 -0.22208
|
|
110 10D+1 -0.25666 0.00000 0.00000 0.13072 0.00000
|
|
111 10D-1 0.00000 -0.18450 0.37347 0.00000 0.03040
|
|
112 10D+2 0.00000 -0.12308 -0.39842 0.00000 0.15988
|
|
113 10D-2 0.25331 0.00000 0.00000 0.06406 0.00000
|
|
114 11D 0 0.00000 0.07293 -0.38869 0.00000 0.24731
|
|
115 11D+1 0.03900 0.00000 0.00000 -0.04625 0.00000
|
|
116 11D-1 0.00000 0.06284 0.07257 0.00000 -0.19148
|
|
117 11D+2 0.00000 0.24239 0.21532 0.00000 -0.06538
|
|
118 11D-2 0.39648 0.00000 0.00000 0.05620 0.00000
|
|
119 12D 0 0.00000 0.46184 -0.23289 0.00000 -0.29781
|
|
120 12D+1 -0.14240 0.00000 0.00000 0.00491 0.00000
|
|
121 12D-1 0.00000 -0.52923 0.27005 0.00000 -0.14057
|
|
122 12D+2 0.00000 0.39072 -0.49536 0.00000 -0.03925
|
|
123 12D-2 0.81893 0.00000 0.00000 0.23074 0.00000
|
|
124 13F 0 0.00000 0.21030 0.19605 0.00000 0.18932
|
|
125 13F+1 -0.14478 0.00000 0.00000 0.01203 0.00000
|
|
126 13F-1 0.00000 0.10501 -0.04291 0.00000 -0.30366
|
|
127 13F+2 0.00000 0.06834 0.23231 0.00000 -0.08660
|
|
128 13F-2 0.35645 0.00000 0.00000 -0.23083 0.00000
|
|
129 13F+3 0.12585 0.00000 0.00000 0.11436 0.00000
|
|
130 13F-3 0.00000 0.21609 0.12578 0.00000 -0.02441
|
|
131 14F 0 0.00000 -0.23027 -0.01649 0.00000 -0.26056
|
|
132 14F+1 0.27778 0.00000 0.00000 0.11259 0.00000
|
|
133 14F-1 0.00000 -0.36066 0.23369 0.00000 0.24855
|
|
134 14F+2 0.00000 -0.19928 -0.07618 0.00000 0.00113
|
|
135 14F-2 -0.12519 0.00000 0.00000 0.12088 0.00000
|
|
136 14F+3 0.33887 0.00000 0.00000 0.03855 0.00000
|
|
137 14F-3 0.00000 -0.23044 0.10193 0.00000 -0.06248
|
|
138 15G 0 0.00000 -0.21325 0.40679 0.00000 0.05722
|
|
139 15G+1 0.25366 0.00000 0.00000 0.28322 0.00000
|
|
140 15G-1 0.00000 -0.09280 0.03231 0.00000 0.21466
|
|
141 15G+2 0.00000 -0.00791 0.00251 0.00000 0.05954
|
|
142 15G-2 -0.14250 0.00000 0.00000 -0.16000 0.00000
|
|
143 15G+3 0.07196 0.00000 0.00000 0.15966 0.00000
|
|
144 15G-3 0.00000 -0.02545 0.09919 0.00000 -0.07756
|
|
145 15G+4 0.00000 -0.15047 -0.01526 0.00000 -0.08717
|
|
146 15G-4 -0.14351 0.00000 0.00000 0.13531 0.00000
|
|
147 3 H 1S 0.00000 -0.09247 0.03250 -0.05629 -0.02232
|
|
148 2S 0.00000 0.33181 0.17083 -0.29589 0.28026
|
|
149 3S 0.00000 -2.74789 0.45804 -0.79335 -0.35165
|
|
150 4S 0.00000 -0.75589 0.20366 -0.35275 0.06633
|
|
151 5S 0.00000 -0.06192 -0.02088 0.03616 -0.02978
|
|
152 6PX 0.01525 -0.10414 0.06463 -0.06083 0.01965
|
|
153 6PY 0.02641 0.06012 0.01380 0.06463 0.02444
|
|
154 6PZ 0.00000 0.02630 -0.00792 0.01372 -0.00431
|
|
155 7PX 0.04616 -0.01306 -0.17649 0.29392 -0.14819
|
|
156 7PY 0.07995 0.00754 0.09013 -0.17649 0.00736
|
|
157 7PZ 0.00000 -0.12292 0.10650 -0.18447 0.00578
|
|
158 8PX 0.70726 1.19345 0.03935 -0.36666 -0.26476
|
|
159 8PY 1.22501 -0.68904 -0.32121 0.03935 -0.87162
|
|
160 8PZ 0.00000 0.37478 0.40819 -0.70700 -0.16506
|
|
161 9PX 0.21426 0.52810 -0.05730 -0.06316 -0.13974
|
|
162 9PY 0.37111 -0.30490 -0.12933 -0.05730 -0.30887
|
|
163 9PZ 0.00000 0.27049 0.14363 -0.24877 0.01428
|
|
164 10D 0 0.00000 0.12829 -0.14577 0.25249 0.11104
|
|
165 10D+1 0.12833 -0.15978 -0.10511 0.31278 -0.24120
|
|
166 10D-1 0.22227 0.09225 0.19141 -0.10511 -0.38737
|
|
167 10D+2 -0.21938 0.06154 -0.05156 0.20026 -0.04426
|
|
168 10D-2 -0.12666 -0.10659 0.20026 -0.28280 -0.11786
|
|
169 11D 0 0.00000 0.07293 0.19434 -0.33662 -0.12365
|
|
170 11D+1 -0.01950 0.05442 -0.05145 0.04286 0.14390
|
|
171 11D-1 -0.03378 -0.03142 -0.01655 -0.05145 0.05777
|
|
172 11D+2 -0.34336 -0.12120 0.09598 -0.06890 0.36880
|
|
173 11D-2 -0.19824 0.20992 -0.06890 0.17554 0.25068
|
|
174 12D 0 0.00000 0.46184 0.11645 -0.20169 0.14890
|
|
175 12D+1 0.07120 -0.45832 -0.11481 0.20377 -0.27475
|
|
176 12D-1 0.12333 0.26461 0.07119 -0.11481 -0.61646
|
|
177 12D+2 -0.70921 -0.19536 0.04922 0.31441 0.33297
|
|
178 12D-2 -0.40946 0.33837 0.31441 -0.31384 0.21490
|
|
179 13F 0 0.00000 0.21030 -0.09802 0.16978 -0.09466
|
|
180 13F+1 0.07239 0.09095 0.02379 -0.02918 0.22543
|
|
181 13F-1 0.12538 -0.05251 -0.00170 0.02379 0.08679
|
|
182 13F+2 -0.30870 -0.03417 -0.11505 -0.20055 -0.25692
|
|
183 13F-2 -0.17823 0.05918 -0.20055 0.11653 -0.09833
|
|
184 13F+3 0.12585 0.00000 -0.09904 -0.05718 -0.09180
|
|
185 13F-3 0.00000 0.21609 -0.06289 0.10893 0.01221
|
|
186 14F 0 0.00000 -0.23027 0.00825 -0.01428 0.13028
|
|
187 14F+1 -0.13889 -0.31234 -0.05244 0.20342 -0.23939
|
|
188 14F-1 -0.24056 0.18033 0.14287 -0.05244 -0.16609
|
|
189 14F+2 0.10842 0.09964 0.07162 0.08533 0.50802
|
|
190 14F-2 0.06260 -0.17258 0.08533 -0.02691 0.29266
|
|
191 14F+3 0.33887 0.00000 -0.03338 -0.01927 -0.14667
|
|
192 14F-3 0.00000 -0.23044 -0.05097 0.08828 0.03124
|
|
193 15G 0 0.00000 -0.21325 -0.20340 0.35229 -0.02861
|
|
194 15G+1 -0.12683 -0.08037 0.10865 0.09504 -0.08854
|
|
195 15G-1 -0.21968 0.04640 0.22049 0.10865 0.06131
|
|
196 15G+2 0.12341 0.00396 -0.11938 -0.07037 0.24111
|
|
197 15G-2 0.07125 -0.00685 -0.07037 -0.03812 0.10483
|
|
198 15G+3 0.07196 0.00000 -0.13827 -0.07983 -0.34979
|
|
199 15G-3 0.00000 -0.02545 -0.04960 0.08591 0.03878
|
|
200 15G+4 -0.12429 0.07524 -0.10530 -0.05199 0.02953
|
|
201 15G-4 0.07176 0.13031 0.05199 0.04527 -0.06738
|
|
202 4 H 1S 0.00000 -0.09247 0.03250 0.05629 -0.02232
|
|
203 2S 0.00000 0.33181 0.17083 0.29589 0.28026
|
|
204 3S 0.00000 -2.74789 0.45804 0.79335 -0.35165
|
|
205 4S 0.00000 -0.75589 0.20366 0.35275 0.06633
|
|
206 5S 0.00000 -0.06192 -0.02088 -0.03616 -0.02978
|
|
207 6PX 0.01525 0.10414 -0.06463 -0.06083 -0.01965
|
|
208 6PY -0.02641 0.06012 0.01380 -0.06463 0.02444
|
|
209 6PZ 0.00000 0.02630 -0.00792 -0.01372 -0.00431
|
|
210 7PX 0.04616 0.01306 0.17649 0.29392 0.14819
|
|
211 7PY -0.07995 0.00754 0.09013 0.17649 0.00736
|
|
212 7PZ 0.00000 -0.12292 0.10650 0.18447 0.00578
|
|
213 8PX 0.70726 -1.19345 -0.03935 -0.36666 0.26476
|
|
214 8PY -1.22501 -0.68904 -0.32121 -0.03935 -0.87162
|
|
215 8PZ 0.00000 0.37478 0.40819 0.70700 -0.16506
|
|
216 9PX 0.21426 -0.52810 0.05730 -0.06316 0.13974
|
|
217 9PY -0.37111 -0.30490 -0.12933 0.05730 -0.30887
|
|
218 9PZ 0.00000 0.27049 0.14363 0.24877 0.01428
|
|
219 10D 0 0.00000 0.12829 -0.14577 -0.25249 0.11104
|
|
220 10D+1 0.12833 0.15978 0.10511 0.31278 0.24120
|
|
221 10D-1 -0.22227 0.09225 0.19141 0.10511 -0.38737
|
|
222 10D+2 0.21938 0.06154 -0.05156 -0.20026 -0.04426
|
|
223 10D-2 -0.12666 0.10659 -0.20026 -0.28280 0.11786
|
|
224 11D 0 0.00000 0.07293 0.19434 0.33662 -0.12365
|
|
225 11D+1 -0.01950 -0.05442 0.05145 0.04286 -0.14390
|
|
226 11D-1 0.03378 -0.03142 -0.01655 0.05145 0.05777
|
|
227 11D+2 0.34336 -0.12120 0.09598 0.06890 0.36880
|
|
228 11D-2 -0.19824 -0.20992 0.06890 0.17554 -0.25068
|
|
229 12D 0 0.00000 0.46184 0.11645 0.20169 0.14890
|
|
230 12D+1 0.07120 0.45832 0.11481 0.20377 0.27475
|
|
231 12D-1 -0.12333 0.26461 0.07119 0.11481 -0.61646
|
|
232 12D+2 0.70921 -0.19536 0.04922 -0.31441 0.33297
|
|
233 12D-2 -0.40946 -0.33837 -0.31441 -0.31384 -0.21490
|
|
234 13F 0 0.00000 0.21030 -0.09802 -0.16978 -0.09466
|
|
235 13F+1 0.07239 -0.09095 -0.02379 -0.02918 -0.22543
|
|
236 13F-1 -0.12538 -0.05251 -0.00170 -0.02379 0.08679
|
|
237 13F+2 0.30870 -0.03417 -0.11505 0.20055 -0.25692
|
|
238 13F-2 -0.17823 -0.05918 0.20055 0.11653 0.09833
|
|
239 13F+3 0.12585 0.00000 0.09904 -0.05718 0.09180
|
|
240 13F-3 0.00000 0.21609 -0.06289 -0.10893 0.01221
|
|
241 14F 0 0.00000 -0.23027 0.00825 0.01428 0.13028
|
|
242 14F+1 -0.13889 0.31234 0.05244 0.20342 0.23939
|
|
243 14F-1 0.24056 0.18033 0.14287 0.05244 -0.16609
|
|
244 14F+2 -0.10842 0.09964 0.07162 -0.08533 0.50802
|
|
245 14F-2 0.06260 0.17258 -0.08533 -0.02691 -0.29266
|
|
246 14F+3 0.33887 0.00000 0.03338 -0.01927 0.14667
|
|
247 14F-3 0.00000 -0.23044 -0.05097 -0.08828 0.03124
|
|
248 15G 0 0.00000 -0.21325 -0.20340 -0.35229 -0.02861
|
|
249 15G+1 -0.12683 0.08037 -0.10865 0.09504 0.08854
|
|
250 15G-1 0.21968 0.04640 0.22049 -0.10865 0.06131
|
|
251 15G+2 -0.12341 0.00396 -0.11938 0.07037 0.24111
|
|
252 15G-2 0.07125 0.00685 0.07037 -0.03812 -0.10483
|
|
253 15G+3 0.07196 0.00000 0.13827 -0.07983 0.34979
|
|
254 15G-3 0.00000 -0.02545 -0.04960 -0.08591 0.03878
|
|
255 15G+4 0.12429 0.07524 -0.10530 0.05199 0.02953
|
|
256 15G-4 0.07176 -0.13031 -0.05199 0.04527 0.06738
|
|
181 182 183 184 185
|
|
(E)--V (A1)--V (A2)--V (E)--V (E)--V
|
|
Eigenvalues -- 13.57610 13.63855 13.64793 13.68829 13.68829
|
|
1 1 N 1S 0.00000 -0.00895 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.02465 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 0.10839 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 -0.61151 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 2.36596 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 1.60987 0.00000 0.00000 0.00000
|
|
7 7PX 0.05236 0.00000 0.00000 0.00000 0.32989
|
|
8 7PY 0.00000 0.00000 0.00000 0.32989 0.00000
|
|
9 7PZ 0.00000 -0.00863 0.00000 0.00000 0.00000
|
|
10 8PX -0.41593 0.00000 0.00000 0.00000 -0.33419
|
|
11 8PY 0.00000 0.00000 0.00000 -0.33419 0.00000
|
|
12 8PZ 0.00000 -0.16656 0.00000 0.00000 0.00000
|
|
13 9PX 1.16039 0.00000 0.00000 0.00000 2.34994
|
|
14 9PY 0.00000 0.00000 0.00000 2.34994 0.00000
|
|
15 9PZ 0.00000 1.17283 0.00000 0.00000 0.00000
|
|
16 10PX 0.73232 0.00000 0.00000 0.00000 1.53569
|
|
17 10PY 0.00000 0.00000 0.00000 1.53569 0.00000
|
|
18 10PZ 0.00000 -0.48244 0.00000 0.00000 0.00000
|
|
19 11PX 0.01608 0.00000 0.00000 0.00000 0.44045
|
|
20 11PY 0.00000 0.00000 0.00000 0.44045 0.00000
|
|
21 11PZ 0.00000 -0.24854 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00493 0.00000 0.00000 0.00000
|
|
23 12D+1 -0.03329 0.00000 0.00000 0.00000 0.12234
|
|
24 12D-1 0.00000 0.00000 0.00000 0.12234 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.09612 0.00000
|
|
26 12D-2 0.01096 0.00000 0.00000 0.00000 0.09612
|
|
27 13D 0 0.00000 -0.02621 0.00000 0.00000 0.00000
|
|
28 13D+1 0.08181 0.00000 0.00000 0.00000 -0.08782
|
|
29 13D-1 0.00000 0.00000 0.00000 -0.08782 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 -0.05578 0.00000
|
|
31 13D-2 0.00909 0.00000 0.00000 0.00000 -0.05578
|
|
32 14D 0 0.00000 -0.82144 0.00000 0.00000 0.00000
|
|
33 14D+1 -0.32910 0.00000 0.00000 0.00000 0.08959
|
|
34 14D-1 0.00000 0.00000 0.00000 0.08959 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 -0.30893 0.00000
|
|
36 14D-2 1.38021 0.00000 0.00000 0.00000 -0.30893
|
|
37 15D 0 0.00000 0.19953 0.00000 0.00000 0.00000
|
|
38 15D+1 0.03565 0.00000 0.00000 0.00000 -0.36467
|
|
39 15D-1 0.00000 0.00000 0.00000 -0.36467 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 -0.10378 0.00000
|
|
41 15D-2 0.37533 0.00000 0.00000 0.00000 -0.10378
|
|
42 16F 0 0.00000 0.19922 0.00000 0.00000 0.00000
|
|
43 16F+1 0.13194 0.00000 0.00000 0.00000 0.03801
|
|
44 16F-1 0.00000 0.00000 0.00000 0.03801 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.32588 0.00000
|
|
46 16F-2 0.06158 0.00000 0.00000 0.00000 0.32588
|
|
47 16F+3 0.00000 0.00000 0.37485 0.00000 0.00000
|
|
48 16F-3 0.00000 0.22649 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 -0.21540 0.00000 0.00000 0.00000
|
|
50 17F+1 -0.08116 0.00000 0.00000 0.00000 -0.31126
|
|
51 17F-1 0.00000 0.00000 0.00000 -0.31126 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 -0.46115 0.00000
|
|
53 17F-2 -0.14303 0.00000 0.00000 0.00000 -0.46115
|
|
54 17F+3 0.00000 0.00000 -0.78097 0.00000 0.00000
|
|
55 17F-3 0.00000 -0.58362 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 -0.36917 0.00000 0.00000 0.00000
|
|
57 18F+1 -0.07067 0.00000 0.00000 0.00000 -0.02642
|
|
58 18F-1 0.00000 0.00000 0.00000 -0.02642 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.04977 0.00000
|
|
60 18F-2 0.15744 0.00000 0.00000 0.00000 0.04977
|
|
61 18F+3 0.00000 0.00000 -0.03676 0.00000 0.00000
|
|
62 18F-3 0.00000 -0.54633 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 -0.17071 0.00000 0.00000 0.00000
|
|
64 19G+1 0.01602 0.00000 0.00000 0.00000 0.09057
|
|
65 19G-1 0.00000 0.00000 0.00000 0.09057 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 -0.07350 0.00000
|
|
67 19G-2 0.28196 0.00000 0.00000 0.00000 -0.07350
|
|
68 19G+3 0.00000 0.00000 0.14272 0.00000 0.00000
|
|
69 19G-3 0.00000 -0.12356 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.27685 0.00000
|
|
71 19G-4 0.21776 0.00000 0.00000 0.00000 -0.27685
|
|
72 20G 0 0.00000 0.34776 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00937 0.00000 0.00000 0.00000 0.00643
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00643 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.21484 0.00000
|
|
76 20G-2 -0.56933 0.00000 0.00000 0.00000 0.21484
|
|
77 20G+3 0.00000 0.00000 -0.10688 0.00000 0.00000
|
|
78 20G-3 0.00000 0.08015 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 -0.36710 0.00000
|
|
80 20G-4 -0.74505 0.00000 0.00000 0.00000 0.36710
|
|
81 21H 0 0.00000 -0.14406 0.00000 0.00000 0.00000
|
|
82 21H+1 -0.09965 0.00000 0.00000 0.00000 -0.07673
|
|
83 21H-1 0.00000 0.00000 0.00000 -0.07673 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 -0.01486 0.00000
|
|
85 21H-2 0.09511 0.00000 0.00000 0.00000 -0.01486
|
|
86 21H+3 0.00000 0.00000 0.00166 0.00000 0.00000
|
|
87 21H-3 0.00000 0.16294 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.25457 0.00000
|
|
89 21H-4 0.25782 0.00000 0.00000 0.00000 -0.25457
|
|
90 21H+5 0.15545 0.00000 0.00000 0.00000 -0.10621
|
|
91 21H-5 0.00000 0.00000 0.00000 0.10621 0.00000
|
|
92 2 H 1S 0.00000 0.00074 0.00000 -0.11521 0.00000
|
|
93 2S 0.00000 -0.04018 0.00000 0.68249 0.00000
|
|
94 3S 0.00000 -0.57222 0.00000 -2.24832 0.00000
|
|
95 4S 0.00000 -0.76691 0.00000 -0.57582 0.00000
|
|
96 5S 0.00000 -0.01151 0.00000 -0.22035 0.00000
|
|
97 6PX 0.03578 0.00000 0.06133 0.00000 0.02537
|
|
98 6PY 0.00000 -0.01214 0.00000 -0.07210 0.00000
|
|
99 6PZ 0.00000 0.00206 0.00000 0.05900 0.00000
|
|
100 7PX -0.07820 0.00000 0.11908 0.00000 0.18255
|
|
101 7PY 0.00000 0.02866 0.00000 -0.14818 0.00000
|
|
102 7PZ 0.00000 -0.06274 0.00000 0.15710 0.00000
|
|
103 8PX -1.02448 0.00000 -0.54552 0.00000 -0.20284
|
|
104 8PY 0.00000 0.04087 0.00000 0.88994 0.00000
|
|
105 8PZ 0.00000 -0.57248 0.00000 -0.95477 0.00000
|
|
106 9PX -0.38956 0.00000 -0.52821 0.00000 -0.55624
|
|
107 9PY 0.00000 0.30215 0.00000 0.25317 0.00000
|
|
108 9PZ 0.00000 -0.09811 0.00000 -0.64036 0.00000
|
|
109 10D 0 0.00000 -0.47906 0.00000 -0.06449 0.00000
|
|
110 10D+1 -0.52663 0.00000 -0.21179 0.00000 -0.23354
|
|
111 10D-1 0.00000 -0.08490 0.00000 0.20493 0.00000
|
|
112 10D+2 0.00000 0.35558 0.00000 -0.43586 0.00000
|
|
113 10D-2 -0.11230 0.00000 0.19617 0.00000 0.28572
|
|
114 11D 0 0.00000 0.24652 0.00000 0.02983 0.00000
|
|
115 11D+1 0.14085 0.00000 0.14555 0.00000 0.31000
|
|
116 11D-1 0.00000 0.29373 0.00000 -0.02302 0.00000
|
|
117 11D+2 0.00000 -0.37747 0.00000 0.37320 0.00000
|
|
118 11D-2 0.51353 0.00000 -0.11438 0.00000 -0.39093
|
|
119 12D 0 0.00000 -0.52807 0.00000 -0.24951 0.00000
|
|
120 12D+1 -0.77508 0.00000 -0.36706 0.00000 -0.13900
|
|
121 12D-1 0.00000 0.09515 0.00000 0.98867 0.00000
|
|
122 12D+2 0.00000 0.20813 0.00000 0.00807 0.00000
|
|
123 12D-2 0.45704 0.00000 0.83216 0.00000 0.72489
|
|
124 13F 0 0.00000 0.19446 0.00000 -0.32806 0.00000
|
|
125 13F+1 0.21695 0.00000 -0.10050 0.00000 0.03892
|
|
126 13F-1 0.00000 -0.21134 0.00000 -0.10273 0.00000
|
|
127 13F+2 0.00000 0.04726 0.00000 -0.26201 0.00000
|
|
128 13F-2 -0.31369 0.00000 -0.40721 0.00000 -0.03226
|
|
129 13F+3 0.10600 0.00000 -0.25859 0.00000 -0.39138
|
|
130 13F-3 0.00000 0.19802 0.00000 0.11454 0.00000
|
|
131 14F 0 0.00000 -0.17211 0.00000 0.41599 0.00000
|
|
132 14F+1 -0.30430 0.00000 0.07836 0.00000 0.05792
|
|
133 14F-1 0.00000 0.41356 0.00000 0.29605 0.00000
|
|
134 14F+2 0.00000 0.04021 0.00000 0.44438 0.00000
|
|
135 14F-2 0.67699 0.00000 0.50397 0.00000 0.01994
|
|
136 14F+3 0.16936 0.00000 0.46171 0.00000 0.45415
|
|
137 14F-3 0.00000 -0.14179 0.00000 -0.01841 0.00000
|
|
138 15G 0 0.00000 0.07696 0.00000 0.00266 0.00000
|
|
139 15G+1 0.01019 0.00000 0.08901 0.00000 0.04485
|
|
140 15G-1 0.00000 0.13349 0.00000 -0.20442 0.00000
|
|
141 15G+2 0.00000 0.23186 0.00000 0.24814 0.00000
|
|
142 15G-2 0.30163 0.00000 0.02158 0.00000 -0.01986
|
|
143 15G+3 0.40390 0.00000 0.34421 0.00000 0.14350
|
|
144 15G-3 0.00000 -0.05719 0.00000 -0.26797 0.00000
|
|
145 15G+4 0.00000 -0.14767 0.00000 0.15234 0.00000
|
|
146 15G-4 -0.06844 0.00000 -0.20103 0.00000 -0.09450
|
|
147 3 H 1S 0.03866 0.00074 0.00000 0.05761 -0.09978
|
|
148 2S -0.48542 -0.04018 0.00000 -0.34125 0.59106
|
|
149 3S 0.60908 -0.57222 0.00000 1.12416 -1.94710
|
|
150 4S -0.11489 -0.76691 0.00000 0.28791 -0.49867
|
|
151 5S 0.05159 -0.01151 0.00000 0.11018 -0.19083
|
|
152 6PX 0.00174 -0.01052 -0.03066 0.04220 -0.04773
|
|
153 6PY 0.01965 0.00607 -0.05311 0.00100 0.04220
|
|
154 6PZ 0.00746 0.00206 0.00000 -0.02950 0.05110
|
|
155 7PX 0.17848 0.02482 -0.05954 0.14321 -0.06550
|
|
156 7PY -0.14819 -0.01433 -0.10313 0.09986 0.14321
|
|
157 7PZ -0.01000 -0.06274 0.00000 -0.07855 0.13606
|
|
158 8PX -0.56590 0.03540 0.27276 -0.47319 0.61674
|
|
159 8PY -0.26476 -0.02044 0.47243 0.07035 -0.47319
|
|
160 8PZ 0.28590 -0.57248 0.00000 0.47739 -0.82686
|
|
161 9PX -0.14751 0.26167 0.26410 -0.35048 0.05082
|
|
162 9PY -0.13974 -0.15108 0.45744 -0.35389 -0.35048
|
|
163 9PZ -0.02474 -0.09811 0.00000 0.32018 -0.55457
|
|
164 10D 0 -0.19233 -0.47906 0.00000 0.03224 -0.05585
|
|
165 10D+1 -0.10886 -0.07353 0.10589 -0.18987 0.09531
|
|
166 10D-1 -0.24120 0.04245 0.18341 -0.12392 -0.18987
|
|
167 10D+2 -0.11786 -0.17779 -0.16989 0.10533 0.31245
|
|
168 10D-2 0.09183 0.30794 -0.09809 0.31245 -0.25546
|
|
169 11D 0 0.21417 0.24652 0.00000 -0.01492 0.02584
|
|
170 11D+1 -0.10840 0.25437 -0.07278 0.14420 0.06023
|
|
171 11D-1 0.14390 -0.14686 -0.12605 0.22675 0.14420
|
|
172 11D+2 0.25068 0.18873 0.09905 -0.19990 -0.33088
|
|
173 11D-2 0.07935 -0.32690 0.05719 -0.33088 0.18217
|
|
174 12D 0 -0.25791 -0.52807 0.00000 0.12475 -0.21608
|
|
175 12D+1 -0.29920 0.08240 0.18353 -0.48829 0.70675
|
|
176 12D-1 -0.27475 -0.04757 0.31788 0.14292 -0.48829
|
|
177 12D+2 0.21490 -0.10406 -0.72067 0.54569 0.31040
|
|
178 12D-2 0.08482 0.18024 -0.41608 0.31040 0.18727
|
|
179 13F 0 0.16395 0.19446 0.00000 0.16403 -0.28411
|
|
180 13F+1 -0.17351 -0.18303 0.05025 0.06134 -0.06732
|
|
181 13F-1 0.22543 0.10567 0.08704 0.00351 0.06134
|
|
182 13F+2 -0.09833 -0.02363 0.35266 -0.08970 0.09949
|
|
183 13F-2 -0.14338 0.04093 0.20361 0.09949 -0.20458
|
|
184 13F+3 -0.05300 0.00000 -0.25859 0.33895 0.19569
|
|
185 13F-3 -0.02114 0.19802 0.00000 -0.05727 0.09919
|
|
186 14F 0 -0.22565 -0.17211 0.00000 -0.20800 0.36026
|
|
187 14F+1 0.11034 0.35815 -0.03918 -0.10312 0.23652
|
|
188 14F-1 -0.23939 -0.20678 -0.06786 0.11745 -0.10312
|
|
189 14F+2 0.29266 -0.02011 -0.43645 0.12605 -0.18379
|
|
190 14F-2 0.17009 0.03482 -0.25199 -0.18379 0.33827
|
|
191 14F+3 -0.08468 0.00000 0.46171 -0.39331 -0.22708
|
|
192 14F-3 -0.05411 -0.14179 0.00000 0.00920 -0.01594
|
|
193 15G 0 0.04955 0.07696 0.00000 -0.00133 0.00230
|
|
194 15G+1 0.16354 0.11561 -0.04450 0.10794 -0.14210
|
|
195 15G-1 -0.08854 -0.06675 -0.07708 -0.01747 0.10794
|
|
196 15G+2 0.10483 -0.11593 -0.01869 0.04714 -0.11605
|
|
197 15G-2 0.12007 0.20080 -0.01079 -0.11605 0.18114
|
|
198 15G+3 -0.20195 0.00000 0.34421 -0.12427 -0.07175
|
|
199 15G-3 -0.06717 -0.05719 0.00000 0.13399 -0.23207
|
|
200 15G+4 0.06738 0.07384 -0.17410 0.10896 -0.02505
|
|
201 15G-4 0.04827 0.12789 0.10052 0.02505 -0.13788
|
|
202 4 H 1S -0.03866 0.00074 0.00000 0.05761 0.09978
|
|
203 2S 0.48542 -0.04018 0.00000 -0.34125 -0.59106
|
|
204 3S -0.60908 -0.57222 0.00000 1.12416 1.94710
|
|
205 4S 0.11489 -0.76691 0.00000 0.28791 0.49867
|
|
206 5S -0.05159 -0.01151 0.00000 0.11018 0.19083
|
|
207 6PX 0.00174 0.01052 -0.03066 -0.04220 -0.04773
|
|
208 6PY -0.01965 0.00607 0.05311 0.00100 -0.04220
|
|
209 6PZ -0.00746 0.00206 0.00000 -0.02950 -0.05110
|
|
210 7PX 0.17848 -0.02482 -0.05954 -0.14321 -0.06550
|
|
211 7PY 0.14819 -0.01433 0.10313 0.09986 -0.14321
|
|
212 7PZ 0.01000 -0.06274 0.00000 -0.07855 -0.13606
|
|
213 8PX -0.56590 -0.03540 0.27276 0.47319 0.61674
|
|
214 8PY 0.26476 -0.02044 -0.47243 0.07035 0.47319
|
|
215 8PZ -0.28590 -0.57248 0.00000 0.47739 0.82686
|
|
216 9PX -0.14751 -0.26167 0.26410 0.35048 0.05082
|
|
217 9PY 0.13974 -0.15108 -0.45744 -0.35389 0.35048
|
|
218 9PZ 0.02474 -0.09811 0.00000 0.32018 0.55457
|
|
219 10D 0 0.19233 -0.47906 0.00000 0.03224 0.05585
|
|
220 10D+1 -0.10886 0.07353 0.10589 0.18987 0.09531
|
|
221 10D-1 0.24120 0.04245 -0.18341 -0.12392 0.18987
|
|
222 10D+2 0.11786 -0.17779 0.16989 0.10533 -0.31245
|
|
223 10D-2 0.09183 -0.30794 -0.09809 -0.31245 -0.25546
|
|
224 11D 0 -0.21417 0.24652 0.00000 -0.01492 -0.02584
|
|
225 11D+1 -0.10840 -0.25437 -0.07278 -0.14420 0.06023
|
|
226 11D-1 -0.14390 -0.14686 0.12605 0.22675 -0.14420
|
|
227 11D+2 -0.25068 0.18873 -0.09905 -0.19990 0.33088
|
|
228 11D-2 0.07935 0.32690 0.05719 0.33088 0.18217
|
|
229 12D 0 0.25791 -0.52807 0.00000 0.12475 0.21608
|
|
230 12D+1 -0.29920 -0.08240 0.18353 0.48829 0.70675
|
|
231 12D-1 0.27475 -0.04757 -0.31788 0.14292 0.48829
|
|
232 12D+2 -0.21490 -0.10406 0.72067 0.54569 -0.31040
|
|
233 12D-2 0.08482 -0.18024 -0.41608 -0.31040 0.18727
|
|
234 13F 0 -0.16395 0.19446 0.00000 0.16403 0.28411
|
|
235 13F+1 -0.17351 0.18303 0.05025 -0.06134 -0.06732
|
|
236 13F-1 -0.22543 0.10567 -0.08704 0.00351 -0.06134
|
|
237 13F+2 0.09833 -0.02363 -0.35266 -0.08970 -0.09949
|
|
238 13F-2 -0.14338 -0.04093 0.20361 -0.09949 -0.20458
|
|
239 13F+3 -0.05300 0.00000 -0.25859 -0.33895 0.19569
|
|
240 13F-3 0.02114 0.19802 0.00000 -0.05727 -0.09919
|
|
241 14F 0 0.22565 -0.17211 0.00000 -0.20800 -0.36026
|
|
242 14F+1 0.11034 -0.35815 -0.03918 0.10312 0.23652
|
|
243 14F-1 0.23939 -0.20678 0.06786 0.11745 0.10312
|
|
244 14F+2 -0.29266 -0.02011 0.43645 0.12605 0.18379
|
|
245 14F-2 0.17009 -0.03482 -0.25199 0.18379 0.33827
|
|
246 14F+3 -0.08468 0.00000 0.46171 0.39331 -0.22708
|
|
247 14F-3 0.05411 -0.14179 0.00000 0.00920 0.01594
|
|
248 15G 0 -0.04955 0.07696 0.00000 -0.00133 -0.00230
|
|
249 15G+1 0.16354 -0.11561 -0.04450 -0.10794 -0.14210
|
|
250 15G-1 0.08854 -0.06675 0.07708 -0.01747 -0.10794
|
|
251 15G+2 -0.10483 -0.11593 0.01869 0.04714 0.11605
|
|
252 15G-2 0.12007 -0.20080 -0.01079 0.11605 0.18114
|
|
253 15G+3 -0.20195 0.00000 0.34421 0.12427 -0.07175
|
|
254 15G-3 0.06717 -0.05719 0.00000 0.13399 0.23207
|
|
255 15G+4 -0.06738 0.07384 0.17410 0.10896 0.02505
|
|
256 15G-4 0.04827 -0.12789 0.10052 -0.02505 -0.13788
|
|
186 187 188 189 190
|
|
(E)--V (E)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 13.78055 13.78055 13.82978 13.84989 13.84989
|
|
1 1 N 1S 0.00000 0.00000 -0.00821 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 -0.02536 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 -0.30692 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 1.26152 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 -2.19329 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 -3.45243 0.00000 0.00000
|
|
7 7PX 0.00000 -0.15650 0.00000 -0.08327 0.00000
|
|
8 7PY -0.15650 0.00000 0.00000 0.00000 -0.08327
|
|
9 7PZ 0.00000 0.00000 0.19450 0.00000 0.00000
|
|
10 8PX 0.00000 0.12569 0.00000 -0.16534 0.00000
|
|
11 8PY 0.12569 0.00000 0.00000 0.00000 -0.16534
|
|
12 8PZ 0.00000 0.00000 -0.94730 0.00000 0.00000
|
|
13 9PX 0.00000 -1.13455 0.00000 0.23617 0.00000
|
|
14 9PY -1.13455 0.00000 0.00000 0.00000 0.23617
|
|
15 9PZ 0.00000 0.00000 3.48032 0.00000 0.00000
|
|
16 10PX 0.00000 -1.33360 0.00000 2.75713 0.00000
|
|
17 10PY -1.33360 0.00000 0.00000 0.00000 2.75713
|
|
18 10PZ 0.00000 0.00000 3.03505 0.00000 0.00000
|
|
19 11PX 0.00000 -0.22233 0.00000 0.20331 0.00000
|
|
20 11PY -0.22233 0.00000 0.00000 0.00000 0.20331
|
|
21 11PZ 0.00000 0.00000 0.59566 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 -0.03107 0.00000 0.00000
|
|
23 12D+1 0.00000 -0.08748 0.00000 -0.03074 0.00000
|
|
24 12D-1 -0.08748 0.00000 0.00000 0.00000 -0.03074
|
|
25 12D+2 -0.06026 0.00000 0.00000 0.00000 -0.05331
|
|
26 12D-2 0.00000 -0.06026 0.00000 -0.05331 0.00000
|
|
27 13D 0 0.00000 0.00000 -0.06637 0.00000 0.00000
|
|
28 13D+1 0.00000 0.13469 0.00000 0.17423 0.00000
|
|
29 13D-1 0.13469 0.00000 0.00000 0.00000 0.17423
|
|
30 13D+2 0.06862 0.00000 0.00000 0.00000 0.11912
|
|
31 13D-2 0.00000 0.06862 0.00000 0.11912 0.00000
|
|
32 14D 0 0.00000 0.00000 -2.04633 0.00000 0.00000
|
|
33 14D+1 0.00000 -0.05786 0.00000 0.84317 0.00000
|
|
34 14D-1 -0.05786 0.00000 0.00000 0.00000 0.84317
|
|
35 14D+2 0.70838 0.00000 0.00000 0.00000 -0.89261
|
|
36 14D-2 0.00000 0.70838 0.00000 -0.89261 0.00000
|
|
37 15D 0 0.00000 0.00000 -0.78569 0.00000 0.00000
|
|
38 15D+1 0.00000 0.25551 0.00000 -0.57801 0.00000
|
|
39 15D-1 0.25551 0.00000 0.00000 0.00000 -0.57801
|
|
40 15D+2 0.72765 0.00000 0.00000 0.00000 -0.92860
|
|
41 15D-2 0.00000 0.72765 0.00000 -0.92860 0.00000
|
|
42 16F 0 0.00000 0.00000 -0.04073 0.00000 0.00000
|
|
43 16F+1 0.00000 0.09774 0.00000 0.31775 0.00000
|
|
44 16F-1 0.09774 0.00000 0.00000 0.00000 0.31775
|
|
45 16F+2 -0.02017 0.00000 0.00000 0.00000 0.01804
|
|
46 16F-2 0.00000 -0.02017 0.00000 0.01804 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.30549 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 -0.12728 0.00000 0.00000
|
|
50 17F+1 0.00000 -0.08622 0.00000 -0.81795 0.00000
|
|
51 17F-1 -0.08622 0.00000 0.00000 0.00000 -0.81795
|
|
52 17F+2 0.12757 0.00000 0.00000 0.00000 -0.24452
|
|
53 17F-2 0.00000 0.12757 0.00000 -0.24452 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 -0.59635 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 -0.55602 0.00000 0.00000
|
|
57 18F+1 0.00000 -0.11263 0.00000 -0.24441 0.00000
|
|
58 18F-1 -0.11263 0.00000 0.00000 0.00000 -0.24441
|
|
59 18F+2 0.11066 0.00000 0.00000 0.00000 -0.12569
|
|
60 18F-2 0.00000 0.11066 0.00000 -0.12569 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 -0.06063 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 -0.16739 0.00000 0.00000
|
|
64 19G+1 0.00000 -0.38982 0.00000 -0.05227 0.00000
|
|
65 19G-1 -0.38982 0.00000 0.00000 0.00000 -0.05227
|
|
66 19G+2 0.17284 0.00000 0.00000 0.00000 -0.18220
|
|
67 19G-2 0.00000 0.17284 0.00000 -0.18220 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.29602 0.00000 0.00000
|
|
70 19G+4 -0.02294 0.00000 0.00000 0.00000 -0.03471
|
|
71 19G-4 0.00000 0.02294 0.00000 0.03471 0.00000
|
|
72 20G 0 0.00000 0.00000 0.68955 0.00000 0.00000
|
|
73 20G+1 0.00000 0.43356 0.00000 0.09487 0.00000
|
|
74 20G-1 0.43356 0.00000 0.00000 0.00000 0.09487
|
|
75 20G+2 -0.25006 0.00000 0.00000 0.00000 0.54046
|
|
76 20G-2 0.00000 -0.25006 0.00000 0.54046 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 -0.56143 0.00000 0.00000
|
|
79 20G+4 -0.06765 0.00000 0.00000 0.00000 0.09005
|
|
80 20G-4 0.00000 0.06765 0.00000 -0.09005 0.00000
|
|
81 21H 0 0.00000 0.00000 -0.28582 0.00000 0.00000
|
|
82 21H+1 0.00000 0.01127 0.00000 0.17081 0.00000
|
|
83 21H-1 0.01127 0.00000 0.00000 0.00000 0.17081
|
|
84 21H+2 -0.03994 0.00000 0.00000 0.00000 -0.20994
|
|
85 21H-2 0.00000 -0.03994 0.00000 -0.20994 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.32647 0.00000 0.00000
|
|
88 21H+4 -0.09057 0.00000 0.00000 0.00000 -0.17538
|
|
89 21H-4 0.00000 0.09057 0.00000 0.17538 0.00000
|
|
90 21H+5 0.00000 0.14656 0.00000 -0.16533 0.00000
|
|
91 21H-5 -0.14656 0.00000 0.00000 0.00000 0.16533
|
|
92 2 H 1S 0.24384 0.00000 -0.18303 0.00000 -0.02930
|
|
93 2S -0.84395 0.00000 0.62369 0.00000 -0.25662
|
|
94 3S 2.41257 0.00000 0.01241 0.00000 -1.21351
|
|
95 4S 0.41196 0.00000 1.62364 0.00000 -0.34676
|
|
96 5S 0.14875 0.00000 -0.01286 0.00000 0.05551
|
|
97 6PX 0.00000 0.00024 0.00000 0.01798 0.00000
|
|
98 6PY 0.11154 0.00000 -0.05894 0.00000 -0.00051
|
|
99 6PZ -0.03700 0.00000 0.07189 0.00000 0.08020
|
|
100 7PX 0.00000 -0.05748 0.00000 0.02855 0.00000
|
|
101 7PY 0.06500 0.00000 -0.03651 0.00000 0.28683
|
|
102 7PZ -0.04158 0.00000 -0.03508 0.00000 -0.14571
|
|
103 8PX 0.00000 -0.08911 0.00000 -0.10150 0.00000
|
|
104 8PY -0.81670 0.00000 -0.51986 0.00000 -0.73214
|
|
105 8PZ 0.62794 0.00000 -1.25152 0.00000 -1.01945
|
|
106 9PX 0.00000 0.11272 0.00000 -0.27919 0.00000
|
|
107 9PY -0.24503 0.00000 -0.72664 0.00000 -0.51601
|
|
108 9PZ 0.38344 0.00000 -0.53737 0.00000 -0.59879
|
|
109 10D 0 0.45082 0.00000 0.23556 0.00000 -0.50715
|
|
110 10D+1 0.00000 -0.27730 0.00000 0.35473 0.00000
|
|
111 10D-1 0.23328 0.00000 0.18674 0.00000 -0.07389
|
|
112 10D+2 -0.10353 0.00000 -0.40521 0.00000 0.29540
|
|
113 10D-2 0.00000 -0.26194 0.00000 0.10603 0.00000
|
|
114 11D 0 -0.36927 0.00000 -0.51085 0.00000 0.17360
|
|
115 11D+1 0.00000 0.17383 0.00000 -0.25112 0.00000
|
|
116 11D-1 -0.35089 0.00000 0.27066 0.00000 0.40647
|
|
117 11D+2 0.02511 0.00000 0.20372 0.00000 -0.37867
|
|
118 11D-2 0.00000 0.33134 0.00000 -0.11297 0.00000
|
|
119 12D 0 0.52421 0.00000 -0.58361 0.00000 -1.05823
|
|
120 12D+1 0.00000 -0.26418 0.00000 0.33844 0.00000
|
|
121 12D-1 -0.13012 0.00000 0.70971 0.00000 0.43142
|
|
122 12D+2 -0.51222 0.00000 -0.51909 0.00000 -0.71171
|
|
123 12D-2 0.00000 -0.29997 0.00000 0.28773 0.00000
|
|
124 13F 0 -0.19761 0.00000 0.07700 0.00000 -0.08589
|
|
125 13F+1 0.00000 0.15291 0.00000 0.01305 0.00000
|
|
126 13F-1 0.11871 0.00000 -0.20223 0.00000 -0.20948
|
|
127 13F+2 -0.09404 0.00000 0.04444 0.00000 -0.01863
|
|
128 13F-2 0.00000 0.00064 0.00000 -0.00294 0.00000
|
|
129 13F+3 0.00000 0.03126 0.00000 -0.04380 0.00000
|
|
130 13F-3 -0.51260 0.00000 0.04260 0.00000 -0.32283
|
|
131 14F 0 0.25769 0.00000 0.04686 0.00000 0.10320
|
|
132 14F+1 0.00000 -0.16955 0.00000 0.05845 0.00000
|
|
133 14F-1 -0.24009 0.00000 0.61775 0.00000 0.70837
|
|
134 14F+2 -0.02516 0.00000 0.19855 0.00000 0.14966
|
|
135 14F-2 0.00000 0.11179 0.00000 -0.15314 0.00000
|
|
136 14F+3 0.00000 -0.08050 0.00000 0.12052 0.00000
|
|
137 14F-3 0.59896 0.00000 0.16122 0.00000 0.48335
|
|
138 15G 0 0.06469 0.00000 0.18177 0.00000 0.38444
|
|
139 15G+1 0.00000 0.02156 0.00000 -0.00979 0.00000
|
|
140 15G-1 -0.29235 0.00000 -0.04126 0.00000 0.05914
|
|
141 15G+2 -0.05038 0.00000 0.35568 0.00000 0.34853
|
|
142 15G-2 0.00000 0.15555 0.00000 0.03596 0.00000
|
|
143 15G+3 0.00000 -0.00680 0.00000 -0.18206 0.00000
|
|
144 15G-3 0.18410 0.00000 -0.03536 0.00000 0.06310
|
|
145 15G+4 0.26651 0.00000 0.12109 0.00000 0.17887
|
|
146 15G-4 0.00000 -0.05755 0.00000 -0.19558 0.00000
|
|
147 3 H 1S -0.12192 0.21117 -0.18303 -0.02537 0.01465
|
|
148 2S 0.42197 -0.73088 0.62369 -0.22224 0.12831
|
|
149 3S -1.20629 2.08935 0.01241 -1.05093 0.60675
|
|
150 4S -0.20598 0.35677 1.62364 -0.30030 0.17338
|
|
151 5S -0.07438 0.12883 -0.01286 0.04807 -0.02775
|
|
152 6PX -0.04819 0.08371 -0.05104 0.00411 0.00800
|
|
153 6PY 0.02807 -0.04819 0.02947 0.00800 0.01336
|
|
154 6PZ 0.01850 -0.03204 0.07189 0.06946 -0.04010
|
|
155 7PX -0.05304 0.03438 -0.03162 0.22226 -0.11184
|
|
156 7PY -0.02686 -0.05304 0.01825 -0.11184 0.09312
|
|
157 7PZ 0.02079 -0.03601 -0.03508 -0.12619 0.07286
|
|
158 8PX 0.31506 -0.63480 -0.45021 -0.57448 0.27307
|
|
159 8PY -0.27101 0.31506 0.25993 0.27307 -0.25916
|
|
160 8PZ -0.31397 0.54381 -1.25152 -0.88287 0.50973
|
|
161 9PX 0.15491 -0.15559 -0.62929 -0.45681 0.10255
|
|
162 9PY 0.02328 0.15491 0.36332 0.10255 -0.33840
|
|
163 9PZ -0.19172 0.33207 -0.53737 -0.51857 0.29940
|
|
164 10D 0 -0.22541 0.39042 0.23556 -0.43920 0.25357
|
|
165 10D+1 -0.22109 0.10563 0.16172 0.03327 0.18559
|
|
166 10D-1 -0.14966 -0.22109 -0.09337 0.18559 0.24757
|
|
167 10D+2 -0.22234 -0.06859 0.20260 -0.08200 0.15337
|
|
168 10D-2 -0.06859 -0.14313 -0.35092 0.24806 -0.08200
|
|
169 11D 0 0.18463 -0.31980 -0.51085 0.15034 -0.08680
|
|
170 11D+1 0.22721 -0.21971 0.23439 0.24207 -0.28474
|
|
171 11D-1 0.04265 0.22721 -0.13533 -0.28474 -0.08672
|
|
172 11D+2 0.25478 0.13260 -0.10186 0.11505 -0.17940
|
|
173 11D-2 0.13260 0.10167 0.17643 -0.31225 0.11505
|
|
174 12D 0 -0.26210 0.45398 -0.58361 -0.91646 0.52912
|
|
175 12D+1 -0.05805 -0.16363 0.61463 0.40818 -0.04026
|
|
176 12D-1 -0.23066 -0.05805 -0.35486 -0.04026 0.36169
|
|
177 12D+2 -0.35303 0.09191 0.25955 0.43277 0.03787
|
|
178 12D-2 0.09191 -0.45916 -0.44955 -0.46185 0.43277
|
|
179 13F 0 0.09881 -0.17114 0.07700 -0.07438 0.04295
|
|
180 13F+1 0.01481 0.12726 -0.17514 -0.15385 0.09636
|
|
181 13F-1 0.14436 0.01481 0.10112 0.09636 -0.04258
|
|
182 13F+2 -0.02303 0.04100 -0.02222 0.00680 -0.00686
|
|
183 13F-2 0.04100 -0.07037 0.03849 -0.01471 0.00680
|
|
184 13F+3 -0.02707 -0.01563 0.00000 0.02190 0.03793
|
|
185 13F-3 0.25630 -0.44392 0.04260 -0.27958 0.16142
|
|
186 14F 0 -0.12884 0.22317 0.04686 0.08938 -0.05160
|
|
187 14F+1 0.03054 -0.22245 0.53499 0.54589 -0.28142
|
|
188 14F-1 -0.18718 0.03054 -0.30888 -0.28142 0.22093
|
|
189 14F+2 0.07755 0.05930 -0.09927 -0.13112 -0.07744
|
|
190 14F-2 0.05930 0.00907 0.17195 0.07396 -0.13112
|
|
191 14F+3 0.06972 0.04025 0.00000 -0.06026 -0.10437
|
|
192 14F-3 -0.29948 0.51871 0.16122 0.41860 -0.24168
|
|
193 15G 0 -0.03235 0.05602 0.18177 0.33294 -0.19222
|
|
194 15G+1 0.13593 -0.21387 -0.03573 0.04191 -0.02985
|
|
195 15G-1 -0.05692 0.13593 0.02063 -0.02985 0.00744
|
|
196 15G+2 0.10407 0.08917 -0.17784 -0.13535 0.11411
|
|
197 15G-2 0.08917 0.00111 0.30803 0.27039 -0.13535
|
|
198 15G+3 0.00589 0.00340 0.00000 0.09103 0.15767
|
|
199 15G-3 -0.09205 0.15943 -0.03536 0.05465 -0.03155
|
|
200 15G+4 0.10979 -0.09048 -0.06055 0.00723 0.19140
|
|
201 15G-4 0.09048 -0.21427 -0.10487 -0.18305 -0.00723
|
|
202 4 H 1S -0.12192 -0.21117 -0.18303 0.02537 0.01465
|
|
203 2S 0.42197 0.73088 0.62369 0.22224 0.12831
|
|
204 3S -1.20629 -2.08935 0.01241 1.05093 0.60675
|
|
205 4S -0.20598 -0.35677 1.62364 0.30030 0.17338
|
|
206 5S -0.07438 -0.12883 -0.01286 -0.04807 -0.02775
|
|
207 6PX 0.04819 0.08371 0.05104 0.00411 -0.00800
|
|
208 6PY 0.02807 0.04819 0.02947 -0.00800 0.01336
|
|
209 6PZ 0.01850 0.03204 0.07189 -0.06946 -0.04010
|
|
210 7PX 0.05304 0.03438 0.03162 0.22226 0.11184
|
|
211 7PY -0.02686 0.05304 0.01825 0.11184 0.09312
|
|
212 7PZ 0.02079 0.03601 -0.03508 0.12619 0.07286
|
|
213 8PX -0.31506 -0.63480 0.45021 -0.57448 -0.27307
|
|
214 8PY -0.27101 -0.31506 0.25993 -0.27307 -0.25916
|
|
215 8PZ -0.31397 -0.54381 -1.25152 0.88287 0.50973
|
|
216 9PX -0.15491 -0.15559 0.62929 -0.45681 -0.10255
|
|
217 9PY 0.02328 -0.15491 0.36332 -0.10255 -0.33840
|
|
218 9PZ -0.19172 -0.33207 -0.53737 0.51857 0.29940
|
|
219 10D 0 -0.22541 -0.39042 0.23556 0.43920 0.25357
|
|
220 10D+1 0.22109 0.10563 -0.16172 0.03327 -0.18559
|
|
221 10D-1 -0.14966 0.22109 -0.09337 -0.18559 0.24757
|
|
222 10D+2 -0.22234 0.06859 0.20260 0.08200 0.15337
|
|
223 10D-2 0.06859 -0.14313 0.35092 0.24806 0.08200
|
|
224 11D 0 0.18463 0.31980 -0.51085 -0.15034 -0.08680
|
|
225 11D+1 -0.22721 -0.21971 -0.23439 0.24207 0.28474
|
|
226 11D-1 0.04265 -0.22721 -0.13533 0.28474 -0.08672
|
|
227 11D+2 0.25478 -0.13260 -0.10186 -0.11505 -0.17940
|
|
228 11D-2 -0.13260 0.10167 -0.17643 -0.31225 -0.11505
|
|
229 12D 0 -0.26210 -0.45398 -0.58361 0.91646 0.52912
|
|
230 12D+1 0.05805 -0.16363 -0.61463 0.40818 0.04026
|
|
231 12D-1 -0.23066 0.05805 -0.35486 0.04026 0.36169
|
|
232 12D+2 -0.35303 -0.09191 0.25955 -0.43277 0.03787
|
|
233 12D-2 -0.09191 -0.45916 0.44955 -0.46185 -0.43277
|
|
234 13F 0 0.09881 0.17114 0.07700 0.07438 0.04295
|
|
235 13F+1 -0.01481 0.12726 0.17514 -0.15385 -0.09636
|
|
236 13F-1 0.14436 -0.01481 0.10112 -0.09636 -0.04258
|
|
237 13F+2 -0.02303 -0.04100 -0.02222 -0.00680 -0.00686
|
|
238 13F-2 -0.04100 -0.07037 -0.03849 -0.01471 -0.00680
|
|
239 13F+3 0.02707 -0.01563 0.00000 0.02190 -0.03793
|
|
240 13F-3 0.25630 0.44392 0.04260 0.27958 0.16142
|
|
241 14F 0 -0.12884 -0.22317 0.04686 -0.08938 -0.05160
|
|
242 14F+1 -0.03054 -0.22245 -0.53499 0.54589 0.28142
|
|
243 14F-1 -0.18718 -0.03054 -0.30888 0.28142 0.22093
|
|
244 14F+2 0.07755 -0.05930 -0.09927 0.13112 -0.07744
|
|
245 14F-2 -0.05930 0.00907 -0.17195 0.07396 0.13112
|
|
246 14F+3 -0.06972 0.04025 0.00000 -0.06026 0.10437
|
|
247 14F-3 -0.29948 -0.51871 0.16122 -0.41860 -0.24168
|
|
248 15G 0 -0.03235 -0.05602 0.18177 -0.33294 -0.19222
|
|
249 15G+1 -0.13593 -0.21387 0.03573 0.04191 0.02985
|
|
250 15G-1 -0.05692 -0.13593 0.02063 0.02985 0.00744
|
|
251 15G+2 0.10407 -0.08917 -0.17784 0.13535 0.11411
|
|
252 15G-2 -0.08917 0.00111 -0.30803 0.27039 0.13535
|
|
253 15G+3 -0.00589 0.00340 0.00000 0.09103 -0.15767
|
|
254 15G-3 -0.09205 -0.15943 -0.03536 -0.05465 -0.03155
|
|
255 15G+4 0.10979 0.09048 -0.06055 -0.00723 0.19140
|
|
256 15G-4 -0.09048 -0.21427 0.10487 -0.18305 0.00723
|
|
191 192 193 194 195
|
|
(A2)--V (E)--V (E)--V (A1)--V (E)--V
|
|
Eigenvalues -- 13.87981 13.98999 13.98999 14.07417 14.11583
|
|
1 1 N 1S 0.00000 0.00000 0.00000 -0.00870 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 0.13664 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 0.58428 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 -0.52051 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 0.22438 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 -0.20028 0.00000
|
|
7 7PX 0.00000 0.00000 0.26942 0.00000 -0.05881
|
|
8 7PY 0.00000 0.26942 0.00000 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 -0.15436 0.00000
|
|
10 8PX 0.00000 0.00000 -1.05496 0.00000 -0.29348
|
|
11 8PY 0.00000 -1.05496 0.00000 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.05473 0.00000
|
|
13 9PX 0.00000 0.00000 2.93623 0.00000 -0.43627
|
|
14 9PY 0.00000 2.93623 0.00000 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.78449 0.00000
|
|
16 10PX 0.00000 0.00000 1.28462 0.00000 2.18711
|
|
17 10PY 0.00000 1.28462 0.00000 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.83698 0.00000
|
|
19 11PX 0.00000 0.00000 -0.08090 0.00000 0.03345
|
|
20 11PY 0.00000 -0.08090 0.00000 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.10442 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 -0.00173 0.00000
|
|
23 12D+1 0.00000 0.00000 -0.02130 0.00000 -0.11913
|
|
24 12D-1 0.00000 -0.02130 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.08302 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.08302 0.00000 0.00517
|
|
27 13D 0 0.00000 0.00000 0.00000 0.02622 0.00000
|
|
28 13D+1 0.00000 0.00000 -0.12290 0.00000 0.21868
|
|
29 13D-1 0.00000 -0.12290 0.00000 0.00000 0.00000
|
|
30 13D+2 0.00000 0.16314 0.00000 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.16314 0.00000 0.17610
|
|
32 14D 0 0.00000 0.00000 0.00000 -0.59747 0.00000
|
|
33 14D+1 0.00000 0.00000 -0.39951 0.00000 -0.49886
|
|
34 14D-1 0.00000 -0.39951 0.00000 0.00000 0.00000
|
|
35 14D+2 0.00000 0.60524 0.00000 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.60524 0.00000 -0.08915
|
|
37 15D 0 0.00000 0.00000 0.00000 -0.59154 0.00000
|
|
38 15D+1 0.00000 0.00000 0.26720 0.00000 -0.97029
|
|
39 15D-1 0.00000 0.26720 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 0.05478 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.05478 0.00000 -0.55508
|
|
42 16F 0 0.00000 0.00000 0.00000 0.28589 0.00000
|
|
43 16F+1 0.00000 0.00000 -0.29588 0.00000 0.10357
|
|
44 16F-1 0.00000 -0.29588 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.15249 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.15249 0.00000 -0.08563
|
|
47 16F+3 0.05153 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 -0.07471 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 -0.23209 0.00000
|
|
50 17F+1 0.00000 0.00000 -0.08356 0.00000 0.06336
|
|
51 17F-1 0.00000 -0.08356 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 -0.54207 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 -0.54207 0.00000 0.17371
|
|
54 17F+3 -0.20321 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 -0.05451 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.28305 0.00000
|
|
57 18F+1 0.00000 0.00000 -1.10004 0.00000 0.15455
|
|
58 18F-1 0.00000 -1.10004 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 -0.31632 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 -0.31632 0.00000 0.47834
|
|
61 18F+3 0.22801 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 -0.47841 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 -0.31914 0.00000
|
|
64 19G+1 0.00000 0.00000 0.04195 0.00000 -0.06863
|
|
65 19G-1 0.00000 0.04195 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 -0.35622 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 -0.35622 0.00000 0.12766
|
|
68 19G+3 -0.03530 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 -0.28507 0.00000
|
|
70 19G+4 0.00000 -0.21259 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.21259 0.00000 0.04120
|
|
72 20G 0 0.00000 0.00000 0.00000 0.07993 0.00000
|
|
73 20G+1 0.00000 0.00000 0.31829 0.00000 0.08986
|
|
74 20G-1 0.00000 0.31829 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.72461 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.72461 0.00000 -0.31687
|
|
77 20G+3 0.03213 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.04782 0.00000
|
|
79 20G+4 0.00000 0.84088 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 -0.84088 0.00000 -0.32698
|
|
81 21H 0 0.00000 0.00000 0.00000 0.08653 0.00000
|
|
82 21H+1 0.00000 0.00000 0.18819 0.00000 -0.39741
|
|
83 21H-1 0.00000 0.18819 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 -0.16311 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 -0.16311 0.00000 -0.12630
|
|
86 21H+3 -0.10247 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.35557 0.00000
|
|
88 21H+4 0.00000 -0.45628 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.45628 0.00000 -0.00042
|
|
90 21H+5 0.00000 0.00000 -0.06791 0.00000 0.03131
|
|
91 21H-5 0.00000 0.06791 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.05982 0.00000 0.25984 0.00000
|
|
93 2S 0.00000 -0.50959 0.00000 -0.55679 0.00000
|
|
94 3S 0.00000 -0.45755 0.00000 0.37242 0.00000
|
|
95 4S 0.00000 -0.16623 0.00000 -0.07588 0.00000
|
|
96 5S 0.00000 0.03771 0.00000 0.03525 0.00000
|
|
97 6PX 0.05350 0.00000 -0.00534 0.00000 -0.04826
|
|
98 6PY 0.00000 -0.16739 0.00000 0.14667 0.00000
|
|
99 6PZ 0.00000 0.02000 0.00000 -0.00137 0.00000
|
|
100 7PX 0.05375 0.00000 -0.10115 0.00000 -0.00270
|
|
101 7PY 0.00000 0.42557 0.00000 -0.13934 0.00000
|
|
102 7PZ 0.00000 -0.31498 0.00000 0.01936 0.00000
|
|
103 8PX -0.16635 0.00000 -1.14245 0.00000 -0.11783
|
|
104 8PY 0.00000 -0.43746 0.00000 -0.24067 0.00000
|
|
105 8PZ 0.00000 -1.10263 0.00000 -0.38078 0.00000
|
|
106 9PX -0.45915 0.00000 -0.32390 0.00000 -0.13651
|
|
107 9PY 0.00000 0.11567 0.00000 -0.10759 0.00000
|
|
108 9PZ 0.00000 -0.10458 0.00000 -0.27834 0.00000
|
|
109 10D 0 0.00000 0.02827 0.00000 0.15997 0.00000
|
|
110 10D+1 0.74231 0.00000 -0.06127 0.00000 0.50974
|
|
111 10D-1 0.00000 -0.33775 0.00000 0.14645 0.00000
|
|
112 10D+2 0.00000 0.22379 0.00000 0.04933 0.00000
|
|
113 10D-2 0.34035 0.00000 0.31471 0.00000 0.46677
|
|
114 11D 0 0.00000 -0.41097 0.00000 -0.29791 0.00000
|
|
115 11D+1 -0.69561 0.00000 -0.08903 0.00000 -0.55523
|
|
116 11D-1 0.00000 0.74175 0.00000 -0.09918 0.00000
|
|
117 11D+2 0.00000 -0.29344 0.00000 -0.15974 0.00000
|
|
118 11D-2 -0.34766 0.00000 0.26921 0.00000 -0.37155
|
|
119 12D 0 0.00000 0.00305 0.00000 -0.05177 0.00000
|
|
120 12D+1 0.39908 0.00000 -0.50733 0.00000 0.10899
|
|
121 12D-1 0.00000 -0.06004 0.00000 0.32318 0.00000
|
|
122 12D+2 0.00000 -0.03348 0.00000 -0.04111 0.00000
|
|
123 12D-2 0.70460 0.00000 0.74565 0.00000 0.17518
|
|
124 13F 0 0.00000 -0.06345 0.00000 -0.07103 0.00000
|
|
125 13F+1 -0.09778 0.00000 0.04551 0.00000 0.13052
|
|
126 13F-1 0.00000 0.48447 0.00000 0.05079 0.00000
|
|
127 13F+2 0.00000 0.14228 0.00000 -0.11102 0.00000
|
|
128 13F-2 0.10725 0.00000 -0.14918 0.00000 -0.07645
|
|
129 13F+3 -0.21992 0.00000 0.04121 0.00000 0.14476
|
|
130 13F-3 0.00000 -0.05212 0.00000 0.07074 0.00000
|
|
131 14F 0 0.00000 0.03762 0.00000 0.02467 0.00000
|
|
132 14F+1 0.15178 0.00000 0.01014 0.00000 -0.18893
|
|
133 14F-1 0.00000 -0.23603 0.00000 0.05858 0.00000
|
|
134 14F+2 0.00000 -0.04928 0.00000 0.21231 0.00000
|
|
135 14F-2 -0.10212 0.00000 0.38455 0.00000 0.13893
|
|
136 14F+3 0.35033 0.00000 0.45411 0.00000 -0.09089
|
|
137 14F-3 0.00000 0.04290 0.00000 -0.00097 0.00000
|
|
138 15G 0 0.00000 -0.01242 0.00000 -0.12922 0.00000
|
|
139 15G+1 -0.05333 0.00000 0.03598 0.00000 -0.14575
|
|
140 15G-1 0.00000 -0.11555 0.00000 0.00693 0.00000
|
|
141 15G+2 0.00000 -0.18978 0.00000 0.05801 0.00000
|
|
142 15G-2 -0.09206 0.00000 0.04819 0.00000 0.10332
|
|
143 15G+3 -0.00598 0.00000 0.23922 0.00000 0.06601
|
|
144 15G-3 0.00000 0.00187 0.00000 -0.41805 0.00000
|
|
145 15G+4 0.00000 0.05147 0.00000 0.16760 0.00000
|
|
146 15G-4 -0.17950 0.00000 -0.40216 0.00000 -0.12888
|
|
147 3 H 1S 0.00000 0.02991 -0.05181 0.25984 -0.11596
|
|
148 2S 0.00000 0.25480 -0.44132 -0.55679 -0.26711
|
|
149 3S 0.00000 0.22877 -0.39625 0.37242 -1.04521
|
|
150 4S 0.00000 0.08311 -0.14396 -0.07588 -0.21649
|
|
151 5S 0.00000 -0.01886 0.03266 0.03525 0.06163
|
|
152 6PX -0.02675 0.07017 -0.12687 0.12702 -0.08864
|
|
153 6PY -0.04634 -0.04585 0.07017 -0.07334 0.02331
|
|
154 6PZ 0.00000 -0.01000 0.01732 -0.00137 -0.00103
|
|
155 7PX -0.02687 -0.22808 0.29389 -0.12068 0.33258
|
|
156 7PY -0.04655 0.03053 -0.22808 0.06967 -0.19358
|
|
157 7PZ 0.00000 0.15749 -0.27278 0.01936 -0.09637
|
|
158 8PX 0.08317 -0.30527 -0.61371 -0.20843 -0.17696
|
|
159 8PY 0.14406 -0.96621 -0.30527 0.12034 0.03414
|
|
160 8PZ 0.00000 0.55132 -0.95491 -0.38078 0.46764
|
|
161 9PX 0.22957 -0.19034 0.00578 -0.09318 -0.15322
|
|
162 9PY 0.39763 -0.21401 -0.19034 0.05380 0.00965
|
|
163 9PZ 0.00000 0.05229 -0.09057 -0.27834 0.14249
|
|
164 10D 0 0.00000 -0.01413 0.02448 0.15997 0.29782
|
|
165 10D+1 -0.37115 0.11972 -0.26863 0.12683 0.20752
|
|
166 10D-1 -0.64286 -0.13039 0.11972 -0.07322 0.17449
|
|
167 10D+2 -0.29475 0.29198 0.03937 -0.02466 0.29722
|
|
168 10D-2 -0.17017 0.03937 0.24652 0.04272 -0.04803
|
|
169 11D 0 0.00000 0.20549 -0.35591 -0.29791 -0.14704
|
|
170 11D+1 0.34780 -0.35974 0.53405 -0.08589 -0.29954
|
|
171 11D-1 0.60242 0.11866 -0.35974 0.04959 -0.14762
|
|
172 11D+2 0.30109 0.12855 0.24364 0.07987 -0.30367
|
|
173 11D-2 0.17383 0.24364 -0.15278 -0.13834 0.15443
|
|
174 12D 0 0.00000 -0.00153 0.00264 -0.05177 0.02780
|
|
175 12D+1 -0.19954 -0.19368 -0.17186 0.27989 -0.33261
|
|
176 12D-1 -0.34561 -0.39550 -0.19368 -0.16159 0.25496
|
|
177 12D+2 -0.61020 0.55087 0.33737 0.02055 0.30815
|
|
178 12D-2 -0.35230 0.33737 0.16130 -0.03560 -0.35856
|
|
179 13F 0 0.00000 0.03172 -0.05495 -0.07103 0.14264
|
|
180 13F+1 0.04889 -0.19007 0.37473 0.04398 -0.09844
|
|
181 13F-1 0.08468 0.15525 -0.19007 -0.02539 0.13219
|
|
182 13F+2 -0.09288 -0.07632 -0.12620 0.05551 -0.08251
|
|
183 13F-2 -0.05362 -0.12620 0.06941 -0.09615 0.06646
|
|
184 13F+3 -0.21992 -0.03569 -0.02061 0.00000 -0.07238
|
|
185 13F-3 0.00000 0.02606 -0.04513 0.07074 -0.18713
|
|
186 14F 0 0.00000 -0.01881 0.03258 0.02467 -0.23827
|
|
187 14F+1 -0.07589 0.10660 -0.17449 0.05073 -0.03918
|
|
188 14F-1 -0.13144 -0.05140 0.10660 -0.02929 -0.08646
|
|
189 14F+2 0.08844 0.27609 0.18786 -0.10616 0.15252
|
|
190 14F-2 0.05106 0.18786 0.05918 0.18387 -0.12525
|
|
191 14F+3 0.35033 -0.39327 -0.22705 0.00000 0.04545
|
|
192 14F-3 0.00000 -0.02145 0.03715 -0.00097 0.24407
|
|
193 15G 0 0.00000 0.00621 -0.01076 -0.12922 -0.27891
|
|
194 15G+1 0.02666 0.06562 -0.07767 0.00600 0.15242
|
|
195 15G-1 0.04618 -0.00190 0.06562 -0.00346 -0.17215
|
|
196 15G+2 0.07973 -0.01130 0.10305 -0.02901 0.04919
|
|
197 15G-2 0.04603 0.10305 -0.13029 0.05024 0.01812
|
|
198 15G+3 -0.00598 -0.20717 -0.11961 0.00000 -0.03300
|
|
199 15G-3 0.00000 -0.00094 0.00162 -0.41805 -0.08198
|
|
200 15G+4 -0.15545 0.31449 0.15185 -0.08380 -0.07212
|
|
201 15G-4 0.08975 -0.15185 -0.13915 -0.14515 -0.25379
|
|
202 4 H 1S 0.00000 0.02991 0.05181 0.25984 0.11596
|
|
203 2S 0.00000 0.25480 0.44132 -0.55679 0.26711
|
|
204 3S 0.00000 0.22877 0.39625 0.37242 1.04521
|
|
205 4S 0.00000 0.08311 0.14396 -0.07588 0.21649
|
|
206 5S 0.00000 -0.01886 -0.03266 0.03525 -0.06163
|
|
207 6PX -0.02675 -0.07017 -0.12687 -0.12702 -0.08864
|
|
208 6PY 0.04634 -0.04585 -0.07017 -0.07334 -0.02331
|
|
209 6PZ 0.00000 -0.01000 -0.01732 -0.00137 0.00103
|
|
210 7PX -0.02687 0.22808 0.29389 0.12068 0.33258
|
|
211 7PY 0.04655 0.03053 0.22808 0.06967 0.19358
|
|
212 7PZ 0.00000 0.15749 0.27278 0.01936 0.09637
|
|
213 8PX 0.08317 0.30527 -0.61371 0.20843 -0.17696
|
|
214 8PY -0.14406 -0.96621 0.30527 0.12034 -0.03414
|
|
215 8PZ 0.00000 0.55132 0.95491 -0.38078 -0.46764
|
|
216 9PX 0.22957 0.19034 0.00578 0.09318 -0.15322
|
|
217 9PY -0.39763 -0.21401 0.19034 0.05380 -0.00965
|
|
218 9PZ 0.00000 0.05229 0.09057 -0.27834 -0.14249
|
|
219 10D 0 0.00000 -0.01413 -0.02448 0.15997 -0.29782
|
|
220 10D+1 -0.37115 -0.11972 -0.26863 -0.12683 0.20752
|
|
221 10D-1 0.64286 -0.13039 -0.11972 -0.07322 -0.17449
|
|
222 10D+2 0.29475 0.29198 -0.03937 -0.02466 -0.29722
|
|
223 10D-2 -0.17017 -0.03937 0.24652 -0.04272 -0.04803
|
|
224 11D 0 0.00000 0.20549 0.35591 -0.29791 0.14704
|
|
225 11D+1 0.34780 0.35974 0.53405 0.08589 -0.29954
|
|
226 11D-1 -0.60242 0.11866 0.35974 0.04959 0.14762
|
|
227 11D+2 -0.30109 0.12855 -0.24364 0.07987 0.30367
|
|
228 11D-2 0.17383 -0.24364 -0.15278 0.13834 0.15443
|
|
229 12D 0 0.00000 -0.00153 -0.00264 -0.05177 -0.02780
|
|
230 12D+1 -0.19954 0.19368 -0.17186 -0.27989 -0.33261
|
|
231 12D-1 0.34561 -0.39550 0.19368 -0.16159 -0.25496
|
|
232 12D+2 0.61020 0.55087 -0.33737 0.02055 -0.30815
|
|
233 12D-2 -0.35230 -0.33737 0.16130 0.03560 -0.35856
|
|
234 13F 0 0.00000 0.03172 0.05495 -0.07103 -0.14264
|
|
235 13F+1 0.04889 0.19007 0.37473 -0.04398 -0.09844
|
|
236 13F-1 -0.08468 0.15525 0.19007 -0.02539 -0.13219
|
|
237 13F+2 0.09288 -0.07632 0.12620 0.05551 0.08251
|
|
238 13F-2 -0.05362 0.12620 0.06941 0.09615 0.06646
|
|
239 13F+3 -0.21992 0.03569 -0.02061 0.00000 -0.07238
|
|
240 13F-3 0.00000 0.02606 0.04513 0.07074 0.18713
|
|
241 14F 0 0.00000 -0.01881 -0.03258 0.02467 0.23827
|
|
242 14F+1 -0.07589 -0.10660 -0.17449 -0.05073 -0.03918
|
|
243 14F-1 0.13144 -0.05140 -0.10660 -0.02929 0.08646
|
|
244 14F+2 -0.08844 0.27609 -0.18786 -0.10616 -0.15252
|
|
245 14F-2 0.05106 -0.18786 0.05918 -0.18387 -0.12525
|
|
246 14F+3 0.35033 0.39327 -0.22705 0.00000 0.04545
|
|
247 14F-3 0.00000 -0.02145 -0.03715 -0.00097 -0.24407
|
|
248 15G 0 0.00000 0.00621 0.01076 -0.12922 0.27891
|
|
249 15G+1 0.02666 -0.06562 -0.07767 -0.00600 0.15242
|
|
250 15G-1 -0.04618 -0.00190 -0.06562 -0.00346 0.17215
|
|
251 15G+2 -0.07973 -0.01130 -0.10305 -0.02901 -0.04919
|
|
252 15G-2 0.04603 -0.10305 -0.13029 -0.05024 0.01812
|
|
253 15G+3 -0.00598 0.20717 -0.11961 0.00000 -0.03300
|
|
254 15G-3 0.00000 -0.00094 -0.00162 -0.41805 0.08198
|
|
255 15G+4 0.15545 0.31449 -0.15185 -0.08380 0.07212
|
|
256 15G-4 0.08975 0.15185 -0.13915 0.14515 -0.25379
|
|
196 197 198 199 200
|
|
(E)--V (E)--V (E)--V (A1)--V (A1)--V
|
|
Eigenvalues -- 14.11583 14.24801 14.24801 14.42993 14.52891
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.02445 0.02255
|
|
2 2S 0.00000 0.00000 0.00000 -0.14328 -0.05158
|
|
3 3S 0.00000 0.00000 0.00000 -0.48742 0.39281
|
|
4 4S 0.00000 0.00000 0.00000 0.43357 -4.14402
|
|
5 5S 0.00000 0.00000 0.00000 0.05885 6.09084
|
|
6 6S 0.00000 0.00000 0.00000 0.16073 1.10726
|
|
7 7PX 0.00000 0.06519 0.00000 0.00000 0.00000
|
|
8 7PY -0.05881 0.00000 0.06519 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.43255 -0.48644
|
|
10 8PX 0.00000 -0.12818 0.00000 0.00000 0.00000
|
|
11 8PY -0.29348 0.00000 -0.12818 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 -1.24553 1.39030
|
|
13 9PX 0.00000 0.16426 0.00000 0.00000 0.00000
|
|
14 9PY -0.43627 0.00000 0.16426 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 2.66974 -1.66379
|
|
16 10PX 0.00000 -0.74381 0.00000 0.00000 0.00000
|
|
17 10PY 2.18711 0.00000 -0.74381 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.84346 -1.09083
|
|
19 11PX 0.00000 -0.22275 0.00000 0.00000 0.00000
|
|
20 11PY 0.03345 0.00000 -0.22275 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 -0.11605 -0.01109
|
|
22 12D 0 0.00000 0.00000 0.00000 -0.06594 -0.08314
|
|
23 12D+1 0.00000 0.11850 0.00000 0.00000 0.00000
|
|
24 12D-1 -0.11913 0.00000 0.11850 0.00000 0.00000
|
|
25 12D+2 0.00517 0.00000 0.02253 0.00000 0.00000
|
|
26 12D-2 0.00000 0.02253 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.30613 0.29246
|
|
28 13D+1 0.00000 -0.18757 0.00000 0.00000 0.00000
|
|
29 13D-1 0.21868 0.00000 -0.18757 0.00000 0.00000
|
|
30 13D+2 0.17610 0.00000 -0.28901 0.00000 0.00000
|
|
31 13D-2 0.00000 -0.28901 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 -1.59647 -0.44283
|
|
33 14D+1 0.00000 0.97777 0.00000 0.00000 0.00000
|
|
34 14D-1 -0.49886 0.00000 0.97777 0.00000 0.00000
|
|
35 14D+2 -0.08915 0.00000 -0.76688 0.00000 0.00000
|
|
36 14D-2 0.00000 -0.76688 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 -0.03777 -0.65428
|
|
38 15D+1 0.00000 0.72624 0.00000 0.00000 0.00000
|
|
39 15D-1 -0.97029 0.00000 0.72624 0.00000 0.00000
|
|
40 15D+2 -0.55508 0.00000 0.59082 0.00000 0.00000
|
|
41 15D-2 0.00000 0.59082 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 -0.56084 0.66744
|
|
43 16F+1 0.00000 0.16247 0.00000 0.00000 0.00000
|
|
44 16F-1 0.10357 0.00000 0.16247 0.00000 0.00000
|
|
45 16F+2 -0.08563 0.00000 -0.48770 0.00000 0.00000
|
|
46 16F-2 0.00000 -0.48770 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 -0.35048 -0.17639
|
|
49 17F 0 0.00000 0.00000 0.00000 0.11134 -0.45465
|
|
50 17F+1 0.00000 -0.59195 0.00000 0.00000 0.00000
|
|
51 17F-1 0.06336 0.00000 -0.59195 0.00000 0.00000
|
|
52 17F+2 0.17371 0.00000 0.52899 0.00000 0.00000
|
|
53 17F-2 0.00000 0.52899 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 -0.10802 0.14857
|
|
56 18F 0 0.00000 0.00000 0.00000 -1.08319 0.62139
|
|
57 18F+1 0.00000 -0.50029 0.00000 0.00000 0.00000
|
|
58 18F-1 0.15455 0.00000 -0.50029 0.00000 0.00000
|
|
59 18F+2 0.47834 0.00000 -0.87491 0.00000 0.00000
|
|
60 18F-2 0.00000 -0.87491 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 -0.96596 -1.12302
|
|
63 19G 0 0.00000 0.00000 0.00000 -0.39444 -0.23825
|
|
64 19G+1 0.00000 0.17875 0.00000 0.00000 0.00000
|
|
65 19G-1 -0.06863 0.00000 0.17875 0.00000 0.00000
|
|
66 19G+2 0.12766 0.00000 -0.24580 0.00000 0.00000
|
|
67 19G-2 0.00000 -0.24580 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 -0.13335 -0.53678
|
|
70 19G+4 -0.04120 0.00000 -0.11786 0.00000 0.00000
|
|
71 19G-4 0.00000 0.11786 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 1.01152 0.27473
|
|
73 20G+1 0.00000 0.06216 0.00000 0.00000 0.00000
|
|
74 20G-1 0.08986 0.00000 0.06216 0.00000 0.00000
|
|
75 20G+2 -0.31687 0.00000 0.60879 0.00000 0.00000
|
|
76 20G-2 0.00000 0.60879 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 -0.39908 0.63231
|
|
79 20G+4 0.32698 0.00000 0.52643 0.00000 0.00000
|
|
80 20G-4 0.00000 -0.52643 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 -0.07747 -0.19454
|
|
82 21H+1 0.00000 0.08332 0.00000 0.00000 0.00000
|
|
83 21H-1 -0.39741 0.00000 0.08332 0.00000 0.00000
|
|
84 21H+2 -0.12630 0.00000 -0.13731 0.00000 0.00000
|
|
85 21H-2 0.00000 -0.13731 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.48850 -0.10048
|
|
88 21H+4 0.00042 0.00000 -0.16421 0.00000 0.00000
|
|
89 21H-4 0.00000 0.16421 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 -0.31606 0.00000 0.00000 0.00000
|
|
91 21H-5 -0.03131 0.00000 0.31606 0.00000 0.00000
|
|
92 2 H 1S -0.13390 0.00000 -0.42287 0.01262 0.19108
|
|
93 2S -0.30843 0.00000 0.47212 0.23618 -0.79621
|
|
94 3S -1.20691 0.00000 0.39939 0.01428 -1.62179
|
|
95 4S -0.24998 0.00000 0.04068 -0.17847 -0.29398
|
|
96 5S 0.07117 0.00000 -0.05514 0.00764 -0.01363
|
|
97 6PX 0.00000 -0.10877 0.00000 0.00000 0.00000
|
|
98 6PY -0.10210 0.00000 -0.32858 0.04359 0.07885
|
|
99 6PZ -0.00119 0.00000 0.04941 -0.07312 -0.05820
|
|
100 7PX 0.00000 0.00107 0.00000 0.00000 0.00000
|
|
101 7PY 0.44435 0.00000 0.44486 -0.23045 0.06462
|
|
102 7PZ -0.11128 0.00000 -0.28595 0.02723 -0.03338
|
|
103 8PX 0.00000 -0.12097 0.00000 0.00000 0.00000
|
|
104 8PY -0.19667 0.00000 -0.56721 -0.40447 0.40881
|
|
105 8PZ 0.53999 0.00000 -0.92557 -1.27492 -0.22678
|
|
106 9PX 0.00000 0.33977 0.00000 0.00000 0.00000
|
|
107 9PY -0.15879 0.00000 0.36940 0.07128 -0.02955
|
|
108 9PZ 0.16453 0.00000 -0.18854 -0.06704 -0.05699
|
|
109 10D 0 0.34389 0.00000 -0.08099 0.28686 0.12272
|
|
110 10D+1 0.00000 -0.22435 0.00000 0.00000 0.00000
|
|
111 10D-1 0.10678 0.00000 0.14032 -0.12105 0.21120
|
|
112 10D+2 -0.21963 0.00000 -0.04872 0.00406 -0.06089
|
|
113 10D-2 0.00000 -0.23812 0.00000 0.00000 0.00000
|
|
114 11D 0 -0.16979 0.00000 -0.32704 -0.71020 -0.14157
|
|
115 11D+1 0.00000 0.28826 0.00000 0.00000 0.00000
|
|
116 11D-1 -0.21431 0.00000 0.29086 0.58747 -0.23072
|
|
117 11D+2 0.32976 0.00000 0.01307 -0.27901 0.05666
|
|
118 11D-2 0.00000 0.33854 0.00000 0.00000 0.00000
|
|
119 12D 0 0.03210 0.00000 -0.07530 -0.41581 -0.03255
|
|
120 12D+1 0.00000 -0.00360 0.00000 0.00000 0.00000
|
|
121 12D-1 -0.47981 0.00000 0.39415 0.07919 -0.13805
|
|
122 12D+2 -0.53647 0.00000 -0.09928 0.15482 -0.17547
|
|
123 12D-2 0.00000 -0.62195 0.00000 0.00000 0.00000
|
|
124 13F 0 0.16471 0.00000 -0.05674 0.19663 0.13600
|
|
125 13F+1 0.00000 0.14965 0.00000 0.00000 0.00000
|
|
126 13F-1 -0.17476 0.00000 0.29421 0.16848 0.00984
|
|
127 13F+2 0.11409 0.00000 0.04850 0.18989 0.07734
|
|
128 13F-2 0.00000 0.02004 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.39469 0.00000 0.00000 0.00000
|
|
130 13F-3 -0.21608 0.00000 -0.12248 0.19298 -0.01332
|
|
131 14F 0 -0.27513 0.00000 0.01813 -0.20836 -0.16331
|
|
132 14F+1 0.00000 -0.13862 0.00000 0.00000 0.00000
|
|
133 14F-1 0.01074 0.00000 0.01919 0.26229 0.01489
|
|
134 14F+2 -0.21331 0.00000 0.21413 -0.06977 -0.27055
|
|
135 14F-2 0.00000 -0.19458 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 -0.52339 0.00000 0.00000 0.00000
|
|
137 14F-3 0.28183 0.00000 0.13029 -0.10370 0.07071
|
|
138 15G 0 -0.32206 0.00000 -0.04908 -0.09339 0.10738
|
|
139 15G+1 0.00000 -0.06044 0.00000 0.00000 0.00000
|
|
140 15G-1 0.25180 0.00000 -0.05754 0.27484 0.01451
|
|
141 15G+2 -0.01028 0.00000 0.15266 0.06511 0.00312
|
|
142 15G-2 0.00000 0.15792 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 -0.15674 0.00000 0.00000 0.00000
|
|
144 15G-3 -0.09467 0.00000 -0.33402 0.10029 0.34476
|
|
145 15G+4 0.29543 0.00000 0.09633 -0.02644 0.09354
|
|
146 15G-4 0.00000 0.28666 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.06695 -0.36622 0.21144 0.01262 0.19108
|
|
148 2S 0.15421 0.40886 -0.23606 0.23618 -0.79621
|
|
149 3S 0.60345 0.34588 -0.19969 0.01428 -1.62179
|
|
150 4S 0.12499 0.03523 -0.02034 -0.17847 -0.29398
|
|
151 5S -0.03558 -0.04775 0.02757 0.00764 -0.01363
|
|
152 6PX 0.02331 -0.27362 0.09518 0.03775 0.06828
|
|
153 6PY -0.06172 0.09518 -0.16372 -0.02179 -0.03942
|
|
154 6PZ 0.00059 0.04279 -0.02470 -0.07312 -0.05820
|
|
155 7PX -0.19358 0.33391 -0.19217 -0.19958 0.05596
|
|
156 7PY 0.10906 -0.19217 0.11202 0.11523 -0.03231
|
|
157 7PZ 0.05564 -0.24764 0.14298 0.02723 -0.03338
|
|
158 8PX 0.03414 -0.45565 0.19323 -0.35028 0.35404
|
|
159 8PY -0.13754 0.19323 -0.23253 0.20224 -0.20440
|
|
160 8PZ -0.26999 -0.80157 0.46279 -1.27492 -0.22678
|
|
161 9PX 0.00965 0.36199 -0.01283 0.06173 -0.02559
|
|
162 9PY -0.14208 -0.01283 0.34718 -0.03564 0.01477
|
|
163 9PZ -0.08226 -0.16328 0.09427 -0.06704 -0.05699
|
|
164 10D 0 -0.17195 -0.07014 0.04050 0.28686 0.12272
|
|
165 10D+1 0.17449 0.04916 -0.15791 -0.10484 0.18291
|
|
166 10D-1 0.40900 -0.15791 -0.13318 0.06053 -0.10560
|
|
167 10D+2 0.29517 -0.08201 -0.19077 -0.00203 0.03044
|
|
168 10D-2 0.29722 -0.09607 -0.08201 0.00352 -0.05273
|
|
169 11D 0 0.08490 -0.28323 0.16352 -0.71020 -0.14157
|
|
170 11D+1 -0.14762 0.29021 -0.00113 0.50877 -0.19981
|
|
171 11D-1 -0.47000 -0.00113 0.28891 -0.29374 0.11536
|
|
172 11D+2 -0.19622 0.14093 0.25717 0.13950 -0.02833
|
|
173 11D-2 -0.30367 0.09444 0.14093 -0.24163 0.04907
|
|
174 12D 0 -0.01605 -0.06521 0.03765 -0.41581 -0.03255
|
|
175 12D+1 0.25496 0.29471 -0.17223 0.06858 -0.11955
|
|
176 12D-1 -0.03821 -0.17223 0.09583 -0.03959 0.06902
|
|
177 12D+2 -0.00273 -0.22633 -0.49128 -0.07741 0.08774
|
|
178 12D-2 0.30815 -0.22995 -0.22633 0.13408 -0.15196
|
|
179 13F 0 -0.08235 -0.04914 0.02837 0.19663 0.13600
|
|
180 13F+1 0.13219 0.25807 -0.06260 0.14591 0.00852
|
|
181 13F-1 0.05420 -0.06260 0.18579 -0.08424 -0.00492
|
|
182 13F+2 -0.02881 -0.01232 0.02715 -0.09494 -0.03867
|
|
183 13F-2 -0.08251 0.04138 -0.01232 0.16445 0.06698
|
|
184 13F+3 -0.12537 -0.19735 -0.34181 0.00000 0.00000
|
|
185 13F-3 0.10804 -0.10607 0.06124 0.19298 -0.01332
|
|
186 14F 0 0.13757 0.01570 -0.00907 -0.20836 -0.16331
|
|
187 14F+1 -0.08646 -0.02026 -0.06834 0.22715 0.01289
|
|
188 14F-1 -0.13901 -0.06834 -0.09917 -0.13114 -0.00744
|
|
189 14F+2 0.05087 -0.17698 -0.09240 0.03488 0.13528
|
|
190 14F-2 0.15252 0.11195 -0.17698 -0.06042 -0.23431
|
|
191 14F+3 0.07871 0.26169 0.45327 0.00000 0.00000
|
|
192 14F-3 -0.14091 0.11283 -0.06514 -0.10370 0.07071
|
|
193 15G 0 0.16103 -0.04251 0.02454 -0.09339 0.10738
|
|
194 15G+1 -0.17215 -0.05826 -0.00126 0.23802 0.01257
|
|
195 15G-1 -0.04636 -0.00126 -0.05971 -0.13742 -0.00726
|
|
196 15G+2 0.07492 0.00228 0.15661 -0.03256 -0.00156
|
|
197 15G-2 0.04919 0.15398 0.00228 0.05639 0.00270
|
|
198 15G+3 -0.05717 0.07837 0.13574 0.00000 0.00000
|
|
199 15G-3 0.04733 -0.28927 0.16701 0.10029 0.34476
|
|
200 15G+4 0.17052 -0.16584 -0.19091 0.01322 -0.04677
|
|
201 15G-4 0.07212 -0.00058 0.16584 0.02290 -0.08101
|
|
202 4 H 1S 0.06695 0.36622 0.21144 0.01262 0.19108
|
|
203 2S 0.15421 -0.40886 -0.23606 0.23618 -0.79621
|
|
204 3S 0.60345 -0.34588 -0.19969 0.01428 -1.62179
|
|
205 4S 0.12499 -0.03523 -0.02034 -0.17847 -0.29398
|
|
206 5S -0.03558 0.04775 0.02757 0.00764 -0.01363
|
|
207 6PX -0.02331 -0.27362 -0.09518 -0.03775 -0.06828
|
|
208 6PY -0.06172 -0.09518 -0.16372 -0.02179 -0.03942
|
|
209 6PZ 0.00059 -0.04279 -0.02470 -0.07312 -0.05820
|
|
210 7PX 0.19358 0.33391 0.19217 0.19958 -0.05596
|
|
211 7PY 0.10906 0.19217 0.11202 0.11523 -0.03231
|
|
212 7PZ 0.05564 0.24764 0.14298 0.02723 -0.03338
|
|
213 8PX -0.03414 -0.45565 -0.19323 0.35028 -0.35404
|
|
214 8PY -0.13754 -0.19323 -0.23253 0.20224 -0.20440
|
|
215 8PZ -0.26999 0.80157 0.46279 -1.27492 -0.22678
|
|
216 9PX -0.00965 0.36199 0.01283 -0.06173 0.02559
|
|
217 9PY -0.14208 0.01283 0.34718 -0.03564 0.01477
|
|
218 9PZ -0.08226 0.16328 0.09427 -0.06704 -0.05699
|
|
219 10D 0 -0.17195 0.07014 0.04050 0.28686 0.12272
|
|
220 10D+1 -0.17449 0.04916 0.15791 0.10484 -0.18291
|
|
221 10D-1 0.40900 0.15791 -0.13318 0.06053 -0.10560
|
|
222 10D+2 0.29517 0.08201 -0.19077 -0.00203 0.03044
|
|
223 10D-2 -0.29722 -0.09607 0.08201 -0.00352 0.05273
|
|
224 11D 0 0.08490 0.28323 0.16352 -0.71020 -0.14157
|
|
225 11D+1 0.14762 0.29021 0.00113 -0.50877 0.19981
|
|
226 11D-1 -0.47000 0.00113 0.28891 -0.29374 0.11536
|
|
227 11D+2 -0.19622 -0.14093 0.25717 0.13950 -0.02833
|
|
228 11D-2 0.30367 0.09444 -0.14093 0.24163 -0.04907
|
|
229 12D 0 -0.01605 0.06521 0.03765 -0.41581 -0.03255
|
|
230 12D+1 -0.25496 0.29471 0.17223 -0.06858 0.11955
|
|
231 12D-1 -0.03821 0.17223 0.09583 -0.03959 0.06902
|
|
232 12D+2 -0.00273 0.22633 -0.49128 -0.07741 0.08774
|
|
233 12D-2 -0.30815 -0.22995 0.22633 -0.13408 0.15196
|
|
234 13F 0 -0.08235 0.04914 0.02837 0.19663 0.13600
|
|
235 13F+1 -0.13219 0.25807 0.06260 -0.14591 -0.00852
|
|
236 13F-1 0.05420 0.06260 0.18579 -0.08424 -0.00492
|
|
237 13F+2 -0.02881 0.01232 0.02715 -0.09494 -0.03867
|
|
238 13F-2 0.08251 0.04138 0.01232 -0.16445 -0.06698
|
|
239 13F+3 0.12537 -0.19735 0.34181 0.00000 0.00000
|
|
240 13F-3 0.10804 0.10607 0.06124 0.19298 -0.01332
|
|
241 14F 0 0.13757 -0.01570 -0.00907 -0.20836 -0.16331
|
|
242 14F+1 0.08646 -0.02026 0.06834 -0.22715 -0.01289
|
|
243 14F-1 -0.13901 0.06834 -0.09917 -0.13114 -0.00744
|
|
244 14F+2 0.05087 0.17698 -0.09240 0.03488 0.13528
|
|
245 14F-2 -0.15252 0.11195 0.17698 0.06042 0.23431
|
|
246 14F+3 -0.07871 0.26169 -0.45327 0.00000 0.00000
|
|
247 14F-3 -0.14091 -0.11283 -0.06514 -0.10370 0.07071
|
|
248 15G 0 0.16103 0.04251 0.02454 -0.09339 0.10738
|
|
249 15G+1 0.17215 -0.05826 0.00126 -0.23802 -0.01257
|
|
250 15G-1 -0.04636 0.00126 -0.05971 -0.13742 -0.00726
|
|
251 15G+2 0.07492 -0.00228 0.15661 -0.03256 -0.00156
|
|
252 15G-2 -0.04919 0.15398 -0.00228 -0.05639 -0.00270
|
|
253 15G+3 0.05717 0.07837 -0.13574 0.00000 0.00000
|
|
254 15G-3 0.04733 0.28927 0.16701 0.10029 0.34476
|
|
255 15G+4 0.17052 0.16584 -0.19091 0.01322 -0.04677
|
|
256 15G-4 -0.07212 -0.00058 -0.16584 -0.02290 0.08101
|
|
201 202 203 204 205
|
|
(E)--V (E)--V (A2)--V (E)--V (E)--V
|
|
Eigenvalues -- 14.67409 14.67409 14.74432 14.75686 14.75686
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
7 7PX 0.10284 0.00000 0.00000 0.18463 0.00000
|
|
8 7PY 0.00000 0.10284 0.00000 0.00000 0.18463
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX -0.21004 0.00000 0.00000 -0.33815 0.00000
|
|
11 8PY 0.00000 -0.21004 0.00000 0.00000 -0.33815
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX 0.87769 0.00000 0.00000 -0.25849 0.00000
|
|
14 9PY 0.00000 0.87769 0.00000 0.00000 -0.25849
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX -1.23255 0.00000 0.00000 -0.81548 0.00000
|
|
17 10PY 0.00000 -1.23255 0.00000 0.00000 -0.81548
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX -0.04441 0.00000 0.00000 -0.15681 0.00000
|
|
20 11PY 0.00000 -0.04441 0.00000 0.00000 -0.15681
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.06926 0.00000 0.00000 0.10178 0.00000
|
|
24 12D-1 0.00000 0.06926 0.00000 0.00000 0.10178
|
|
25 12D+2 0.00000 0.14348 0.00000 0.00000 -0.01338
|
|
26 12D-2 0.14348 0.00000 0.00000 -0.01338 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 -0.08974 0.00000 0.00000 -0.03850 0.00000
|
|
29 13D-1 0.00000 -0.08974 0.00000 0.00000 -0.03850
|
|
30 13D+2 0.00000 -0.42646 0.00000 0.00000 -0.07315
|
|
31 13D-2 -0.42646 0.00000 0.00000 -0.07315 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.04633 0.00000 0.00000 -0.05659 0.00000
|
|
34 14D-1 0.00000 0.04633 0.00000 0.00000 -0.05659
|
|
35 14D+2 0.00000 3.24110 0.00000 0.00000 0.51583
|
|
36 14D-2 3.24110 0.00000 0.00000 0.51583 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.24651 0.00000 0.00000 0.61946 0.00000
|
|
39 15D-1 0.00000 0.24651 0.00000 0.00000 0.61946
|
|
40 15D+2 0.00000 0.92148 0.00000 0.00000 -0.19838
|
|
41 15D-2 0.92148 0.00000 0.00000 -0.19838 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.10325 0.00000 0.00000 -0.29303 0.00000
|
|
44 16F-1 0.00000 0.10325 0.00000 0.00000 -0.29303
|
|
45 16F+2 0.00000 0.04997 0.00000 0.00000 0.07542
|
|
46 16F-2 0.04997 0.00000 0.00000 0.07542 0.00000
|
|
47 16F+3 0.00000 0.00000 0.18620 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 -0.21775 0.00000 0.00000 0.14430 0.00000
|
|
51 17F-1 0.00000 -0.21775 0.00000 0.00000 0.14430
|
|
52 17F+2 0.00000 -0.68858 0.00000 0.00000 0.13945
|
|
53 17F-2 -0.68858 0.00000 0.00000 0.13945 0.00000
|
|
54 17F+3 0.00000 0.00000 0.17619 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.04735 0.00000 0.00000 -0.80138 0.00000
|
|
58 18F-1 0.00000 0.04735 0.00000 0.00000 -0.80138
|
|
59 18F+2 0.00000 -0.60742 0.00000 0.00000 0.25753
|
|
60 18F-2 -0.60742 0.00000 0.00000 0.25753 0.00000
|
|
61 18F+3 0.00000 0.00000 1.35616 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.09298 0.00000 0.00000 -0.79608 0.00000
|
|
65 19G-1 0.00000 0.09298 0.00000 0.00000 -0.79608
|
|
66 19G+2 0.00000 0.05923 0.00000 0.00000 -0.02228
|
|
67 19G-2 0.05923 0.00000 0.00000 -0.02228 0.00000
|
|
68 19G+3 0.00000 0.00000 0.14540 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 -0.44790 0.00000 0.00000 0.28054
|
|
71 19G-4 0.44790 0.00000 0.00000 -0.28054 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 -0.07461 0.00000 0.00000 1.06929 0.00000
|
|
74 20G-1 0.00000 -0.07461 0.00000 0.00000 1.06929
|
|
75 20G+2 0.00000 -0.16821 0.00000 0.00000 0.09008
|
|
76 20G-2 -0.16821 0.00000 0.00000 0.09008 0.00000
|
|
77 20G+3 0.00000 0.00000 -0.27082 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 1.63028 0.00000 0.00000 -0.08488
|
|
80 20G-4 -1.63028 0.00000 0.00000 0.08488 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.02685 0.00000 0.00000 -0.14515 0.00000
|
|
83 21H-1 0.00000 0.02685 0.00000 0.00000 -0.14515
|
|
84 21H+2 0.00000 -0.09842 0.00000 0.00000 -0.56816
|
|
85 21H-2 -0.09842 0.00000 0.00000 -0.56816 0.00000
|
|
86 21H+3 0.00000 0.00000 0.03989 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 -0.51231 0.00000 0.00000 0.01480
|
|
89 21H-4 0.51231 0.00000 0.00000 -0.01480 0.00000
|
|
90 21H+5 0.22629 0.00000 0.00000 0.19214 0.00000
|
|
91 21H-5 0.00000 -0.22629 0.00000 0.00000 -0.19214
|
|
92 2 H 1S 0.00000 0.05359 0.00000 0.00000 0.17664
|
|
93 2S 0.00000 -0.96685 0.00000 0.00000 -1.17134
|
|
94 3S 0.00000 3.66410 0.00000 0.00000 1.75533
|
|
95 4S 0.00000 0.88180 0.00000 0.00000 0.36098
|
|
96 5S 0.00000 -0.00676 0.00000 0.00000 0.06349
|
|
97 6PX 0.02690 0.00000 0.19897 -0.02854 0.00000
|
|
98 6PY 0.00000 -0.00979 0.00000 0.00000 -0.03916
|
|
99 6PZ 0.00000 0.12427 0.00000 0.00000 -0.01615
|
|
100 7PX -0.16717 0.00000 -0.07885 0.00192 0.00000
|
|
101 7PY 0.00000 0.35228 0.00000 0.00000 0.40719
|
|
102 7PZ 0.00000 -0.23415 0.00000 0.00000 -0.19470
|
|
103 8PX -2.15087 0.00000 0.67967 -0.03605 0.00000
|
|
104 8PY 0.00000 -1.79293 0.00000 0.00000 -1.00987
|
|
105 8PZ 0.00000 0.57211 0.00000 0.00000 0.07378
|
|
106 9PX -0.35147 0.00000 -0.00604 0.22458 0.00000
|
|
107 9PY 0.00000 -0.54430 0.00000 0.00000 -0.28704
|
|
108 9PZ 0.00000 0.09235 0.00000 0.00000 -0.02736
|
|
109 10D 0 0.00000 0.52290 0.00000 0.00000 -0.33719
|
|
110 10D+1 0.39663 0.00000 -0.19103 0.18024 0.00000
|
|
111 10D-1 0.00000 0.13755 0.00000 0.00000 0.12879
|
|
112 10D+2 0.00000 -0.08507 0.00000 0.00000 0.21028
|
|
113 10D-2 -0.32098 0.00000 -0.40687 -0.03277 0.00000
|
|
114 11D 0 0.00000 -0.74508 0.00000 0.00000 0.50970
|
|
115 11D+1 -1.01732 0.00000 0.21654 -0.20095 0.00000
|
|
116 11D-1 0.00000 -0.32446 0.00000 0.00000 0.01168
|
|
117 11D+2 0.00000 0.00193 0.00000 0.00000 -0.47978
|
|
118 11D-2 1.25954 0.00000 0.13978 0.10688 0.00000
|
|
119 12D 0 0.00000 -0.16180 0.00000 0.00000 -0.01171
|
|
120 12D+1 -0.24048 0.00000 0.38843 -0.16236 0.00000
|
|
121 12D-1 0.00000 0.09221 0.00000 0.00000 0.00243
|
|
122 12D+2 0.00000 -0.08745 0.00000 0.00000 -0.14556
|
|
123 12D-2 0.81550 0.00000 0.03084 -0.11351 0.00000
|
|
124 13F 0 0.00000 -0.11858 0.00000 0.00000 0.08809
|
|
125 13F+1 -0.10038 0.00000 -0.23533 -0.06642 0.00000
|
|
126 13F-1 0.00000 -0.07937 0.00000 0.00000 0.05589
|
|
127 13F+2 0.00000 -0.19205 0.00000 0.00000 0.06735
|
|
128 13F-2 0.23506 0.00000 0.15145 -0.16079 0.00000
|
|
129 13F+3 0.09273 0.00000 -0.34567 0.09123 0.00000
|
|
130 13F-3 0.00000 0.16711 0.00000 0.00000 0.25455
|
|
131 14F 0 0.00000 -0.03576 0.00000 0.00000 0.24327
|
|
132 14F+1 -0.10972 0.00000 0.33228 0.01015 0.00000
|
|
133 14F-1 0.00000 0.28372 0.00000 0.00000 -0.29312
|
|
134 14F+2 0.00000 0.28678 0.00000 0.00000 0.01891
|
|
135 14F-2 0.36030 0.00000 -0.30387 0.23083 0.00000
|
|
136 14F+3 0.58609 0.00000 0.36654 -0.10449 0.00000
|
|
137 14F-3 0.00000 -0.42332 0.00000 0.00000 0.04516
|
|
138 15G 0 0.00000 0.12560 0.00000 0.00000 0.01475
|
|
139 15G+1 -0.22343 0.00000 -0.02888 -0.23160 0.00000
|
|
140 15G-1 0.00000 -0.10503 0.00000 0.00000 -0.19508
|
|
141 15G+2 0.00000 0.13784 0.00000 0.00000 -0.03323
|
|
142 15G-2 0.17371 0.00000 -0.31507 0.18275 0.00000
|
|
143 15G+3 0.03777 0.00000 -0.19226 -0.00941 0.00000
|
|
144 15G-3 0.00000 -0.24721 0.00000 0.00000 -0.16544
|
|
145 15G+4 0.00000 -0.39308 0.00000 0.00000 0.00175
|
|
146 15G-4 -0.33700 0.00000 -0.16662 0.11224 0.00000
|
|
147 3 H 1S 0.04641 -0.02680 0.00000 0.15298 -0.08832
|
|
148 2S -0.83731 0.48342 0.00000 -1.01441 0.58567
|
|
149 3S 3.17320 -1.83205 0.00000 1.52016 -0.87766
|
|
150 4S 0.76366 -0.44090 0.00000 0.31262 -0.18049
|
|
151 5S -0.00585 0.00338 0.00000 0.05498 -0.03174
|
|
152 6PX -0.00061 0.01589 -0.09948 -0.03650 0.00460
|
|
153 6PY 0.01589 0.01773 -0.17231 0.00460 -0.03119
|
|
154 6PZ 0.10762 -0.06214 0.00000 -0.01398 0.00807
|
|
155 7PX 0.22242 -0.22493 0.03943 0.30587 -0.17549
|
|
156 7PY -0.22493 -0.03731 0.06829 -0.17549 0.10324
|
|
157 7PZ -0.20278 0.11707 0.00000 -0.16862 0.09735
|
|
158 8PX -1.88242 -0.15499 -0.33983 -0.76642 0.42167
|
|
159 8PY -0.15499 -2.06138 -0.58861 0.42167 -0.27951
|
|
160 8PZ 0.49546 -0.28605 0.00000 0.06389 -0.03689
|
|
161 9PX -0.49610 0.08350 0.00302 -0.15914 0.22154
|
|
162 9PY 0.08350 -0.39968 0.00523 0.22154 0.09667
|
|
163 9PZ 0.07998 -0.04617 0.00000 -0.02370 0.01368
|
|
164 10D 0 0.45284 -0.26145 0.00000 -0.29201 0.16859
|
|
165 10D+1 0.20232 0.11218 0.09552 0.14166 0.02228
|
|
166 10D-1 0.11218 0.33186 0.16544 0.02228 0.16738
|
|
167 10D+2 -0.10215 -0.26200 0.35236 -0.10525 0.02799
|
|
168 10D-2 -0.14404 -0.10215 0.20344 0.14952 -0.10525
|
|
169 11D 0 -0.64526 0.37254 0.00000 0.44141 -0.25485
|
|
170 11D+1 -0.49767 -0.30002 -0.10827 -0.04148 -0.09207
|
|
171 11D-1 -0.30002 -0.84411 -0.18753 -0.09207 -0.14779
|
|
172 11D+2 0.54456 0.94514 -0.12106 0.25403 -0.03979
|
|
173 11D-2 0.31633 0.54456 -0.06989 -0.33312 0.25403
|
|
174 12D 0 -0.14013 0.08090 0.00000 -0.01014 0.00585
|
|
175 12D+1 0.00903 -0.14406 -0.19422 -0.03877 -0.07136
|
|
176 12D-1 -0.14406 -0.15731 -0.33639 -0.07136 -0.12116
|
|
177 12D+2 0.39099 0.58977 -0.02671 0.01388 -0.12152
|
|
178 12D-2 0.13829 0.39099 -0.01542 -0.13755 0.01388
|
|
179 13F 0 -0.10269 0.05929 0.00000 0.07629 -0.04405
|
|
180 13F+1 -0.08462 -0.00910 0.11767 0.02531 -0.05296
|
|
181 13F-1 -0.00910 -0.09513 0.20380 -0.05296 -0.03584
|
|
182 13F+2 0.18495 0.12828 -0.13116 -0.09879 -0.10376
|
|
183 13F-2 -0.08528 0.18495 -0.07572 0.01032 -0.09879
|
|
184 13F+3 -0.04637 -0.08031 -0.34567 -0.04562 -0.07901
|
|
185 13F-3 0.14473 -0.08356 0.00000 0.22045 -0.12727
|
|
186 14F 0 -0.03097 0.01788 0.00000 0.21068 -0.12164
|
|
187 14F+1 0.18536 -0.17037 -0.16614 -0.21730 0.13132
|
|
188 14F-1 -0.17037 -0.01136 -0.28777 0.13132 -0.06566
|
|
189 14F+2 0.03183 0.34192 0.26316 0.09176 0.17785
|
|
190 14F-2 0.30516 0.03183 0.15193 0.07189 0.09176
|
|
191 14F+3 -0.29304 -0.50757 0.36654 0.05225 0.09049
|
|
192 14F-3 -0.36661 0.21166 0.00000 0.03911 -0.02258
|
|
193 15G 0 0.10877 -0.06280 0.00000 0.01277 -0.00737
|
|
194 15G+1 -0.13463 -0.05127 0.01444 -0.20421 -0.01582
|
|
195 15G-1 -0.05127 -0.19383 0.02501 -0.01582 -0.22247
|
|
196 15G+2 0.01553 0.16475 0.27286 0.09352 0.12875
|
|
197 15G-2 0.14681 0.01553 0.15754 0.02076 0.09352
|
|
198 15G+3 -0.01889 -0.03271 -0.19226 0.00470 0.00815
|
|
199 15G-3 -0.21409 0.12360 0.00000 -0.14327 0.08272
|
|
200 15G+4 0.31614 0.15448 -0.14430 -0.04936 -0.08374
|
|
201 15G-4 0.21056 -0.31614 0.08331 0.02675 0.04936
|
|
202 4 H 1S -0.04641 -0.02680 0.00000 -0.15298 -0.08832
|
|
203 2S 0.83731 0.48342 0.00000 1.01441 0.58567
|
|
204 3S -3.17320 -1.83205 0.00000 -1.52016 -0.87766
|
|
205 4S -0.76366 -0.44090 0.00000 -0.31262 -0.18049
|
|
206 5S 0.00585 0.00338 0.00000 -0.05498 -0.03174
|
|
207 6PX -0.00061 -0.01589 -0.09948 -0.03650 -0.00460
|
|
208 6PY -0.01589 0.01773 0.17231 -0.00460 -0.03119
|
|
209 6PZ -0.10762 -0.06214 0.00000 0.01398 0.00807
|
|
210 7PX 0.22242 0.22493 0.03943 0.30587 0.17549
|
|
211 7PY 0.22493 -0.03731 -0.06829 0.17549 0.10324
|
|
212 7PZ 0.20278 0.11707 0.00000 0.16862 0.09735
|
|
213 8PX -1.88242 0.15499 -0.33983 -0.76642 -0.42167
|
|
214 8PY 0.15499 -2.06138 0.58861 -0.42167 -0.27951
|
|
215 8PZ -0.49546 -0.28605 0.00000 -0.06389 -0.03689
|
|
216 9PX -0.49610 -0.08350 0.00302 -0.15914 -0.22154
|
|
217 9PY -0.08350 -0.39968 -0.00523 -0.22154 0.09667
|
|
218 9PZ -0.07998 -0.04617 0.00000 0.02370 0.01368
|
|
219 10D 0 -0.45284 -0.26145 0.00000 0.29201 0.16859
|
|
220 10D+1 0.20232 -0.11218 0.09552 0.14166 -0.02228
|
|
221 10D-1 -0.11218 0.33186 -0.16544 -0.02228 0.16738
|
|
222 10D+2 0.10215 -0.26200 -0.35236 0.10525 0.02799
|
|
223 10D-2 -0.14404 0.10215 0.20344 0.14952 0.10525
|
|
224 11D 0 0.64526 0.37254 0.00000 -0.44141 -0.25485
|
|
225 11D+1 -0.49767 0.30002 -0.10827 -0.04148 0.09207
|
|
226 11D-1 0.30002 -0.84411 0.18753 0.09207 -0.14779
|
|
227 11D+2 -0.54456 0.94514 0.12106 -0.25403 -0.03979
|
|
228 11D-2 0.31633 -0.54456 -0.06989 -0.33312 -0.25403
|
|
229 12D 0 0.14013 0.08090 0.00000 0.01014 0.00585
|
|
230 12D+1 0.00903 0.14406 -0.19422 -0.03877 0.07136
|
|
231 12D-1 0.14406 -0.15731 0.33639 0.07136 -0.12116
|
|
232 12D+2 -0.39099 0.58977 0.02671 -0.01388 -0.12152
|
|
233 12D-2 0.13829 -0.39099 -0.01542 -0.13755 -0.01388
|
|
234 13F 0 0.10269 0.05929 0.00000 -0.07629 -0.04405
|
|
235 13F+1 -0.08462 0.00910 0.11767 0.02531 0.05296
|
|
236 13F-1 0.00910 -0.09513 -0.20380 0.05296 -0.03584
|
|
237 13F+2 -0.18495 0.12828 0.13116 0.09879 -0.10376
|
|
238 13F-2 -0.08528 -0.18495 -0.07572 0.01032 0.09879
|
|
239 13F+3 -0.04637 0.08031 -0.34567 -0.04562 0.07901
|
|
240 13F-3 -0.14473 -0.08356 0.00000 -0.22045 -0.12727
|
|
241 14F 0 0.03097 0.01788 0.00000 -0.21068 -0.12164
|
|
242 14F+1 0.18536 0.17037 -0.16614 -0.21730 -0.13132
|
|
243 14F-1 0.17037 -0.01136 0.28777 -0.13132 -0.06566
|
|
244 14F+2 -0.03183 0.34192 -0.26316 -0.09176 0.17785
|
|
245 14F-2 0.30516 -0.03183 0.15193 0.07189 -0.09176
|
|
246 14F+3 -0.29304 0.50757 0.36654 0.05225 -0.09049
|
|
247 14F-3 0.36661 0.21166 0.00000 -0.03911 -0.02258
|
|
248 15G 0 -0.10877 -0.06280 0.00000 -0.01277 -0.00737
|
|
249 15G+1 -0.13463 0.05127 0.01444 -0.20421 0.01582
|
|
250 15G-1 0.05127 -0.19383 -0.02501 0.01582 -0.22247
|
|
251 15G+2 -0.01553 0.16475 -0.27286 -0.09352 0.12875
|
|
252 15G-2 0.14681 -0.01553 0.15754 0.02076 -0.09352
|
|
253 15G+3 -0.01889 0.03271 -0.19226 0.00470 -0.00815
|
|
254 15G-3 0.21409 0.12360 0.00000 0.14327 0.08272
|
|
255 15G+4 -0.31614 0.15448 0.14430 0.04936 -0.08374
|
|
256 15G-4 0.21056 0.31614 0.08331 0.02675 -0.04936
|
|
206 207 208 209 210
|
|
(E)--V (E)--V (A2)--V (A1)--V (E)--V
|
|
Eigenvalues -- 14.95047 14.95047 14.97234 14.97247 15.02829
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.05033 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 -0.45984 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 -2.39095 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 0.79843 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 20.15979 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 4.52960 0.00000
|
|
7 7PX 0.00000 0.10089 0.00000 0.00000 0.00000
|
|
8 7PY 0.10089 0.00000 0.00000 0.00000 0.41508
|
|
9 7PZ 0.00000 0.00000 0.00000 -0.04548 0.00000
|
|
10 8PX 0.00000 -0.22982 0.00000 0.00000 0.00000
|
|
11 8PY -0.22982 0.00000 0.00000 0.00000 -1.50443
|
|
12 8PZ 0.00000 0.00000 0.00000 0.36612 0.00000
|
|
13 9PX 0.00000 -0.80532 0.00000 0.00000 0.00000
|
|
14 9PY -0.80532 0.00000 0.00000 0.00000 5.29001
|
|
15 9PZ 0.00000 0.00000 0.00000 -3.01388 0.00000
|
|
16 10PX 0.00000 -0.39261 0.00000 0.00000 0.00000
|
|
17 10PY -0.39261 0.00000 0.00000 0.00000 2.59065
|
|
18 10PZ 0.00000 0.00000 0.00000 -3.79494 0.00000
|
|
19 11PX 0.00000 -0.07201 0.00000 0.00000 0.00000
|
|
20 11PY -0.07201 0.00000 0.00000 0.00000 0.04438
|
|
21 11PZ 0.00000 0.00000 0.00000 -0.26006 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.04600 0.00000
|
|
23 12D+1 0.00000 0.01026 0.00000 0.00000 0.00000
|
|
24 12D-1 0.01026 0.00000 0.00000 0.00000 0.11960
|
|
25 12D+2 0.13539 0.00000 0.00000 0.00000 -0.25308
|
|
26 12D-2 0.00000 0.13539 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.08668 0.00000
|
|
28 13D+1 0.00000 0.14405 0.00000 0.00000 0.00000
|
|
29 13D-1 0.14405 0.00000 0.00000 0.00000 -0.02004
|
|
30 13D+2 -0.38187 0.00000 0.00000 0.00000 0.16368
|
|
31 13D-2 0.00000 -0.38187 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 -2.87276 0.00000
|
|
33 14D+1 0.00000 -1.87112 0.00000 0.00000 0.00000
|
|
34 14D-1 -1.87112 0.00000 0.00000 0.00000 -0.89175
|
|
35 14D+2 4.41034 0.00000 0.00000 0.00000 -1.21422
|
|
36 14D-2 0.00000 4.41034 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 -0.68872 0.00000
|
|
38 15D+1 0.00000 -0.35346 0.00000 0.00000 0.00000
|
|
39 15D-1 -0.35346 0.00000 0.00000 0.00000 -0.22149
|
|
40 15D+2 0.34884 0.00000 0.00000 0.00000 -0.88896
|
|
41 15D-2 0.00000 0.34884 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.16444 0.00000
|
|
43 16F+1 0.00000 -0.16140 0.00000 0.00000 0.00000
|
|
44 16F-1 -0.16140 0.00000 0.00000 0.00000 -0.44573
|
|
45 16F+2 -0.02330 0.00000 0.00000 0.00000 0.54014
|
|
46 16F-2 0.00000 -0.02330 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 -0.22711 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.37247 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.15512 0.00000
|
|
50 17F+1 0.00000 0.73027 0.00000 0.00000 0.00000
|
|
51 17F-1 0.73027 0.00000 0.00000 0.00000 -0.00679
|
|
52 17F+2 -0.12983 0.00000 0.00000 0.00000 -0.25314
|
|
53 17F-2 0.00000 -0.12983 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 1.57045 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 -0.79231 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.72290 0.00000
|
|
57 18F+1 0.00000 0.35008 0.00000 0.00000 0.00000
|
|
58 18F-1 0.35008 0.00000 0.00000 0.00000 -0.44953
|
|
59 18F+2 0.48440 0.00000 0.00000 0.00000 0.30181
|
|
60 18F-2 0.00000 0.48440 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 2.63853 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 -0.20380 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 -0.05821 0.00000
|
|
64 19G+1 0.00000 -0.05573 0.00000 0.00000 0.00000
|
|
65 19G-1 -0.05573 0.00000 0.00000 0.00000 0.39680
|
|
66 19G+2 0.50528 0.00000 0.00000 0.00000 -0.06096
|
|
67 19G-2 0.00000 0.50528 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.60712 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.25944 0.00000
|
|
70 19G+4 -0.27942 0.00000 0.00000 0.00000 -0.17053
|
|
71 19G-4 0.00000 0.27942 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.16453 0.00000
|
|
73 20G+1 0.00000 0.47504 0.00000 0.00000 0.00000
|
|
74 20G-1 0.47504 0.00000 0.00000 0.00000 -0.43966
|
|
75 20G+2 -1.43278 0.00000 0.00000 0.00000 -0.02454
|
|
76 20G-2 0.00000 -1.43278 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 -1.68126 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 -0.78024 0.00000
|
|
79 20G+4 0.85833 0.00000 0.00000 0.00000 0.63415
|
|
80 20G-4 0.00000 -0.85833 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.23563 0.00000
|
|
82 21H+1 0.00000 -0.18446 0.00000 0.00000 0.00000
|
|
83 21H-1 -0.18446 0.00000 0.00000 0.00000 0.30704
|
|
84 21H+2 0.41903 0.00000 0.00000 0.00000 0.10060
|
|
85 21H-2 0.00000 0.41903 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.46964 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.25624 0.00000
|
|
88 21H+4 -0.44717 0.00000 0.00000 0.00000 0.21063
|
|
89 21H-4 0.00000 0.44717 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.21291 0.00000 0.00000 0.00000
|
|
91 21H-5 -0.21291 0.00000 0.00000 0.00000 0.12915
|
|
92 2 H 1S -0.05499 0.00000 0.00000 0.19845 0.25701
|
|
93 2S -0.86836 0.00000 0.00000 1.07835 0.14469
|
|
94 3S 2.64406 0.00000 0.00000 -7.90758 -4.90882
|
|
95 4S 0.79930 0.00000 0.00000 -2.18384 -1.53062
|
|
96 5S 0.02156 0.00000 0.00000 -0.04925 0.11891
|
|
97 6PX 0.00000 -0.08805 -0.07239 0.00000 0.00000
|
|
98 6PY -0.06281 0.00000 0.00000 0.09894 0.19905
|
|
99 6PZ 0.05036 0.00000 0.00000 0.00540 -0.10972
|
|
100 7PX 0.00000 -0.03808 0.06748 0.00000 0.00000
|
|
101 7PY 0.41112 0.00000 0.00000 -0.56766 -0.35150
|
|
102 7PZ -0.13210 0.00000 0.00000 0.18393 0.14996
|
|
103 8PX 0.00000 -1.82825 2.55829 0.00000 0.00000
|
|
104 8PY -1.05131 0.00000 0.00000 4.08905 2.61814
|
|
105 8PZ 2.63105 0.00000 0.00000 -2.25664 -1.71349
|
|
106 9PX 0.00000 -0.22040 0.30386 0.00000 0.00000
|
|
107 9PY -0.54011 0.00000 0.00000 1.21493 0.74130
|
|
108 9PZ 0.44305 0.00000 0.00000 -0.46315 -0.51300
|
|
109 10D 0 -0.49476 0.00000 0.00000 -0.12953 0.00666
|
|
110 10D+1 0.00000 0.65145 -0.26405 0.00000 0.00000
|
|
111 10D-1 0.32180 0.00000 0.00000 -0.63335 0.02320
|
|
112 10D+2 0.04844 0.00000 0.00000 -0.14793 -0.25618
|
|
113 10D-2 0.00000 -0.00349 0.67842 0.00000 0.00000
|
|
114 11D 0 0.97538 0.00000 0.00000 0.18066 -0.18350
|
|
115 11D+1 0.00000 -1.37043 0.45002 0.00000 0.00000
|
|
116 11D-1 -1.17742 0.00000 0.00000 1.29029 0.39468
|
|
117 11D+2 0.12749 0.00000 0.00000 0.55427 0.66263
|
|
118 11D-2 0.00000 0.82711 -1.60325 0.00000 0.00000
|
|
119 12D 0 0.30576 0.00000 0.00000 0.11660 -0.07134
|
|
120 12D+1 0.00000 -0.36001 0.58227 0.00000 0.00000
|
|
121 12D-1 -0.77849 0.00000 0.00000 0.52894 0.48168
|
|
122 12D+2 -0.10911 0.00000 0.00000 0.29283 0.29542
|
|
123 12D-2 0.00000 0.67115 -0.59252 0.00000 0.00000
|
|
124 13F 0 -0.16270 0.00000 0.00000 -0.04425 0.03783
|
|
125 13F+1 0.00000 0.09503 -0.21163 0.00000 0.00000
|
|
126 13F-1 -0.04779 0.00000 0.00000 -0.10125 0.16915
|
|
127 13F+2 -0.12790 0.00000 0.00000 0.19389 0.15462
|
|
128 13F-2 0.00000 0.22292 0.12803 0.00000 0.00000
|
|
129 13F+3 0.00000 0.13577 -0.19601 0.00000 0.00000
|
|
130 13F-3 -0.09102 0.00000 0.00000 -0.14600 -0.13631
|
|
131 14F 0 0.06229 0.00000 0.00000 0.15798 -0.17871
|
|
132 14F+1 0.00000 -0.21173 0.05913 0.00000 0.00000
|
|
133 14F-1 -0.61954 0.00000 0.00000 0.22285 0.13498
|
|
134 14F+2 -0.21155 0.00000 0.00000 0.09860 -0.00342
|
|
135 14F-2 0.00000 0.69807 -0.41835 0.00000 0.00000
|
|
136 14F+3 0.00000 0.27345 -0.45305 0.00000 0.00000
|
|
137 14F-3 -0.12037 0.00000 0.00000 0.23542 -0.05724
|
|
138 15G 0 -0.14896 0.00000 0.00000 -0.13151 0.00951
|
|
139 15G+1 0.00000 0.29193 -0.06990 0.00000 0.00000
|
|
140 15G-1 -0.28990 0.00000 0.00000 0.12007 0.19056
|
|
141 15G+2 -0.14564 0.00000 0.00000 0.04240 0.15269
|
|
142 15G-2 0.00000 -0.00897 0.02565 0.00000 0.00000
|
|
143 15G+3 0.00000 0.34325 -0.16342 0.00000 0.00000
|
|
144 15G-3 0.03065 0.00000 0.00000 0.08468 0.03318
|
|
145 15G+4 -0.04312 0.00000 0.00000 0.33182 0.10381
|
|
146 15G-4 0.00000 0.12841 0.22944 0.00000 0.00000
|
|
147 3 H 1S 0.02750 -0.04762 0.00000 0.19845 -0.12850
|
|
148 2S 0.43418 -0.75202 0.00000 1.07835 -0.07235
|
|
149 3S -1.32203 2.28983 0.00000 -7.90758 2.45441
|
|
150 4S -0.39965 0.69221 0.00000 -2.18384 0.76531
|
|
151 5S -0.01078 0.01867 0.00000 -0.04925 -0.05946
|
|
152 6PX -0.01093 -0.06912 0.03620 0.08569 -0.10921
|
|
153 6PY -0.08174 -0.01093 0.06269 -0.04947 0.00988
|
|
154 6PZ -0.02518 0.04362 0.00000 0.00540 0.05486
|
|
155 7PX -0.19451 0.29882 -0.03374 -0.49160 0.19179
|
|
156 7PY 0.07422 -0.19451 -0.05844 0.28383 -0.01932
|
|
157 7PZ 0.06605 -0.11440 0.00000 0.18393 -0.07498
|
|
158 8PX -0.33642 -1.24554 -1.27915 3.54122 -1.35858
|
|
159 8PY -1.63401 -0.33642 -2.21555 -2.04452 0.26501
|
|
160 8PZ -1.31552 2.27855 0.00000 -2.25664 0.85674
|
|
161 9PX 0.13844 -0.46018 -0.15193 1.05216 -0.24521
|
|
162 9PY -0.30033 0.13844 -0.26315 -0.60747 0.31658
|
|
163 9PZ -0.22153 0.38370 0.00000 -0.46315 0.25650
|
|
164 10D 0 0.24738 -0.42848 0.00000 -0.12953 -0.00333
|
|
165 10D+1 0.14274 0.40422 0.13202 -0.54850 0.14308
|
|
166 10D-1 0.56904 0.14274 0.22867 0.31668 0.27103
|
|
167 10D+2 0.00949 -0.02249 -0.58752 0.07397 -0.34032
|
|
168 10D-2 -0.02249 0.03545 -0.33921 -0.12811 -0.04858
|
|
169 11D 0 -0.48769 0.84470 0.00000 0.18066 0.09175
|
|
170 11D+1 -0.08358 -1.22567 -0.22501 1.11743 -0.38172
|
|
171 11D-1 -1.32218 -0.08358 -0.38973 -0.64515 -0.26648
|
|
172 11D+2 0.65220 0.30294 1.38845 -0.27714 0.55365
|
|
173 11D-2 0.30294 0.30239 0.80162 0.48001 -0.06292
|
|
174 12D 0 -0.15288 0.26479 0.00000 0.11660 0.03567
|
|
175 12D+1 0.18121 -0.67387 -0.29113 0.45808 -0.26714
|
|
176 12D-1 -0.46463 0.18121 -0.50426 -0.26447 0.01898
|
|
177 12D+2 0.47608 0.33786 0.51314 -0.14642 0.03848
|
|
178 12D-2 0.33786 0.08596 0.29626 0.25360 -0.14835
|
|
179 13F 0 0.08135 -0.14090 0.00000 -0.04425 -0.01892
|
|
180 13F+1 0.06184 -0.01209 0.10582 -0.08769 -0.06649
|
|
181 13F-1 0.05932 0.06184 0.18328 0.05063 0.05398
|
|
182 13F+2 0.13521 0.15191 -0.11088 -0.09694 -0.02836
|
|
183 13F-2 0.15191 -0.04019 -0.06402 0.16791 -0.10564
|
|
184 13F+3 -0.11758 -0.06789 -0.19601 0.00000 0.09694
|
|
185 13F-3 0.04551 -0.07882 0.00000 -0.14600 0.06816
|
|
186 14F 0 -0.03114 0.05394 0.00000 0.15798 0.08935
|
|
187 14F+1 0.17659 -0.51759 -0.02957 0.19300 -0.14746
|
|
188 14F-1 -0.31368 0.17659 -0.05121 -0.11143 -0.12043
|
|
189 14F+2 0.47066 0.39387 0.36230 -0.04930 0.20989
|
|
190 14F-2 0.39387 0.01586 0.20918 0.08539 0.12315
|
|
191 14F+3 -0.23681 -0.13672 -0.45305 0.00000 -0.09380
|
|
192 14F-3 0.06019 -0.10425 0.00000 0.23542 0.02862
|
|
193 15G 0 0.07448 -0.12900 0.00000 -0.13151 -0.00476
|
|
194 15G+1 0.25194 -0.14444 0.03495 0.10399 -0.11215
|
|
195 15G-1 0.14647 0.25194 0.06054 -0.06004 -0.00370
|
|
196 15G+2 -0.04314 0.05918 -0.02221 -0.02120 0.30711
|
|
197 15G-2 0.05918 -0.11147 -0.01283 0.03672 0.08915
|
|
198 15G+3 -0.29726 -0.17162 -0.16342 0.00000 0.00407
|
|
199 15G-3 -0.01533 0.02655 0.00000 0.08468 -0.01659
|
|
200 15G+4 -0.10709 -0.03693 0.19870 -0.16591 -0.13293
|
|
201 15G-4 0.03693 0.06445 -0.11472 -0.28737 0.13669
|
|
202 4 H 1S 0.02750 0.04762 0.00000 0.19845 -0.12850
|
|
203 2S 0.43418 0.75202 0.00000 1.07835 -0.07235
|
|
204 3S -1.32203 -2.28983 0.00000 -7.90758 2.45441
|
|
205 4S -0.39965 -0.69221 0.00000 -2.18384 0.76531
|
|
206 5S -0.01078 -0.01867 0.00000 -0.04925 -0.05946
|
|
207 6PX 0.01093 -0.06912 0.03620 -0.08569 0.10921
|
|
208 6PY -0.08174 0.01093 -0.06269 -0.04947 0.00988
|
|
209 6PZ -0.02518 -0.04362 0.00000 0.00540 0.05486
|
|
210 7PX 0.19451 0.29882 -0.03374 0.49160 -0.19179
|
|
211 7PY 0.07422 0.19451 0.05844 0.28383 -0.01932
|
|
212 7PZ 0.06605 0.11440 0.00000 0.18393 -0.07498
|
|
213 8PX 0.33642 -1.24554 -1.27915 -3.54122 1.35858
|
|
214 8PY -1.63401 0.33642 2.21555 -2.04452 0.26501
|
|
215 8PZ -1.31552 -2.27855 0.00000 -2.25664 0.85674
|
|
216 9PX -0.13844 -0.46018 -0.15193 -1.05216 0.24521
|
|
217 9PY -0.30033 -0.13844 0.26315 -0.60747 0.31658
|
|
218 9PZ -0.22153 -0.38370 0.00000 -0.46315 0.25650
|
|
219 10D 0 0.24738 0.42848 0.00000 -0.12953 -0.00333
|
|
220 10D+1 -0.14274 0.40422 0.13202 0.54850 -0.14308
|
|
221 10D-1 0.56904 -0.14274 -0.22867 0.31668 0.27103
|
|
222 10D+2 0.00949 0.02249 0.58752 0.07397 -0.34032
|
|
223 10D-2 0.02249 0.03545 -0.33921 0.12811 0.04858
|
|
224 11D 0 -0.48769 -0.84470 0.00000 0.18066 0.09175
|
|
225 11D+1 0.08358 -1.22567 -0.22501 -1.11743 0.38172
|
|
226 11D-1 -1.32218 0.08358 0.38973 -0.64515 -0.26648
|
|
227 11D+2 0.65220 -0.30294 -1.38845 -0.27714 0.55365
|
|
228 11D-2 -0.30294 0.30239 0.80162 -0.48001 0.06292
|
|
229 12D 0 -0.15288 -0.26479 0.00000 0.11660 0.03567
|
|
230 12D+1 -0.18121 -0.67387 -0.29113 -0.45808 0.26714
|
|
231 12D-1 -0.46463 -0.18121 0.50426 -0.26447 0.01898
|
|
232 12D+2 0.47608 -0.33786 -0.51314 -0.14642 0.03848
|
|
233 12D-2 -0.33786 0.08596 0.29626 -0.25360 0.14835
|
|
234 13F 0 0.08135 0.14090 0.00000 -0.04425 -0.01892
|
|
235 13F+1 -0.06184 -0.01209 0.10582 0.08769 0.06649
|
|
236 13F-1 0.05932 -0.06184 -0.18328 0.05063 0.05398
|
|
237 13F+2 0.13521 -0.15191 0.11088 -0.09694 -0.02836
|
|
238 13F-2 -0.15191 -0.04019 -0.06402 -0.16791 0.10564
|
|
239 13F+3 0.11758 -0.06789 -0.19601 0.00000 -0.09694
|
|
240 13F-3 0.04551 0.07882 0.00000 -0.14600 0.06816
|
|
241 14F 0 -0.03114 -0.05394 0.00000 0.15798 0.08935
|
|
242 14F+1 -0.17659 -0.51759 -0.02957 -0.19300 0.14746
|
|
243 14F-1 -0.31368 -0.17659 0.05121 -0.11143 -0.12043
|
|
244 14F+2 0.47066 -0.39387 -0.36230 -0.04930 0.20989
|
|
245 14F-2 -0.39387 0.01586 0.20918 -0.08539 -0.12315
|
|
246 14F+3 0.23681 -0.13672 -0.45305 0.00000 0.09380
|
|
247 14F-3 0.06019 0.10425 0.00000 0.23542 0.02862
|
|
248 15G 0 0.07448 0.12900 0.00000 -0.13151 -0.00476
|
|
249 15G+1 -0.25194 -0.14444 0.03495 -0.10399 0.11215
|
|
250 15G-1 0.14647 -0.25194 -0.06054 -0.06004 -0.00370
|
|
251 15G+2 -0.04314 -0.05918 0.02221 -0.02120 0.30711
|
|
252 15G-2 -0.05918 -0.11147 -0.01283 -0.03672 -0.08915
|
|
253 15G+3 0.29726 -0.17162 -0.16342 0.00000 -0.00407
|
|
254 15G-3 -0.01533 -0.02655 0.00000 0.08468 -0.01659
|
|
255 15G+4 -0.10709 0.03693 -0.19870 -0.16591 -0.13293
|
|
256 15G-4 -0.03693 0.06445 -0.11472 0.28737 -0.13669
|
|
211 212 213 214 215
|
|
(E)--V (A1)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 15.02829 15.38029 15.59184 15.59184 15.88742
|
|
1 1 N 1S 0.00000 0.02035 0.00000 0.00000 -0.00265
|
|
2 2S 0.00000 -0.35366 0.00000 0.00000 -0.15628
|
|
3 3S 0.00000 -2.13897 0.00000 0.00000 -1.25854
|
|
4 4S 0.00000 0.39353 0.00000 0.00000 1.70827
|
|
5 5S 0.00000 23.21255 0.00000 0.00000 7.17307
|
|
6 6S 0.00000 6.43071 0.00000 0.00000 2.60323
|
|
7 7PX 0.41508 0.00000 0.00000 0.18301 0.00000
|
|
8 7PY 0.00000 0.00000 0.18301 0.00000 0.00000
|
|
9 7PZ 0.00000 -0.73446 0.00000 0.00000 0.24646
|
|
10 8PX -1.50443 0.00000 0.00000 -0.78900 0.00000
|
|
11 8PY 0.00000 0.00000 -0.78900 0.00000 0.00000
|
|
12 8PZ 0.00000 2.76208 0.00000 0.00000 -0.45042
|
|
13 9PX 5.29001 0.00000 0.00000 2.54561 0.00000
|
|
14 9PY 0.00000 0.00000 2.54561 0.00000 0.00000
|
|
15 9PZ 0.00000 -10.30607 0.00000 0.00000 -1.49783
|
|
16 10PX 2.59065 0.00000 0.00000 0.19311 0.00000
|
|
17 10PY 0.00000 0.00000 0.19311 0.00000 0.00000
|
|
18 10PZ 0.00000 -5.84295 0.00000 0.00000 -1.23151
|
|
19 11PX 0.04438 0.00000 0.00000 -0.12736 0.00000
|
|
20 11PY 0.00000 0.00000 -0.12736 0.00000 0.00000
|
|
21 11PZ 0.00000 -0.42140 0.00000 0.00000 -0.27950
|
|
22 12D 0 0.00000 0.00292 0.00000 0.00000 0.26162
|
|
23 12D+1 0.11960 0.00000 0.00000 -0.04735 0.00000
|
|
24 12D-1 0.00000 0.00000 -0.04735 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 -0.05132 0.00000 0.00000
|
|
26 12D-2 -0.25308 0.00000 0.00000 -0.05132 0.00000
|
|
27 13D 0 0.00000 -0.38564 0.00000 0.00000 -0.11992
|
|
28 13D+1 -0.02004 0.00000 0.00000 0.07350 0.00000
|
|
29 13D-1 0.00000 0.00000 0.07350 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 -0.02613 0.00000 0.00000
|
|
31 13D-2 0.16368 0.00000 0.00000 -0.02613 0.00000
|
|
32 14D 0 0.00000 1.61049 0.00000 0.00000 -1.43523
|
|
33 14D+1 -0.89175 0.00000 0.00000 0.31587 0.00000
|
|
34 14D-1 0.00000 0.00000 0.31587 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 0.01499 0.00000 0.00000
|
|
36 14D-2 -1.21422 0.00000 0.00000 0.01499 0.00000
|
|
37 15D 0 0.00000 -0.35513 0.00000 0.00000 -0.53752
|
|
38 15D+1 -0.22149 0.00000 0.00000 0.43767 0.00000
|
|
39 15D-1 0.00000 0.00000 0.43767 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.14533 0.00000 0.00000
|
|
41 15D-2 -0.88896 0.00000 0.00000 0.14533 0.00000
|
|
42 16F 0 0.00000 -0.42293 0.00000 0.00000 -0.38649
|
|
43 16F+1 -0.44573 0.00000 0.00000 0.24559 0.00000
|
|
44 16F-1 0.00000 0.00000 0.24559 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.28890 0.00000 0.00000
|
|
46 16F-2 0.54014 0.00000 0.00000 0.28890 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 -0.23320 0.00000 0.00000 0.56382
|
|
49 17F 0 0.00000 0.98180 0.00000 0.00000 0.96603
|
|
50 17F+1 -0.00679 0.00000 0.00000 -0.79108 0.00000
|
|
51 17F-1 0.00000 0.00000 -0.79108 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 -0.49419 0.00000 0.00000
|
|
53 17F-2 -0.25314 0.00000 0.00000 -0.49419 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 -0.30531 0.00000 0.00000 -1.06684
|
|
56 18F 0 0.00000 1.01022 0.00000 0.00000 0.30804
|
|
57 18F+1 -0.44953 0.00000 0.00000 -0.87223 0.00000
|
|
58 18F-1 0.00000 0.00000 -0.87223 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 -0.36680 0.00000 0.00000
|
|
60 18F-2 0.30181 0.00000 0.00000 -0.36680 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 -0.88599 0.00000 0.00000 -1.45474
|
|
63 19G 0 0.00000 0.22662 0.00000 0.00000 -0.32144
|
|
64 19G+1 0.39680 0.00000 0.00000 -0.26128 0.00000
|
|
65 19G-1 0.00000 0.00000 -0.26128 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 -0.26814 0.00000 0.00000
|
|
67 19G-2 -0.06096 0.00000 0.00000 -0.26814 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00611 0.00000 0.00000 -0.55152
|
|
70 19G+4 0.00000 0.00000 -0.01973 0.00000 0.00000
|
|
71 19G-4 0.17053 0.00000 0.00000 0.01973 0.00000
|
|
72 20G 0 0.00000 -1.05565 0.00000 0.00000 0.28307
|
|
73 20G+1 -0.43966 0.00000 0.00000 0.76875 0.00000
|
|
74 20G-1 0.00000 0.00000 0.76875 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.41196 0.00000 0.00000
|
|
76 20G-2 -0.02454 0.00000 0.00000 0.41196 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.79531 0.00000 0.00000 1.24017
|
|
79 20G+4 0.00000 0.00000 0.33675 0.00000 0.00000
|
|
80 20G-4 -0.63415 0.00000 0.00000 -0.33675 0.00000
|
|
81 21H 0 0.00000 0.25121 0.00000 0.00000 -0.36768
|
|
82 21H+1 0.30704 0.00000 0.00000 -0.43584 0.00000
|
|
83 21H-1 0.00000 0.00000 -0.43584 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.10106 0.00000 0.00000
|
|
85 21H-2 0.10060 0.00000 0.00000 0.10106 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 -0.22705 0.00000 0.00000 -0.19415
|
|
88 21H+4 0.00000 0.00000 -0.12013 0.00000 0.00000
|
|
89 21H-4 -0.21063 0.00000 0.00000 0.12013 0.00000
|
|
90 21H+5 -0.12915 0.00000 0.00000 -0.28606 0.00000
|
|
91 21H-5 0.00000 0.00000 0.28606 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.45225 0.17252 0.00000 0.37559
|
|
93 2S 0.00000 -0.39102 -0.92491 0.00000 -1.51159
|
|
94 3S 0.00000 -8.08195 0.48405 0.00000 -2.29836
|
|
95 4S 0.00000 -3.17802 -0.11134 0.00000 -1.16440
|
|
96 5S 0.00000 -0.02698 0.10107 0.00000 -0.00926
|
|
97 6PX -0.05317 0.00000 0.00000 0.00226 0.00000
|
|
98 6PY 0.00000 0.15261 0.08185 0.00000 -0.14399
|
|
99 6PZ 0.00000 0.00603 0.20935 0.00000 -0.04806
|
|
100 7PX 0.09141 0.00000 0.00000 0.05485 0.00000
|
|
101 7PY 0.00000 -0.15653 0.36107 0.00000 0.65567
|
|
102 7PZ 0.00000 -0.06248 -0.18354 0.00000 -0.11573
|
|
103 8PX -0.51936 0.00000 0.00000 -0.91003 0.00000
|
|
104 8PY 0.00000 5.19245 -0.66260 0.00000 1.09451
|
|
105 8PZ 0.00000 0.03954 -1.42135 0.00000 -1.06463
|
|
106 9PX 0.17501 0.00000 0.00000 0.01754 0.00000
|
|
107 9PY 0.00000 1.62763 -0.02092 0.00000 0.43871
|
|
108 9PZ 0.00000 -0.35398 -0.19435 0.00000 -0.15091
|
|
109 10D 0 0.00000 -0.40619 0.43644 0.00000 0.01853
|
|
110 10D+1 0.35364 0.00000 0.00000 0.15920 0.00000
|
|
111 10D-1 0.00000 0.17849 -0.61105 0.00000 -0.31533
|
|
112 10D+2 0.00000 -0.59460 0.48792 0.00000 -0.24412
|
|
113 10D-2 -0.36837 0.00000 0.00000 -0.38830 0.00000
|
|
114 11D 0 0.00000 1.18769 -0.62610 0.00000 0.03236
|
|
115 11D+1 -0.48686 0.00000 0.00000 -0.23329 0.00000
|
|
116 11D-1 0.00000 -0.25978 1.06270 0.00000 0.76495
|
|
117 11D+2 0.00000 1.60498 -0.62701 0.00000 0.59615
|
|
118 11D-2 0.51732 0.00000 0.00000 0.75708 0.00000
|
|
119 12D 0 0.00000 0.58619 -0.20953 0.00000 -0.06550
|
|
120 12D+1 -0.13526 0.00000 0.00000 -0.20467 0.00000
|
|
121 12D-1 0.00000 -0.03588 0.34628 0.00000 0.09540
|
|
122 12D+2 0.00000 0.83463 -0.18496 0.00000 0.20872
|
|
123 12D-2 -0.04717 0.00000 0.00000 0.14311 0.00000
|
|
124 13F 0 0.00000 0.02667 -0.05639 0.00000 0.14098
|
|
125 13F+1 0.01559 0.00000 0.00000 0.09530 0.00000
|
|
126 13F-1 0.00000 -0.13096 -0.10187 0.00000 0.00850
|
|
127 13F+2 0.00000 0.07399 0.05187 0.00000 -0.02876
|
|
128 13F-2 -0.08935 0.00000 0.00000 -0.03955 0.00000
|
|
129 13F+3 -0.11194 0.00000 0.00000 0.02383 0.00000
|
|
130 13F-3 0.00000 -0.14375 -0.03565 0.00000 0.04341
|
|
131 14F 0 0.00000 -0.06786 0.19036 0.00000 0.13662
|
|
132 14F+1 -0.20557 0.00000 0.00000 0.11463 0.00000
|
|
133 14F-1 0.00000 -0.47582 0.37952 0.00000 -0.01193
|
|
134 14F+2 0.00000 -0.07603 0.29397 0.00000 0.24315
|
|
135 14F-2 0.28099 0.00000 0.00000 0.25286 0.00000
|
|
136 14F+3 0.10831 0.00000 0.00000 0.16817 0.00000
|
|
137 14F-3 0.00000 -0.43240 0.26963 0.00000 -0.30750
|
|
138 15G 0 0.00000 -0.02905 -0.07712 0.00000 0.06095
|
|
139 15G+1 -0.06845 0.00000 0.00000 0.19501 0.00000
|
|
140 15G-1 0.00000 0.14159 -0.05541 0.00000 -0.31068
|
|
141 15G+2 0.00000 -0.00263 0.17563 0.00000 -0.10647
|
|
142 15G-2 0.35858 0.00000 0.00000 -0.21783 0.00000
|
|
143 15G+3 -0.00470 0.00000 0.00000 0.20248 0.00000
|
|
144 15G-3 0.00000 -0.09161 -0.26780 0.00000 -0.03465
|
|
145 15G+4 0.00000 -0.16667 0.08973 0.00000 -0.12387
|
|
146 15G-4 0.21185 0.00000 0.00000 0.20191 0.00000
|
|
147 3 H 1S 0.22257 0.45225 -0.08626 0.14941 0.37559
|
|
148 2S 0.12531 -0.39102 0.46245 -0.80099 -1.51159
|
|
149 3S -4.25116 -8.08195 -0.24202 0.41920 -2.29836
|
|
150 4S -1.32555 -3.17802 0.05567 -0.09642 -1.16440
|
|
151 5S 0.10298 -0.02698 -0.05054 0.08753 -0.00926
|
|
152 6PX 0.13599 0.13217 -0.03446 0.06195 -0.12470
|
|
153 6PY -0.10921 -0.07631 0.02216 -0.03446 0.07200
|
|
154 6PZ -0.09502 0.00603 -0.10467 0.18130 -0.04806
|
|
155 7PX -0.24077 -0.13556 -0.13260 0.28452 0.56782
|
|
156 7PY 0.19179 0.07826 0.13140 -0.13260 -0.32783
|
|
157 7PZ 0.12987 -0.06248 0.09177 -0.15895 -0.11573
|
|
158 8PX 1.83376 4.49679 -0.10714 -0.72445 0.94788
|
|
159 8PY -1.35858 -2.59622 -0.84817 -0.10714 -0.54726
|
|
160 8PZ -1.48392 0.03954 0.71067 -1.23092 -1.06463
|
|
161 9PX 0.59973 1.40957 0.01665 -0.01131 0.37993
|
|
162 9PY -0.24521 -0.81382 0.00792 0.01665 -0.21935
|
|
163 9PZ -0.44427 -0.35398 0.09718 -0.16832 -0.15091
|
|
164 10D 0 0.00577 -0.40619 -0.21822 0.37797 0.01853
|
|
165 10D+1 0.10581 0.15457 0.33353 -0.41849 -0.27308
|
|
166 10D-1 0.14308 -0.08924 -0.03336 0.33353 0.15766
|
|
167 10D+2 -0.04858 0.29730 -0.16924 -0.37942 0.12206
|
|
168 10D-2 -0.28422 -0.51494 -0.37942 0.26887 -0.21141
|
|
169 11D 0 -0.15892 1.18769 0.31305 -0.54222 0.03236
|
|
170 11D+1 0.17430 -0.22497 -0.56118 0.73871 0.66247
|
|
171 11D-1 -0.38172 0.12989 0.09071 -0.56118 -0.38247
|
|
172 11D+2 -0.06292 -0.80249 0.41105 0.59933 -0.29808
|
|
173 11D-2 0.62630 1.38995 0.59933 -0.28099 0.51628
|
|
174 12D 0 -0.06178 0.58619 0.10476 -0.18145 -0.06550
|
|
175 12D+1 0.32744 -0.03107 -0.23857 0.20855 0.08262
|
|
176 12D-1 -0.26714 0.01794 -0.06693 -0.23857 -0.04770
|
|
177 12D+2 -0.14835 -0.41732 0.06109 0.14206 -0.10436
|
|
178 12D-2 0.20977 0.72281 0.14206 -0.10294 0.18075
|
|
179 13F 0 0.03276 0.02667 0.02820 -0.04884 0.14098
|
|
180 13F+1 0.13076 -0.11341 0.08538 -0.05258 0.00736
|
|
181 13F-1 -0.06649 0.06548 0.04601 0.08538 -0.00425
|
|
182 13F+2 -0.10564 -0.03699 -0.01670 -0.03959 0.01438
|
|
183 13F-2 0.09363 0.06408 -0.03959 0.02902 -0.02491
|
|
184 13F+3 0.05597 0.00000 -0.02064 -0.01192 0.00000
|
|
185 13F-3 -0.11805 -0.14375 0.01783 -0.03088 0.04341
|
|
186 14F 0 -0.15476 -0.06786 -0.09518 0.16486 0.13662
|
|
187 14F+1 0.04984 -0.41207 -0.11470 0.31330 -0.01033
|
|
188 14F-1 -0.14746 0.23791 0.18085 -0.11470 0.00596
|
|
189 14F+2 0.12315 0.03801 0.26314 -0.01780 -0.12158
|
|
190 14F-2 0.06768 -0.06584 -0.01780 0.28369 0.21057
|
|
191 14F+3 -0.05415 0.00000 -0.14564 -0.08408 0.00000
|
|
192 14F-3 -0.04957 -0.43240 -0.13482 0.23351 -0.30750
|
|
193 15G 0 0.00824 -0.02905 0.03856 -0.06679 0.06095
|
|
194 15G+1 0.12581 0.12262 0.10844 0.00719 -0.26906
|
|
195 15G-1 -0.11215 -0.07079 0.13240 0.10844 0.15534
|
|
196 15G+2 0.08915 0.00132 -0.11946 -0.17037 0.05323
|
|
197 15G-2 0.20416 -0.00228 -0.17037 0.07726 -0.09220
|
|
198 15G+3 0.00235 0.00000 -0.17535 -0.10124 0.00000
|
|
199 15G-3 0.02873 -0.09161 0.13390 -0.23192 -0.03465
|
|
200 15G+4 -0.13669 0.08334 -0.12900 -0.12629 0.06194
|
|
201 15G-4 -0.02490 0.14434 0.12629 -0.01682 0.10728
|
|
202 4 H 1S -0.22257 0.45225 -0.08626 -0.14941 0.37559
|
|
203 2S -0.12531 -0.39102 0.46245 0.80099 -1.51159
|
|
204 3S 4.25116 -8.08195 -0.24202 -0.41920 -2.29836
|
|
205 4S 1.32555 -3.17802 0.05567 0.09642 -1.16440
|
|
206 5S -0.10298 -0.02698 -0.05054 -0.08753 -0.00926
|
|
207 6PX 0.13599 -0.13217 0.03446 0.06195 0.12470
|
|
208 6PY 0.10921 -0.07631 0.02216 0.03446 0.07200
|
|
209 6PZ 0.09502 0.00603 -0.10467 -0.18130 -0.04806
|
|
210 7PX -0.24077 0.13556 0.13260 0.28452 -0.56782
|
|
211 7PY -0.19179 0.07826 0.13140 0.13260 -0.32783
|
|
212 7PZ -0.12987 -0.06248 0.09177 0.15895 -0.11573
|
|
213 8PX 1.83376 -4.49679 0.10714 -0.72445 -0.94788
|
|
214 8PY 1.35858 -2.59622 -0.84817 0.10714 -0.54726
|
|
215 8PZ 1.48392 0.03954 0.71067 1.23092 -1.06463
|
|
216 9PX 0.59973 -1.40957 -0.01665 -0.01131 -0.37993
|
|
217 9PY 0.24521 -0.81382 0.00792 -0.01665 -0.21935
|
|
218 9PZ 0.44427 -0.35398 0.09718 0.16832 -0.15091
|
|
219 10D 0 -0.00577 -0.40619 -0.21822 -0.37797 0.01853
|
|
220 10D+1 0.10581 -0.15457 -0.33353 -0.41849 0.27308
|
|
221 10D-1 -0.14308 -0.08924 -0.03336 -0.33353 0.15766
|
|
222 10D+2 0.04858 0.29730 -0.16924 0.37942 0.12206
|
|
223 10D-2 -0.28422 0.51494 0.37942 0.26887 0.21141
|
|
224 11D 0 0.15892 1.18769 0.31305 0.54222 0.03236
|
|
225 11D+1 0.17430 0.22497 0.56118 0.73871 -0.66247
|
|
226 11D-1 0.38172 0.12989 0.09071 0.56118 -0.38247
|
|
227 11D+2 0.06292 -0.80249 0.41105 -0.59933 -0.29808
|
|
228 11D-2 0.62630 -1.38995 -0.59933 -0.28099 -0.51628
|
|
229 12D 0 0.06178 0.58619 0.10476 0.18145 -0.06550
|
|
230 12D+1 0.32744 0.03107 0.23857 0.20855 -0.08262
|
|
231 12D-1 0.26714 0.01794 -0.06693 0.23857 -0.04770
|
|
232 12D+2 0.14835 -0.41732 0.06109 -0.14206 -0.10436
|
|
233 12D-2 0.20977 -0.72281 -0.14206 -0.10294 -0.18075
|
|
234 13F 0 -0.03276 0.02667 0.02820 0.04884 0.14098
|
|
235 13F+1 0.13076 0.11341 -0.08538 -0.05258 -0.00736
|
|
236 13F-1 0.06649 0.06548 0.04601 -0.08538 -0.00425
|
|
237 13F+2 0.10564 -0.03699 -0.01670 0.03959 0.01438
|
|
238 13F-2 0.09363 -0.06408 0.03959 0.02902 0.02491
|
|
239 13F+3 0.05597 0.00000 0.02064 -0.01192 0.00000
|
|
240 13F-3 0.11805 -0.14375 0.01783 0.03088 0.04341
|
|
241 14F 0 0.15476 -0.06786 -0.09518 -0.16486 0.13662
|
|
242 14F+1 0.04984 0.41207 0.11470 0.31330 0.01033
|
|
243 14F-1 0.14746 0.23791 0.18085 0.11470 0.00596
|
|
244 14F+2 -0.12315 0.03801 0.26314 0.01780 -0.12158
|
|
245 14F-2 0.06768 0.06584 0.01780 0.28369 -0.21057
|
|
246 14F+3 -0.05415 0.00000 0.14564 -0.08408 0.00000
|
|
247 14F-3 0.04957 -0.43240 -0.13482 -0.23351 -0.30750
|
|
248 15G 0 -0.00824 -0.02905 0.03856 0.06679 0.06095
|
|
249 15G+1 0.12581 -0.12262 -0.10844 0.00719 0.26906
|
|
250 15G-1 0.11215 -0.07079 0.13240 -0.10844 0.15534
|
|
251 15G+2 -0.08915 0.00132 -0.11946 0.17037 0.05323
|
|
252 15G-2 0.20416 0.00228 0.17037 0.07726 0.09220
|
|
253 15G+3 0.00235 0.00000 0.17535 -0.10124 0.00000
|
|
254 15G-3 -0.02873 -0.09161 0.13390 0.23192 -0.03465
|
|
255 15G+4 0.13669 0.08334 -0.12900 0.12629 0.06194
|
|
256 15G-4 -0.02490 -0.14434 -0.12629 -0.01682 -0.10728
|
|
216 217 218 219 220
|
|
(E)--V (E)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 16.03855 16.03855 16.23470 16.38063 16.38063
|
|
1 1 N 1S 0.00000 0.00000 0.01252 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 -0.10520 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 -0.71462 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 1.63119 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 2.65738 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.85317 0.00000 0.00000
|
|
7 7PX 0.00000 0.61333 0.00000 0.00000 0.27359
|
|
8 7PY -0.61333 0.00000 0.00000 0.27359 0.00000
|
|
9 7PZ 0.00000 0.00000 0.42662 0.00000 0.00000
|
|
10 8PX 0.00000 -2.85480 0.00000 0.00000 -1.79915
|
|
11 8PY 2.85480 0.00000 0.00000 -1.79915 0.00000
|
|
12 8PZ 0.00000 0.00000 -1.38540 0.00000 0.00000
|
|
13 9PX 0.00000 14.48220 0.00000 0.00000 13.62855
|
|
14 9PY -14.48220 0.00000 0.00000 13.62855 0.00000
|
|
15 9PZ 0.00000 0.00000 2.16774 0.00000 0.00000
|
|
16 10PX 0.00000 9.74169 0.00000 0.00000 6.43167
|
|
17 10PY -9.74169 0.00000 0.00000 6.43167 0.00000
|
|
18 10PZ 0.00000 0.00000 1.27535 0.00000 0.00000
|
|
19 11PX 0.00000 0.57898 0.00000 0.00000 0.15391
|
|
20 11PY -0.57898 0.00000 0.00000 0.15391 0.00000
|
|
21 11PZ 0.00000 0.00000 -0.09668 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.10384 0.00000 0.00000
|
|
23 12D+1 0.00000 0.10032 0.00000 0.00000 -0.14740
|
|
24 12D-1 -0.10032 0.00000 0.00000 -0.14740 0.00000
|
|
25 12D+2 -0.07701 0.00000 0.00000 0.11664 0.00000
|
|
26 12D-2 0.00000 0.07701 0.00000 0.00000 0.11664
|
|
27 13D 0 0.00000 0.00000 0.16096 0.00000 0.00000
|
|
28 13D+1 0.00000 0.25176 0.00000 0.00000 -0.27798
|
|
29 13D-1 -0.25176 0.00000 0.00000 -0.27798 0.00000
|
|
30 13D+2 0.52528 0.00000 0.00000 -0.14711 0.00000
|
|
31 13D-2 0.00000 -0.52528 0.00000 0.00000 -0.14711
|
|
32 14D 0 0.00000 0.00000 -1.86929 0.00000 0.00000
|
|
33 14D+1 0.00000 -6.07547 0.00000 0.00000 -2.29642
|
|
34 14D-1 6.07547 0.00000 0.00000 -2.29642 0.00000
|
|
35 14D+2 1.65079 0.00000 0.00000 -4.80574 0.00000
|
|
36 14D-2 0.00000 -1.65079 0.00000 0.00000 -4.80574
|
|
37 15D 0 0.00000 0.00000 -0.91809 0.00000 0.00000
|
|
38 15D+1 0.00000 -2.75315 0.00000 0.00000 -0.46551
|
|
39 15D-1 2.75315 0.00000 0.00000 -0.46551 0.00000
|
|
40 15D+2 0.82382 0.00000 0.00000 -1.69620 0.00000
|
|
41 15D-2 0.00000 -0.82382 0.00000 0.00000 -1.69620
|
|
42 16F 0 0.00000 0.00000 0.57914 0.00000 0.00000
|
|
43 16F+1 0.00000 -0.16379 0.00000 0.00000 0.99091
|
|
44 16F-1 0.16379 0.00000 0.00000 0.99091 0.00000
|
|
45 16F+2 -0.27648 0.00000 0.00000 0.11039 0.00000
|
|
46 16F-2 0.00000 0.27648 0.00000 0.00000 0.11039
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.67187 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 -0.85890 0.00000 0.00000
|
|
50 17F+1 0.00000 0.24680 0.00000 0.00000 -1.80832
|
|
51 17F-1 -0.24680 0.00000 0.00000 -1.80832 0.00000
|
|
52 17F+2 0.12823 0.00000 0.00000 0.34522 0.00000
|
|
53 17F-2 0.00000 -0.12823 0.00000 0.00000 0.34522
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 -1.25776 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 -0.17610 0.00000 0.00000
|
|
57 18F+1 0.00000 0.22802 0.00000 0.00000 -1.07479
|
|
58 18F-1 -0.22802 0.00000 0.00000 -1.07479 0.00000
|
|
59 18F+2 -0.11581 0.00000 0.00000 0.24512 0.00000
|
|
60 18F-2 0.00000 0.11581 0.00000 0.00000 0.24512
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 -0.31555 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.16273 0.00000 0.00000
|
|
64 19G+1 0.00000 -0.01110 0.00000 0.00000 0.04294
|
|
65 19G-1 0.01110 0.00000 0.00000 0.04294 0.00000
|
|
66 19G+2 -0.11036 0.00000 0.00000 -0.01086 0.00000
|
|
67 19G-2 0.00000 0.11036 0.00000 0.00000 -0.01086
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.15813 0.00000 0.00000
|
|
70 19G+4 -0.01789 0.00000 0.00000 0.12455 0.00000
|
|
71 19G-4 0.00000 -0.01789 0.00000 0.00000 -0.12455
|
|
72 20G 0 0.00000 0.00000 0.65673 0.00000 0.00000
|
|
73 20G+1 0.00000 0.39614 0.00000 0.00000 0.50138
|
|
74 20G-1 -0.39614 0.00000 0.00000 0.50138 0.00000
|
|
75 20G+2 -0.04013 0.00000 0.00000 0.64532 0.00000
|
|
76 20G-2 0.00000 0.04013 0.00000 0.00000 0.64532
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 -0.43071 0.00000 0.00000
|
|
79 20G+4 -0.87792 0.00000 0.00000 0.63310 0.00000
|
|
80 20G-4 0.00000 -0.87792 0.00000 0.00000 -0.63310
|
|
81 21H 0 0.00000 0.00000 -0.00247 0.00000 0.00000
|
|
82 21H+1 0.00000 -0.23711 0.00000 0.00000 0.23076
|
|
83 21H-1 0.23711 0.00000 0.00000 0.23076 0.00000
|
|
84 21H+2 -0.16449 0.00000 0.00000 -0.23314 0.00000
|
|
85 21H-2 0.00000 0.16449 0.00000 0.00000 -0.23314
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.57023 0.00000 0.00000
|
|
88 21H+4 0.59851 0.00000 0.00000 -0.02142 0.00000
|
|
89 21H-4 0.00000 0.59851 0.00000 0.00000 0.02142
|
|
90 21H+5 0.00000 0.43016 0.00000 0.00000 -0.20820
|
|
91 21H-5 0.43016 0.00000 0.00000 0.20820 0.00000
|
|
92 2 H 1S -0.31633 0.00000 0.05193 0.47145 0.00000
|
|
93 2S -0.51663 0.00000 0.30061 0.05721 0.00000
|
|
94 3S 14.98757 0.00000 -0.99977 -12.99546 0.00000
|
|
95 4S 4.57426 0.00000 -0.61968 -3.95209 0.00000
|
|
96 5S -0.06681 0.00000 0.01062 0.14536 0.00000
|
|
97 6PX 0.00000 -0.57277 0.00000 0.00000 0.05788
|
|
98 6PY -0.06123 0.00000 -0.07380 -0.10250 0.00000
|
|
99 6PZ -0.12575 0.00000 -0.53029 -0.71984 0.00000
|
|
100 7PX 0.00000 0.51532 0.00000 0.00000 -0.01225
|
|
101 7PY 0.10863 0.00000 -0.10366 0.10793 0.00000
|
|
102 7PZ 0.11121 0.00000 0.53540 0.72410 0.00000
|
|
103 8PX 0.00000 -3.01368 0.00000 0.00000 -0.53109
|
|
104 8PY -8.25560 0.00000 0.18194 6.78451 0.00000
|
|
105 8PZ 2.72096 0.00000 -1.80284 -5.81076 0.00000
|
|
106 9PX 0.00000 -0.78664 0.00000 0.00000 0.11814
|
|
107 9PY -2.57817 0.00000 0.21683 2.41798 0.00000
|
|
108 9PZ 1.00498 0.00000 -0.47189 -1.41552 0.00000
|
|
109 10D 0 0.21075 0.00000 0.01001 -0.22944 0.00000
|
|
110 10D+1 0.00000 -0.26780 0.00000 0.00000 0.18074
|
|
111 10D-1 0.50803 0.00000 0.18642 -0.46411 0.00000
|
|
112 10D+2 0.63504 0.00000 -0.21117 -0.46861 0.00000
|
|
113 10D-2 0.00000 0.00328 0.00000 0.00000 -0.18369
|
|
114 11D 0 -0.86375 0.00000 -0.50856 0.05161 0.00000
|
|
115 11D+1 0.00000 -0.13136 0.00000 0.00000 -0.27268
|
|
116 11D-1 -1.31424 0.00000 0.34440 2.30744 0.00000
|
|
117 11D+2 -1.99502 0.00000 0.14423 1.34003 0.00000
|
|
118 11D-2 0.00000 1.28283 0.00000 0.00000 0.37549
|
|
119 12D 0 -0.52785 0.00000 -0.27261 -0.09457 0.00000
|
|
120 12D+1 0.00000 -0.31632 0.00000 0.00000 -0.10381
|
|
121 12D-1 -0.95390 0.00000 0.68104 1.99902 0.00000
|
|
122 12D+2 -1.20839 0.00000 -0.03975 1.17468 0.00000
|
|
123 12D-2 0.00000 1.12137 0.00000 0.00000 0.16457
|
|
124 13F 0 -0.02690 0.00000 -0.00066 0.07560 0.00000
|
|
125 13F+1 0.00000 0.06763 0.00000 0.00000 -0.01257
|
|
126 13F-1 0.17990 0.00000 0.25676 0.21517 0.00000
|
|
127 13F+2 -0.03432 0.00000 0.09932 0.20971 0.00000
|
|
128 13F-2 0.00000 0.21559 0.00000 0.00000 -0.01441
|
|
129 13F+3 0.00000 0.46220 0.00000 0.00000 -0.01346
|
|
130 13F-3 0.08872 0.00000 0.00543 0.00129 0.00000
|
|
131 14F 0 -0.24593 0.00000 -0.05121 0.46656 0.00000
|
|
132 14F+1 0.00000 0.14445 0.00000 0.00000 0.00688
|
|
133 14F-1 0.07440 0.00000 0.24090 0.31842 0.00000
|
|
134 14F+2 -0.35252 0.00000 0.15429 0.75513 0.00000
|
|
135 14F-2 0.00000 0.08741 0.00000 0.00000 0.18558
|
|
136 14F+3 0.00000 0.45186 0.00000 0.00000 0.15739
|
|
137 14F-3 0.40080 0.00000 -0.08144 -0.32205 0.00000
|
|
138 15G 0 -0.04004 0.00000 -0.04800 -0.01968 0.00000
|
|
139 15G+1 0.00000 -0.01229 0.00000 0.00000 0.02083
|
|
140 15G-1 -0.01334 0.00000 0.18270 -0.12253 0.00000
|
|
141 15G+2 -0.00089 0.00000 -0.01158 -0.01483 0.00000
|
|
142 15G-2 0.00000 -0.22277 0.00000 0.00000 0.05392
|
|
143 15G+3 0.00000 -0.16820 0.00000 0.00000 0.08611
|
|
144 15G-3 -0.00596 0.00000 -0.04142 -0.14828 0.00000
|
|
145 15G+4 -0.01930 0.00000 -0.16288 -0.11334 0.00000
|
|
146 15G-4 0.00000 -0.15298 0.00000 0.00000 -0.01327
|
|
147 3 H 1S 0.15816 0.27395 0.05193 -0.23572 0.40828
|
|
148 2S 0.25832 0.44742 0.30061 -0.02861 0.04955
|
|
149 3S -7.49379 -12.97962 -0.99977 6.49773 -11.25440
|
|
150 4S -2.28713 -3.96142 -0.61968 1.97605 -3.42261
|
|
151 5S 0.03341 0.05786 0.01062 -0.07268 0.12588
|
|
152 6PX 0.27453 -0.09727 -0.06392 0.06945 -0.06241
|
|
153 6PY 0.41427 -0.27453 0.03690 0.01778 0.06945
|
|
154 6PZ 0.06287 0.10890 -0.53029 0.35992 -0.62340
|
|
155 7PX -0.27018 0.04736 -0.08977 -0.05204 0.07788
|
|
156 7PY -0.35933 0.27018 0.05183 0.01779 -0.05204
|
|
157 7PZ -0.05560 -0.09631 0.53540 -0.36205 0.62709
|
|
158 8PX 4.87974 5.43828 0.15756 -3.16775 4.95561
|
|
159 8PY 0.19636 -4.87974 -0.09097 1.29781 -3.16775
|
|
160 8PZ -1.36048 -2.35642 -1.80284 2.90538 -5.03227
|
|
161 9PX 1.45700 1.73697 0.18778 -0.99586 1.84302
|
|
162 9PY -0.05456 -1.45700 -0.10842 0.69310 -0.99586
|
|
163 9PZ -0.50249 -0.87034 -0.47189 0.70776 -1.22588
|
|
164 10D 0 -0.10538 -0.18252 0.01001 0.11472 -0.19870
|
|
165 10D+1 -0.10403 -0.44797 0.16144 0.27923 -0.30290
|
|
166 10D-1 0.32785 0.10403 -0.09321 0.01953 0.27923
|
|
167 10D+2 0.15630 0.27640 0.10559 -0.25492 0.12338
|
|
168 10D-2 -0.27640 -0.47546 -0.18288 0.12338 -0.39738
|
|
169 11D 0 0.43188 0.74803 -0.50856 -0.02581 0.04470
|
|
170 11D+1 0.62596 0.95284 0.29826 -1.11722 1.66241
|
|
171 11D-1 -0.23004 -0.62596 -0.17220 0.37235 -1.11722
|
|
172 11D+2 -1.46088 -0.30839 -0.07212 0.61662 -0.41766
|
|
173 11D-2 0.30839 1.81697 0.12491 -0.41766 1.09890
|
|
174 12D 0 0.26393 0.45714 -0.27261 0.04728 -0.08190
|
|
175 12D+1 0.55002 0.63634 0.58979 -0.91055 1.47331
|
|
176 12D-1 -0.00124 -0.55002 -0.34052 0.42190 -0.91055
|
|
177 12D+2 -1.14312 -0.03768 0.01988 0.41709 -0.43739
|
|
178 12D-2 0.03768 1.18663 -0.03443 -0.43739 0.92215
|
|
179 13F 0 0.01345 0.02330 -0.00066 -0.03780 0.06548
|
|
180 13F+1 -0.10718 -0.11801 0.22236 -0.09861 0.15824
|
|
181 13F-1 -0.00575 0.10718 -0.12838 0.04437 -0.09861
|
|
182 13F+2 -0.17028 0.07849 -0.04966 0.04162 -0.09705
|
|
183 13F-2 -0.07849 0.07964 0.08601 -0.09705 0.15368
|
|
184 13F+3 0.40028 -0.23110 0.00000 0.01166 0.00673
|
|
185 13F-3 -0.04436 -0.07683 0.00543 -0.00065 0.00112
|
|
186 14F 0 0.12296 0.21298 -0.05121 -0.23328 0.40406
|
|
187 14F+1 -0.09476 -0.01969 0.20863 -0.13490 0.24054
|
|
188 14F-1 -0.08973 0.09476 -0.12045 0.08477 -0.13490
|
|
189 14F+2 -0.15369 -0.11480 -0.07715 0.32797 -0.24662
|
|
190 14F-2 0.11480 0.28624 0.13362 -0.24662 0.61275
|
|
191 14F+3 0.39132 -0.22593 0.00000 -0.13630 -0.07870
|
|
192 14F-3 -0.20040 -0.34711 -0.08144 0.16102 -0.27890
|
|
193 15G 0 0.02002 0.03468 -0.04800 0.00984 -0.01704
|
|
194 15G+1 0.01110 0.00694 0.15822 0.06207 -0.08669
|
|
195 15G-1 0.00588 -0.01110 -0.09135 -0.01501 0.06207
|
|
196 15G+2 0.16686 -0.09685 0.00579 0.03673 0.02977
|
|
197 15G-2 0.09685 -0.05503 -0.01003 0.02977 0.00236
|
|
198 15G+3 -0.14566 0.08410 0.00000 -0.07457 -0.04305
|
|
199 15G-3 0.00298 0.00516 -0.04142 0.07414 -0.12842
|
|
200 15G+4 -0.11956 0.05789 0.08144 -0.01838 0.05482
|
|
201 15G-4 0.05789 -0.05272 0.14106 -0.05482 0.08169
|
|
202 4 H 1S 0.15816 -0.27395 0.05193 -0.23572 -0.40828
|
|
203 2S 0.25832 -0.44742 0.30061 -0.02861 -0.04955
|
|
204 3S -7.49379 12.97962 -0.99977 6.49773 11.25440
|
|
205 4S -2.28713 3.96142 -0.61968 1.97605 3.42261
|
|
206 5S 0.03341 -0.05786 0.01062 -0.07268 -0.12588
|
|
207 6PX -0.27453 -0.09727 0.06392 -0.06945 -0.06241
|
|
208 6PY 0.41427 0.27453 0.03690 0.01778 -0.06945
|
|
209 6PZ 0.06287 -0.10890 -0.53029 0.35992 0.62340
|
|
210 7PX 0.27018 0.04736 0.08977 0.05204 0.07788
|
|
211 7PY -0.35933 -0.27018 0.05183 0.01779 0.05204
|
|
212 7PZ -0.05560 0.09631 0.53540 -0.36205 -0.62709
|
|
213 8PX -4.87974 5.43828 -0.15756 3.16775 4.95561
|
|
214 8PY 0.19636 4.87974 -0.09097 1.29781 3.16775
|
|
215 8PZ -1.36048 2.35642 -1.80284 2.90538 5.03227
|
|
216 9PX -1.45700 1.73697 -0.18778 0.99586 1.84302
|
|
217 9PY -0.05456 1.45700 -0.10842 0.69310 0.99586
|
|
218 9PZ -0.50249 0.87034 -0.47189 0.70776 1.22588
|
|
219 10D 0 -0.10538 0.18252 0.01001 0.11472 0.19870
|
|
220 10D+1 0.10403 -0.44797 -0.16144 -0.27923 -0.30290
|
|
221 10D-1 0.32785 -0.10403 -0.09321 0.01953 -0.27923
|
|
222 10D+2 0.15630 -0.27640 0.10559 -0.25492 -0.12338
|
|
223 10D-2 0.27640 -0.47546 0.18288 -0.12338 -0.39738
|
|
224 11D 0 0.43188 -0.74803 -0.50856 -0.02581 -0.04470
|
|
225 11D+1 -0.62596 0.95284 -0.29826 1.11722 1.66241
|
|
226 11D-1 -0.23004 0.62596 -0.17220 0.37235 1.11722
|
|
227 11D+2 -1.46088 0.30839 -0.07212 0.61662 0.41766
|
|
228 11D-2 -0.30839 1.81697 -0.12491 0.41766 1.09890
|
|
229 12D 0 0.26393 -0.45714 -0.27261 0.04728 0.08190
|
|
230 12D+1 -0.55002 0.63634 -0.58979 0.91055 1.47331
|
|
231 12D-1 -0.00124 0.55002 -0.34052 0.42190 0.91055
|
|
232 12D+2 -1.14312 0.03768 0.01988 0.41709 0.43739
|
|
233 12D-2 -0.03768 1.18663 0.03443 0.43739 0.92215
|
|
234 13F 0 0.01345 -0.02330 -0.00066 -0.03780 -0.06548
|
|
235 13F+1 0.10718 -0.11801 -0.22236 0.09861 0.15824
|
|
236 13F-1 -0.00575 -0.10718 -0.12838 0.04437 0.09861
|
|
237 13F+2 -0.17028 -0.07849 -0.04966 0.04162 0.09705
|
|
238 13F-2 0.07849 0.07964 -0.08601 0.09705 0.15368
|
|
239 13F+3 -0.40028 -0.23110 0.00000 -0.01166 0.00673
|
|
240 13F-3 -0.04436 0.07683 0.00543 -0.00065 -0.00112
|
|
241 14F 0 0.12296 -0.21298 -0.05121 -0.23328 -0.40406
|
|
242 14F+1 0.09476 -0.01969 -0.20863 0.13490 0.24054
|
|
243 14F-1 -0.08973 -0.09476 -0.12045 0.08477 0.13490
|
|
244 14F+2 -0.15369 0.11480 -0.07715 0.32797 0.24662
|
|
245 14F-2 -0.11480 0.28624 -0.13362 0.24662 0.61275
|
|
246 14F+3 -0.39132 -0.22593 0.00000 0.13630 -0.07870
|
|
247 14F-3 -0.20040 0.34711 -0.08144 0.16102 0.27890
|
|
248 15G 0 0.02002 -0.03468 -0.04800 0.00984 0.01704
|
|
249 15G+1 -0.01110 0.00694 -0.15822 -0.06207 -0.08669
|
|
250 15G-1 0.00588 0.01110 -0.09135 -0.01501 -0.06207
|
|
251 15G+2 0.16686 0.09685 0.00579 0.03673 -0.02977
|
|
252 15G-2 -0.09685 -0.05503 0.01003 -0.02977 0.00236
|
|
253 15G+3 0.14566 0.08410 0.00000 0.07457 -0.04305
|
|
254 15G-3 0.00298 -0.00516 -0.04142 0.07414 0.12842
|
|
255 15G+4 -0.11956 -0.05789 0.08144 -0.01838 -0.05482
|
|
256 15G-4 -0.05789 -0.05272 -0.14106 0.05482 0.08169
|
|
221 222 223 224 225
|
|
(A1)--V (A2)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 16.49597 16.73807 16.74272 16.74272 16.94602
|
|
1 1 N 1S 0.00391 0.00000 0.00000 0.00000 0.00000
|
|
2 2S -0.14266 0.00000 0.00000 0.00000 0.00000
|
|
3 3S -0.84963 0.00000 0.00000 0.00000 0.00000
|
|
4 4S 0.16125 0.00000 0.00000 0.00000 0.00000
|
|
5 5S 10.40506 0.00000 0.00000 0.00000 0.00000
|
|
6 6S 2.60049 0.00000 0.00000 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 0.00000 0.23838 0.31324
|
|
8 7PY 0.00000 0.00000 0.23838 0.00000 0.00000
|
|
9 7PZ 0.07908 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 0.00000 0.14816 -0.73719
|
|
11 8PY 0.00000 0.00000 0.14816 0.00000 0.00000
|
|
12 8PZ -0.37889 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 0.00000 -10.95955 0.21095
|
|
14 9PY 0.00000 0.00000 -10.95955 0.00000 0.00000
|
|
15 9PZ 0.04389 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 0.00000 -5.05320 -0.66140
|
|
17 10PY 0.00000 0.00000 -5.05320 0.00000 0.00000
|
|
18 10PZ -0.57191 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 0.00000 -0.49622 0.05315
|
|
20 11PY 0.00000 0.00000 -0.49622 0.00000 0.00000
|
|
21 11PZ -0.13593 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 -0.36270 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 0.03828 0.37449
|
|
24 12D-1 0.00000 0.00000 0.03828 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.08476 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.08476 0.01390
|
|
27 13D 0 0.66830 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 0.07396 -0.33320
|
|
29 13D-1 0.00000 0.00000 0.07396 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 -0.08831 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 -0.08831 0.26042
|
|
32 14D 0 -3.53051 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 5.68543 1.68566
|
|
34 14D-1 0.00000 0.00000 5.68543 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 7.14986 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 7.14986 -0.61766
|
|
37 15D 0 -1.10173 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 1.30439 0.73152
|
|
39 15D-1 0.00000 0.00000 1.30439 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 2.04265 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 2.04265 -0.48296
|
|
42 16F 0 -0.35149 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.62157 -0.04641
|
|
44 16F-1 0.00000 0.00000 0.62157 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.88261 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.88261 0.17642
|
|
47 16F+3 0.00000 -1.52541 0.00000 0.00000 0.00000
|
|
48 16F-3 -0.35543 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.94919 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 -1.15149 -0.13336
|
|
51 17F-1 0.00000 0.00000 -1.15149 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 -2.62923 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 -2.62923 -0.80354
|
|
54 17F+3 0.00000 3.08832 0.00000 0.00000 0.00000
|
|
55 17F-3 0.08016 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.65450 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 -0.62262 -0.71205
|
|
58 18F-1 0.00000 0.00000 -0.62262 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 -1.76941 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 -1.76941 -0.05386
|
|
61 18F+3 0.00000 2.06507 0.00000 0.00000 0.00000
|
|
62 18F-3 -0.33030 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.29969 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 -0.07306 -0.49780
|
|
65 19G-1 0.00000 0.00000 -0.07306 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 -0.02621 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 -0.02621 0.36411
|
|
68 19G+3 0.00000 -0.04141 0.00000 0.00000 0.00000
|
|
69 19G-3 0.22918 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.01240 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 -0.01240 0.22671
|
|
72 20G 0 0.29655 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 -0.05234 -0.23326
|
|
74 20G-1 0.00000 0.00000 -0.05234 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.50413 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.50413 0.21619
|
|
77 20G+3 0.00000 -1.28570 0.00000 0.00000 0.00000
|
|
78 20G-3 -0.42676 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.38979 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 -0.38979 -0.33010
|
|
81 21H 0 -0.73651 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.23746 0.33999
|
|
83 21H-1 0.00000 0.00000 0.23746 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.13248 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.13248 0.32285
|
|
86 21H+3 0.00000 -0.00075 0.00000 0.00000 0.00000
|
|
87 21H-3 0.49754 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 -0.03922 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.03922 -0.17226
|
|
90 21H+5 0.00000 0.00000 0.00000 0.50893 -0.37438
|
|
91 21H-5 0.00000 0.00000 -0.50893 0.00000 0.00000
|
|
92 2 H 1S 0.16642 0.00000 -0.64658 0.00000 0.00000
|
|
93 2S 0.07466 0.00000 0.16312 0.00000 0.00000
|
|
94 3S -3.48643 0.00000 15.47522 0.00000 0.00000
|
|
95 4S -1.44146 0.00000 4.38027 0.00000 0.00000
|
|
96 5S -0.00925 0.00000 0.06143 0.00000 0.00000
|
|
97 6PX 0.00000 0.53601 0.00000 -0.42893 0.43782
|
|
98 6PY 0.07289 0.00000 -0.31479 0.00000 0.00000
|
|
99 6PZ -0.32435 0.00000 -0.20957 0.00000 0.00000
|
|
100 7PX 0.00000 -0.66781 0.00000 0.49501 -0.48388
|
|
101 7PY -0.14339 0.00000 0.26920 0.00000 0.00000
|
|
102 7PZ 0.30334 0.00000 0.36832 0.00000 0.00000
|
|
103 8PX 0.00000 3.10650 0.00000 -2.34628 0.49710
|
|
104 8PY 1.45462 0.00000 -10.30741 0.00000 0.00000
|
|
105 8PZ -1.93612 0.00000 2.01218 0.00000 0.00000
|
|
106 9PX 0.00000 0.56574 0.00000 -0.51213 0.21690
|
|
107 9PY 0.65271 0.00000 -3.03953 0.00000 0.00000
|
|
108 9PZ -0.62959 0.00000 0.90517 0.00000 0.00000
|
|
109 10D 0 -0.28028 0.00000 0.33034 0.00000 0.00000
|
|
110 10D+1 0.00000 -0.13037 0.00000 0.01592 0.04410
|
|
111 10D-1 0.05310 0.00000 0.30057 0.00000 0.00000
|
|
112 10D+2 0.13719 0.00000 0.65506 0.00000 0.00000
|
|
113 10D-2 0.00000 0.14958 0.00000 -0.00061 -0.21921
|
|
114 11D 0 0.21385 0.00000 -1.38608 0.00000 0.00000
|
|
115 11D+1 0.00000 0.62035 0.00000 -0.46566 0.00765
|
|
116 11D-1 0.66597 0.00000 -1.10574 0.00000 0.00000
|
|
117 11D+2 -0.23961 0.00000 -2.60642 0.00000 0.00000
|
|
118 11D-2 0.00000 -1.16271 0.00000 0.80151 0.16723
|
|
119 12D 0 -0.06586 0.00000 -1.30086 0.00000 0.00000
|
|
120 12D+1 0.00000 0.51703 0.00000 -0.37778 -0.02740
|
|
121 12D-1 0.80913 0.00000 -0.87005 0.00000 0.00000
|
|
122 12D+2 0.01207 0.00000 -2.19764 0.00000 0.00000
|
|
123 12D-2 0.00000 -1.33032 0.00000 0.96902 -0.23849
|
|
124 13F 0 0.19016 0.00000 -0.05080 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00117 0.00000 -0.07917 0.06752
|
|
126 13F-1 0.12979 0.00000 0.11279 0.00000 0.00000
|
|
127 13F+2 0.19626 0.00000 -0.08181 0.00000 0.00000
|
|
128 13F-2 0.00000 -0.18618 0.00000 0.22966 -0.14590
|
|
129 13F+3 0.00000 -0.13883 0.00000 0.17376 -0.04983
|
|
130 13F-3 0.12293 0.00000 0.24911 0.00000 0.00000
|
|
131 14F 0 0.31290 0.00000 -0.31008 0.00000 0.00000
|
|
132 14F+1 0.00000 -0.03166 0.00000 0.03219 0.01197
|
|
133 14F-1 0.00115 0.00000 0.66097 0.00000 0.00000
|
|
134 14F+2 0.21097 0.00000 -0.43536 0.00000 0.00000
|
|
135 14F-2 0.00000 -0.40575 0.00000 0.30221 0.03620
|
|
136 14F+3 0.00000 -0.65773 0.00000 0.37357 0.03313
|
|
137 14F-3 0.33638 0.00000 0.80299 0.00000 0.00000
|
|
138 15G 0 0.02393 0.00000 0.06749 0.00000 0.00000
|
|
139 15G+1 0.00000 -0.00692 0.00000 -0.03226 0.03775
|
|
140 15G-1 -0.38752 0.00000 0.09291 0.00000 0.00000
|
|
141 15G+2 0.06594 0.00000 0.01218 0.00000 0.00000
|
|
142 15G-2 0.00000 -0.03904 0.00000 0.11128 -0.20481
|
|
143 15G+3 0.00000 -0.05004 0.00000 0.08557 -0.15118
|
|
144 15G-3 -0.03810 0.00000 0.24488 0.00000 0.00000
|
|
145 15G+4 0.32372 0.00000 0.18177 0.00000 0.00000
|
|
146 15G-4 0.00000 0.01791 0.00000 0.03505 -0.05966
|
|
147 3 H 1S 0.16642 0.00000 0.32329 -0.55995 -0.13099
|
|
148 2S 0.07466 0.00000 -0.08156 0.14126 0.34612
|
|
149 3S -3.48643 0.00000 -7.73761 13.40194 0.48291
|
|
150 4S -1.44146 0.00000 -2.19013 3.79342 0.22785
|
|
151 5S -0.00925 0.00000 -0.03072 0.05320 -0.13017
|
|
152 6PX 0.06312 -0.26800 -0.04942 -0.34333 -0.26702
|
|
153 6PY -0.03644 -0.46419 -0.40040 -0.04942 0.40694
|
|
154 6PZ -0.32435 0.00000 0.10479 -0.18150 -0.03221
|
|
155 7PX -0.12418 0.33391 0.09778 0.32565 0.11816
|
|
156 7PY 0.07170 0.57834 0.43855 0.09778 -0.34759
|
|
157 7PZ 0.30334 0.00000 -0.18416 0.31897 0.18502
|
|
158 8PX 1.25974 -1.55325 3.44727 -8.31713 -0.81264
|
|
159 8PY -0.72731 -2.69030 -4.33656 3.44727 0.75618
|
|
160 8PZ -1.93612 0.00000 -1.00609 1.74260 -1.00910
|
|
161 9PX 0.56526 -0.28287 1.09440 -2.40768 -0.03972
|
|
162 9PY -0.32636 -0.48995 -1.14398 1.09440 0.14816
|
|
163 9PZ -0.62959 0.00000 -0.45258 0.78390 -0.28004
|
|
164 10D 0 -0.28028 0.00000 -0.16517 0.28608 0.06334
|
|
165 10D+1 0.04599 0.06519 -0.12326 0.22941 -0.11061
|
|
166 10D-1 -0.02655 0.11291 0.08708 -0.12326 0.08932
|
|
167 10D+2 -0.06859 -0.12954 0.16331 -0.28391 -0.00926
|
|
168 10D-2 0.11881 -0.07479 -0.28391 0.49114 -0.20317
|
|
169 11D 0 0.21385 0.00000 0.69304 -1.20038 -0.61157
|
|
170 11D+1 0.57675 -0.31017 0.27716 -0.94572 0.16768
|
|
171 11D-1 -0.33299 -0.53724 -0.62568 0.27716 -0.09239
|
|
172 11D+2 0.11980 1.00693 -0.05047 1.47568 0.12522
|
|
173 11D-2 -0.20750 0.58135 1.47568 -1.75444 -0.04965
|
|
174 12D 0 -0.06586 0.00000 0.65043 -1.12658 -0.43419
|
|
175 12D+1 0.70073 -0.25851 0.21316 -0.74698 0.25764
|
|
176 12D-1 -0.40457 -0.44776 -0.50085 0.21316 -0.16457
|
|
177 12D+2 -0.00604 1.15209 0.17735 1.37120 0.02124
|
|
178 12D-2 0.01045 0.66516 1.37120 -1.40598 -0.27528
|
|
179 13F 0 0.19016 0.00000 0.02540 -0.04400 -0.22990
|
|
180 13F+1 0.11240 -0.00058 -0.08312 0.06480 0.23153
|
|
181 13F-1 -0.06489 -0.00101 -0.03118 -0.08312 -0.09469
|
|
182 13F+2 -0.09813 0.16124 0.15179 0.13487 -0.01548
|
|
183 13F-2 0.16997 0.09309 0.13487 -0.00394 -0.11910
|
|
184 13F+3 0.00000 -0.13883 -0.15048 -0.08688 0.02491
|
|
185 13F-3 0.12293 0.00000 -0.12455 0.21573 0.03163
|
|
186 14F 0 0.31290 0.00000 0.15504 -0.26853 -0.13844
|
|
187 14F+1 0.00100 0.01583 -0.27227 0.50378 0.28720
|
|
188 14F-1 -0.00058 0.02741 0.18938 -0.27227 -0.15891
|
|
189 14F+2 -0.10549 0.35139 0.11782 0.31938 -0.00698
|
|
190 14F-2 0.18271 0.20288 0.31938 -0.25097 0.04828
|
|
191 14F+3 0.00000 -0.65773 -0.32352 -0.18678 -0.01657
|
|
192 14F-3 0.33638 0.00000 -0.40150 0.69541 0.01318
|
|
193 15G 0 0.02393 0.00000 -0.03374 0.05845 -0.01595
|
|
194 15G+1 -0.33561 0.00346 -0.05420 0.06162 0.40122
|
|
195 15G-1 0.19376 0.00599 -0.00097 -0.05420 -0.20985
|
|
196 15G+2 -0.03297 0.03381 0.08650 0.04291 -0.16497
|
|
197 15G-2 0.05711 0.01952 0.04291 0.03696 0.08093
|
|
198 15G+3 0.00000 -0.05004 -0.07411 -0.04279 0.07559
|
|
199 15G-3 -0.03810 0.00000 -0.12244 0.21207 0.09717
|
|
200 15G+4 -0.16186 0.01551 0.01916 -0.09389 0.05771
|
|
201 15G-4 -0.28035 -0.00895 0.09389 -0.12757 0.04030
|
|
202 4 H 1S 0.16642 0.00000 0.32329 0.55995 0.13099
|
|
203 2S 0.07466 0.00000 -0.08156 -0.14126 -0.34612
|
|
204 3S -3.48643 0.00000 -7.73761 -13.40194 -0.48291
|
|
205 4S -1.44146 0.00000 -2.19013 -3.79342 -0.22785
|
|
206 5S -0.00925 0.00000 -0.03072 -0.05320 0.13017
|
|
207 6PX -0.06312 -0.26800 0.04942 -0.34333 -0.26702
|
|
208 6PY -0.03644 0.46419 -0.40040 0.04942 -0.40694
|
|
209 6PZ -0.32435 0.00000 0.10479 0.18150 0.03221
|
|
210 7PX 0.12418 0.33391 -0.09778 0.32565 0.11816
|
|
211 7PY 0.07170 -0.57834 0.43855 -0.09778 0.34759
|
|
212 7PZ 0.30334 0.00000 -0.18416 -0.31897 -0.18502
|
|
213 8PX -1.25974 -1.55325 -3.44727 -8.31713 -0.81264
|
|
214 8PY -0.72731 2.69030 -4.33656 -3.44727 -0.75618
|
|
215 8PZ -1.93612 0.00000 -1.00609 -1.74260 1.00910
|
|
216 9PX -0.56526 -0.28287 -1.09440 -2.40768 -0.03972
|
|
217 9PY -0.32636 0.48995 -1.14398 -1.09440 -0.14816
|
|
218 9PZ -0.62959 0.00000 -0.45258 -0.78390 0.28004
|
|
219 10D 0 -0.28028 0.00000 -0.16517 -0.28608 -0.06334
|
|
220 10D+1 -0.04599 0.06519 0.12326 0.22941 -0.11061
|
|
221 10D-1 -0.02655 -0.11291 0.08708 0.12326 -0.08932
|
|
222 10D+2 -0.06859 0.12954 0.16331 0.28391 0.00926
|
|
223 10D-2 -0.11881 -0.07479 0.28391 0.49114 -0.20317
|
|
224 11D 0 0.21385 0.00000 0.69304 1.20038 0.61157
|
|
225 11D+1 -0.57675 -0.31017 -0.27716 -0.94572 0.16768
|
|
226 11D-1 -0.33299 0.53724 -0.62568 -0.27716 0.09239
|
|
227 11D+2 0.11980 -1.00693 -0.05047 -1.47568 -0.12522
|
|
228 11D-2 0.20750 0.58135 -1.47568 -1.75444 -0.04965
|
|
229 12D 0 -0.06586 0.00000 0.65043 1.12658 0.43419
|
|
230 12D+1 -0.70073 -0.25851 -0.21316 -0.74698 0.25764
|
|
231 12D-1 -0.40457 0.44776 -0.50085 -0.21316 0.16457
|
|
232 12D+2 -0.00604 -1.15209 0.17735 -1.37120 -0.02124
|
|
233 12D-2 -0.01045 0.66516 -1.37120 -1.40598 -0.27528
|
|
234 13F 0 0.19016 0.00000 0.02540 0.04400 0.22990
|
|
235 13F+1 -0.11240 -0.00058 0.08312 0.06480 0.23153
|
|
236 13F-1 -0.06489 0.00101 -0.03118 0.08312 0.09469
|
|
237 13F+2 -0.09813 -0.16124 0.15179 -0.13487 0.01548
|
|
238 13F-2 -0.16997 0.09309 -0.13487 -0.00394 -0.11910
|
|
239 13F+3 0.00000 -0.13883 0.15048 -0.08688 0.02491
|
|
240 13F-3 0.12293 0.00000 -0.12455 -0.21573 -0.03163
|
|
241 14F 0 0.31290 0.00000 0.15504 0.26853 0.13844
|
|
242 14F+1 -0.00100 0.01583 0.27227 0.50378 0.28720
|
|
243 14F-1 -0.00058 -0.02741 0.18938 0.27227 0.15891
|
|
244 14F+2 -0.10549 -0.35139 0.11782 -0.31938 0.00698
|
|
245 14F-2 -0.18271 0.20288 -0.31938 -0.25097 0.04828
|
|
246 14F+3 0.00000 -0.65773 0.32352 -0.18678 -0.01657
|
|
247 14F-3 0.33638 0.00000 -0.40150 -0.69541 -0.01318
|
|
248 15G 0 0.02393 0.00000 -0.03374 -0.05845 0.01595
|
|
249 15G+1 0.33561 0.00346 0.05420 0.06162 0.40122
|
|
250 15G-1 0.19376 -0.00599 -0.00097 0.05420 0.20985
|
|
251 15G+2 -0.03297 -0.03381 0.08650 -0.04291 0.16497
|
|
252 15G-2 -0.05711 0.01952 -0.04291 0.03696 0.08093
|
|
253 15G+3 0.00000 -0.05004 0.07411 -0.04279 0.07559
|
|
254 15G-3 -0.03810 0.00000 -0.12244 -0.21207 -0.09717
|
|
255 15G+4 -0.16186 -0.01551 0.01916 0.09389 -0.05771
|
|
256 15G-4 0.28035 -0.00895 -0.09389 -0.12757 0.04030
|
|
226 227 228 229 230
|
|
(E)--V (E)--V (E)--V (A1)--V (E)--V
|
|
Eigenvalues -- 16.94602 16.98611 16.98611 17.10201 17.19573
|
|
1 1 N 1S 0.00000 0.00000 0.00000 -0.00869 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 -0.16714 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 -1.19659 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 0.81485 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 12.74392 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 3.11756 0.00000
|
|
7 7PX 0.00000 0.00000 0.09637 0.00000 0.09979
|
|
8 7PY 0.31324 0.09637 0.00000 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 -0.01458 0.00000
|
|
10 8PX 0.00000 0.00000 -0.70107 0.00000 -0.26578
|
|
11 8PY -0.73719 -0.70107 0.00000 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 -0.40239 0.00000
|
|
13 9PX 0.00000 0.00000 6.74421 0.00000 2.39589
|
|
14 9PY 0.21095 6.74421 0.00000 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 1.34933 0.00000
|
|
16 10PX 0.00000 0.00000 2.09702 0.00000 -0.97266
|
|
17 10PY -0.66140 2.09702 0.00000 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 -0.74637 0.00000
|
|
19 11PX 0.00000 0.00000 0.26388 0.00000 -0.01339
|
|
20 11PY 0.05315 0.26388 0.00000 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 -0.18568 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 -0.34993 0.00000
|
|
23 12D+1 0.00000 0.00000 0.15174 0.00000 0.28142
|
|
24 12D-1 0.37449 0.15174 0.00000 0.00000 0.00000
|
|
25 12D+2 0.01390 0.54539 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.54539 0.00000 0.10631
|
|
27 13D 0 0.00000 0.00000 0.00000 0.27248 0.00000
|
|
28 13D+1 0.00000 0.00000 -0.18121 0.00000 -0.29833
|
|
29 13D-1 -0.33320 -0.18121 0.00000 0.00000 0.00000
|
|
30 13D+2 0.26042 -0.76680 0.00000 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 -0.76680 0.00000 -0.25525
|
|
32 14D 0 0.00000 0.00000 0.00000 -4.16952 0.00000
|
|
33 14D+1 0.00000 0.00000 -2.21026 0.00000 1.18933
|
|
34 14D-1 1.68566 -2.21026 0.00000 0.00000 0.00000
|
|
35 14D+2 -0.61766 2.51223 0.00000 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 2.51223 0.00000 -1.71590
|
|
37 15D 0 0.00000 0.00000 0.00000 -1.28041 0.00000
|
|
38 15D+1 0.00000 0.00000 -0.79392 0.00000 1.07726
|
|
39 15D-1 0.73152 -0.79392 0.00000 0.00000 0.00000
|
|
40 15D+2 -0.48296 1.01148 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 1.01148 0.00000 -0.64983
|
|
42 16F 0 0.00000 0.00000 0.00000 0.09736 0.00000
|
|
43 16F+1 0.00000 0.00000 0.04342 0.00000 0.08821
|
|
44 16F-1 -0.04641 0.04342 0.00000 0.00000 0.00000
|
|
45 16F+2 0.17642 -0.35262 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 -0.35262 0.00000 -0.17779
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.10740 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.01620 0.00000
|
|
50 17F+1 0.00000 0.00000 -0.07892 0.00000 -0.85130
|
|
51 17F-1 -0.13336 -0.07892 0.00000 0.00000 0.00000
|
|
52 17F+2 -0.80354 -0.13054 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 -0.13054 0.00000 0.21355
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 -1.49626 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.48048 0.00000
|
|
57 18F+1 0.00000 0.00000 0.34882 0.00000 -0.88983
|
|
58 18F-1 -0.71205 0.34882 0.00000 0.00000 0.00000
|
|
59 18F+2 -0.05386 -0.94101 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 -0.94101 0.00000 0.23054
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 -1.53359 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.31856 0.00000
|
|
64 19G+1 0.00000 0.00000 -0.10007 0.00000 0.15923
|
|
65 19G-1 -0.49780 -0.10007 0.00000 0.00000 0.00000
|
|
66 19G+2 0.36411 -0.26424 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 -0.26424 0.00000 0.31057
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.05888 0.00000
|
|
70 19G+4 -0.22671 0.32184 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 -0.32184 0.00000 0.36996
|
|
72 20G 0 0.00000 0.00000 0.00000 0.25668 0.00000
|
|
73 20G+1 0.00000 0.00000 -0.13520 0.00000 0.37470
|
|
74 20G-1 -0.23326 -0.13520 0.00000 0.00000 0.00000
|
|
75 20G+2 0.21619 -0.18758 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 -0.18758 0.00000 -0.10269
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.48789 0.00000
|
|
79 20G+4 0.33010 -0.15056 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.15056 0.00000 0.16195
|
|
81 21H 0 0.00000 0.00000 0.00000 0.01383 0.00000
|
|
82 21H+1 0.00000 0.00000 0.18459 0.00000 -0.11576
|
|
83 21H-1 0.33999 0.18459 0.00000 0.00000 0.00000
|
|
84 21H+2 0.32285 0.32154 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.32154 0.00000 -0.14379
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 -0.32580 0.00000
|
|
88 21H+4 0.17226 0.46357 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 -0.46357 0.00000 -0.25208
|
|
90 21H+5 0.00000 0.00000 0.59514 0.00000 0.69476
|
|
91 21H-5 0.37438 -0.59514 0.00000 0.00000 0.00000
|
|
92 2 H 1S -0.15125 -0.26172 0.00000 0.23896 0.00000
|
|
93 2S 0.39967 2.42202 0.00000 -0.61129 0.00000
|
|
94 3S 0.55762 -5.44023 0.00000 -4.26352 0.00000
|
|
95 4S 0.26310 -1.20680 0.00000 -1.63739 0.00000
|
|
96 5S -0.15031 -0.13702 0.00000 -0.01181 0.00000
|
|
97 6PX 0.00000 0.00000 -0.18450 0.00000 0.61469
|
|
98 6PY -0.50197 0.19098 0.00000 0.15701 0.00000
|
|
99 6PZ -0.03720 0.26381 0.00000 -0.36365 0.00000
|
|
100 7PX 0.00000 0.00000 0.56386 0.00000 -0.94041
|
|
101 7PY 0.31884 -1.21121 0.00000 0.16597 0.00000
|
|
102 7PZ 0.21364 0.10991 0.00000 0.66517 0.00000
|
|
103 8PX 0.00000 0.00000 -2.72595 0.00000 1.46300
|
|
104 8PY -1.24922 4.07867 0.00000 1.52724 0.00000
|
|
105 8PZ -1.16521 -0.74486 0.00000 -3.07895 0.00000
|
|
106 9PX 0.00000 0.00000 -0.60718 0.00000 0.50722
|
|
107 9PY -0.12526 1.16501 0.00000 0.68836 0.00000
|
|
108 9PZ -0.32337 -0.22917 0.00000 -0.70245 0.00000
|
|
109 10D 0 0.07314 -0.18328 0.00000 0.47440 0.00000
|
|
110 10D+1 0.00000 0.00000 0.26015 0.00000 -0.02925
|
|
111 10D-1 -0.16218 -0.41877 0.00000 -0.47415 0.00000
|
|
112 10D+2 -0.19782 -0.46524 0.00000 0.20019 0.00000
|
|
113 10D-2 0.00000 0.00000 -0.59593 0.00000 0.25969
|
|
114 11D 0 -0.70619 0.53242 0.00000 -0.76981 0.00000
|
|
115 11D+1 0.00000 0.00000 -0.68243 0.00000 -0.05940
|
|
116 11D-1 0.22102 0.53213 0.00000 1.25080 0.00000
|
|
117 11D+2 -0.12195 0.81934 0.00000 0.04963 0.00000
|
|
118 11D-2 0.00000 0.00000 1.36908 0.00000 -0.47688
|
|
119 12D 0 -0.50136 0.63195 0.00000 -0.42277 0.00000
|
|
120 12D+1 0.00000 0.00000 -0.43278 0.00000 0.02252
|
|
121 12D-1 0.35265 0.44543 0.00000 1.00401 0.00000
|
|
122 12D+2 -0.28754 0.89214 0.00000 0.09632 0.00000
|
|
123 12D-2 0.00000 0.00000 0.98416 0.00000 -0.70043
|
|
124 13F 0 -0.26546 -0.01343 0.00000 0.09553 0.00000
|
|
125 13F+1 0.00000 0.00000 -0.12204 0.00000 -0.06540
|
|
126 13F-1 0.28620 -0.04373 0.00000 0.08622 0.00000
|
|
127 13F+2 -0.11016 -0.13730 0.00000 0.06246 0.00000
|
|
128 13F-2 0.00000 0.00000 0.21944 0.00000 0.04449
|
|
129 13F+3 0.00000 0.00000 0.10265 0.00000 -0.01651
|
|
130 13F-3 0.03652 0.11519 0.00000 -0.17008 0.00000
|
|
131 14F 0 -0.15986 0.17984 0.00000 0.13285 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00095 0.00000 -0.11894
|
|
133 14F-1 0.37895 -0.23612 0.00000 0.65691 0.00000
|
|
134 14F+2 0.05231 0.13945 0.00000 0.50334 0.00000
|
|
135 14F-2 0.00000 0.00000 0.56873 0.00000 -0.02392
|
|
136 14F+3 0.00000 0.00000 0.56410 0.00000 -0.42315
|
|
137 14F-3 0.01522 -0.16816 0.00000 0.07924 0.00000
|
|
138 15G 0 -0.01842 -0.00200 0.00000 0.30768 0.00000
|
|
139 15G+1 0.00000 0.00000 0.06708 0.00000 -0.10803
|
|
140 15G-1 0.52238 0.11549 0.00000 0.02174 0.00000
|
|
141 15G+2 0.17618 -0.04454 0.00000 0.28807 0.00000
|
|
142 15G-2 0.00000 0.00000 0.31268 0.00000 0.06878
|
|
143 15G+3 0.00000 0.00000 0.44249 0.00000 -0.05169
|
|
144 15G-3 0.11220 0.28742 0.00000 -0.18343 0.00000
|
|
145 15G+4 -0.07362 0.18538 0.00000 -0.13880 0.00000
|
|
146 15G-4 0.00000 0.00000 -0.16053 0.00000 0.20304
|
|
147 3 H 1S 0.07563 0.13086 -0.22665 0.23896 -0.01272
|
|
148 2S -0.19983 -1.21101 2.09753 -0.61129 0.46941
|
|
149 3S -0.27881 2.72011 -4.71138 -4.26352 -1.74689
|
|
150 4S -0.13155 0.60340 -1.04512 -1.63739 -0.29065
|
|
151 5S 0.07515 0.06851 -0.11866 -0.01181 -0.08806
|
|
152 6PX 0.40694 -0.16259 0.09711 0.13598 0.06361
|
|
153 6PY 0.20287 -0.09063 -0.16259 -0.07851 0.31816
|
|
154 6PZ 0.01860 -0.13191 0.22847 -0.36365 -0.23244
|
|
155 7PX -0.34759 0.76863 -0.76744 0.14373 -0.30382
|
|
156 7PY -0.28320 0.12009 0.76863 -0.08299 -0.36753
|
|
157 7PZ -0.10682 -0.05495 0.09518 0.66517 0.62530
|
|
158 8PX 0.75618 -2.94649 2.37752 1.32263 1.15043
|
|
159 8PY 0.06052 -1.02480 -2.94649 -0.76362 0.18046
|
|
160 8PZ 0.58260 0.37243 -0.64507 -3.07895 -2.10559
|
|
161 9PX 0.14816 -0.76738 0.72196 0.59614 0.46989
|
|
162 9PY 0.13136 -0.16413 -0.76738 -0.34418 0.02155
|
|
163 9PZ 0.16168 0.11459 -0.19847 -0.70245 -0.44444
|
|
164 10D 0 -0.03657 0.09164 -0.15873 0.47440 0.08782
|
|
165 10D+1 0.08932 0.29398 -0.24904 -0.41062 -0.45623
|
|
166 10D-1 -0.00747 0.09042 0.29398 0.23707 0.24652
|
|
167 10D+2 -0.21386 -0.56326 -0.05659 -0.10009 0.09674
|
|
168 10D-2 -0.00926 -0.05659 -0.49792 0.17337 0.09213
|
|
169 11D 0 0.35309 -0.26621 0.46109 -0.76981 -0.08337
|
|
170 11D+1 -0.09239 -0.52592 0.22849 1.08323 0.87299
|
|
171 11D-1 0.06099 -0.37879 -0.52592 -0.62540 -0.53832
|
|
172 11D+2 0.09494 1.23164 0.23804 -0.02482 -0.11101
|
|
173 11D-2 0.12522 0.23804 0.95678 0.04298 -0.28460
|
|
174 12D 0 0.25068 -0.31598 0.54729 -0.42277 -0.13214
|
|
175 12D+1 -0.16457 -0.38027 0.22588 0.86950 0.71473
|
|
176 12D-1 0.06761 -0.21323 -0.38027 -0.50201 -0.39965
|
|
177 12D+2 -0.25075 0.96115 0.03985 -0.04816 -0.41156
|
|
178 12D-2 0.02124 0.03985 0.91514 0.08342 0.01242
|
|
179 13F 0 0.13273 0.00671 -0.01163 0.09553 0.17570
|
|
180 13F+1 -0.09469 -0.03391 -0.06331 0.07467 -0.02912
|
|
181 13F-1 0.12219 -0.10246 -0.03391 -0.04311 -0.02095
|
|
182 13F+2 -0.13697 0.13026 0.15448 -0.03123 0.03518
|
|
183 13F-2 -0.01548 0.15448 -0.04812 0.05409 -0.01644
|
|
184 13F+3 0.04315 -0.08890 -0.05132 0.00000 0.00825
|
|
185 13F-3 -0.01826 -0.05759 0.09976 -0.17008 0.24139
|
|
186 14F 0 0.07993 -0.08992 0.15575 0.13285 0.33351
|
|
187 14F+1 -0.15891 0.10265 -0.17685 0.56890 0.18439
|
|
188 14F-1 0.10371 -0.05832 0.10265 -0.32846 -0.17513
|
|
189 14F+2 0.04023 0.46141 0.18588 -0.25167 -0.20106
|
|
190 14F-2 -0.00698 0.18588 0.24677 0.43590 0.32433
|
|
191 14F+3 -0.02869 -0.48853 -0.28205 0.00000 0.21158
|
|
192 14F-3 -0.00761 0.08408 -0.14564 0.07924 0.20251
|
|
193 15G 0 0.00921 0.00100 -0.00173 0.30768 0.20289
|
|
194 15G+1 -0.20985 -0.02096 0.10339 0.01883 -0.28884
|
|
195 15G-1 0.15890 0.07918 -0.02096 -0.01087 0.10439
|
|
196 15G+2 -0.10956 0.22338 0.15468 -0.14403 -0.03204
|
|
197 15G-2 -0.16497 0.15468 0.04476 0.24947 0.12427
|
|
198 15G+3 0.13093 -0.38320 -0.22124 0.00000 0.02584
|
|
199 15G-3 -0.05610 -0.14371 0.24891 -0.18343 0.08251
|
|
200 15G+4 0.02634 0.16674 -0.01076 0.06940 -0.31494
|
|
201 15G-4 -0.05771 0.01076 -0.17917 0.12021 -0.34245
|
|
202 4 H 1S 0.07563 0.13086 0.22665 0.23896 0.01272
|
|
203 2S -0.19983 -1.21101 -2.09753 -0.61129 -0.46941
|
|
204 3S -0.27881 2.72011 4.71138 -4.26352 1.74689
|
|
205 4S -0.13155 0.60340 1.04512 -1.63739 0.29065
|
|
206 5S 0.07515 0.06851 0.11866 -0.01181 0.08806
|
|
207 6PX -0.40694 0.16259 0.09711 -0.13598 0.06361
|
|
208 6PY 0.20287 -0.09063 0.16259 -0.07851 -0.31816
|
|
209 6PZ 0.01860 -0.13191 -0.22847 -0.36365 0.23244
|
|
210 7PX 0.34759 -0.76863 -0.76744 -0.14373 -0.30382
|
|
211 7PY -0.28320 0.12009 -0.76863 -0.08299 0.36753
|
|
212 7PZ -0.10682 -0.05495 -0.09518 0.66517 -0.62530
|
|
213 8PX -0.75618 2.94649 2.37752 -1.32263 1.15043
|
|
214 8PY 0.06052 -1.02480 2.94649 -0.76362 -0.18046
|
|
215 8PZ 0.58260 0.37243 0.64507 -3.07895 2.10559
|
|
216 9PX -0.14816 0.76738 0.72196 -0.59614 0.46989
|
|
217 9PY 0.13136 -0.16413 0.76738 -0.34418 -0.02155
|
|
218 9PZ 0.16168 0.11459 0.19847 -0.70245 0.44444
|
|
219 10D 0 -0.03657 0.09164 0.15873 0.47440 -0.08782
|
|
220 10D+1 -0.08932 -0.29398 -0.24904 0.41062 -0.45623
|
|
221 10D-1 -0.00747 0.09042 -0.29398 0.23707 -0.24652
|
|
222 10D+2 -0.21386 -0.56326 0.05659 -0.10009 -0.09674
|
|
223 10D-2 0.00926 0.05659 -0.49792 -0.17337 0.09213
|
|
224 11D 0 0.35309 -0.26621 -0.46109 -0.76981 0.08337
|
|
225 11D+1 0.09239 0.52592 0.22849 -1.08323 0.87299
|
|
226 11D-1 0.06099 -0.37879 0.52592 -0.62540 0.53832
|
|
227 11D+2 0.09494 1.23164 -0.23804 -0.02482 0.11101
|
|
228 11D-2 -0.12522 -0.23804 0.95678 -0.04298 -0.28460
|
|
229 12D 0 0.25068 -0.31598 -0.54729 -0.42277 0.13214
|
|
230 12D+1 0.16457 0.38027 0.22588 -0.86950 0.71473
|
|
231 12D-1 0.06761 -0.21323 0.38027 -0.50201 0.39965
|
|
232 12D+2 -0.25075 0.96115 -0.03985 -0.04816 0.41156
|
|
233 12D-2 -0.02124 -0.03985 0.91514 -0.08342 0.01242
|
|
234 13F 0 0.13273 0.00671 0.01163 0.09553 -0.17570
|
|
235 13F+1 0.09469 0.03391 -0.06331 -0.07467 -0.02912
|
|
236 13F-1 0.12219 -0.10246 0.03391 -0.04311 0.02095
|
|
237 13F+2 -0.13697 0.13026 -0.15448 -0.03123 -0.03518
|
|
238 13F-2 0.01548 -0.15448 -0.04812 -0.05409 -0.01644
|
|
239 13F+3 -0.04315 0.08890 -0.05132 0.00000 0.00825
|
|
240 13F-3 -0.01826 -0.05759 -0.09976 -0.17008 -0.24139
|
|
241 14F 0 0.07993 -0.08992 -0.15575 0.13285 -0.33351
|
|
242 14F+1 0.15891 -0.10265 -0.17685 -0.56890 0.18439
|
|
243 14F-1 0.10371 -0.05832 -0.10265 -0.32846 0.17513
|
|
244 14F+2 0.04023 0.46141 -0.18588 -0.25167 0.20106
|
|
245 14F-2 0.00698 -0.18588 0.24677 -0.43590 0.32433
|
|
246 14F+3 0.02869 0.48853 -0.28205 0.00000 0.21158
|
|
247 14F-3 -0.00761 0.08408 0.14564 0.07924 -0.20251
|
|
248 15G 0 0.00921 0.00100 0.00173 0.30768 -0.20289
|
|
249 15G+1 0.20985 0.02096 0.10339 -0.01883 -0.28884
|
|
250 15G-1 0.15890 0.07918 0.02096 -0.01087 -0.10439
|
|
251 15G+2 -0.10956 0.22338 -0.15468 -0.14403 0.03204
|
|
252 15G-2 0.16497 -0.15468 0.04476 -0.24947 0.12427
|
|
253 15G+3 -0.13093 0.38320 -0.22124 0.00000 0.02584
|
|
254 15G-3 -0.05610 -0.14371 -0.24891 -0.18343 -0.08251
|
|
255 15G+4 0.02634 0.16674 0.01076 0.06940 0.31494
|
|
256 15G-4 0.05771 -0.01076 -0.17917 -0.12021 -0.34245
|
|
231 232 233 234 235
|
|
(E)--V (A1)--V (E)--V (E)--V (A2)--V
|
|
Eigenvalues -- 17.19573 17.21685 17.37612 17.37612 17.48753
|
|
1 1 N 1S 0.00000 0.00619 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 -0.20660 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 -1.58829 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 3.38326 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 9.05246 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 3.43486 0.00000 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 0.16259 0.00000 0.00000
|
|
8 7PY -0.09979 0.00000 0.00000 0.16259 0.00000
|
|
9 7PZ 0.00000 0.34182 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 -0.72164 0.00000 0.00000
|
|
11 8PY 0.26578 0.00000 0.00000 -0.72164 0.00000
|
|
12 8PZ 0.00000 -0.59331 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 0.18336 0.00000 0.00000
|
|
14 9PY -2.39589 0.00000 0.00000 0.18336 0.00000
|
|
15 9PZ 0.00000 -2.67495 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 0.98130 0.00000 0.00000
|
|
17 10PY 0.97266 0.00000 0.00000 0.98130 0.00000
|
|
18 10PZ 0.00000 -2.53438 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 0.02610 0.00000 0.00000
|
|
20 11PY 0.01339 0.00000 0.00000 0.02610 0.00000
|
|
21 11PZ 0.00000 -0.37249 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.17964 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 -0.42963 0.00000 0.00000
|
|
24 12D-1 -0.28142 0.00000 0.00000 -0.42963 0.00000
|
|
25 12D+2 -0.10631 0.00000 0.00000 0.14234 0.00000
|
|
26 12D-2 0.00000 0.00000 0.14234 0.00000 0.00000
|
|
27 13D 0 0.00000 -0.17905 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.86121 0.00000 0.00000
|
|
29 13D-1 0.29833 0.00000 0.00000 0.86121 0.00000
|
|
30 13D+2 0.25525 0.00000 0.00000 -0.27209 0.00000
|
|
31 13D-2 0.00000 0.00000 -0.27209 0.00000 0.00000
|
|
32 14D 0 0.00000 -0.00641 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 -3.39640 0.00000 0.00000
|
|
34 14D-1 -1.18933 0.00000 0.00000 -3.39640 0.00000
|
|
35 14D+2 1.71590 0.00000 0.00000 4.55974 0.00000
|
|
36 14D-2 0.00000 0.00000 4.55974 0.00000 0.00000
|
|
37 15D 0 0.00000 0.36827 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 -0.96756 0.00000 0.00000
|
|
39 15D-1 -1.07726 0.00000 0.00000 -0.96756 0.00000
|
|
40 15D+2 0.64983 0.00000 0.00000 0.95895 0.00000
|
|
41 15D-2 0.00000 0.00000 0.95895 0.00000 0.00000
|
|
42 16F 0 0.00000 0.13929 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 -0.31582 0.00000 0.00000
|
|
44 16F-1 -0.08821 0.00000 0.00000 -0.31582 0.00000
|
|
45 16F+2 0.17779 0.00000 0.00000 0.39817 0.00000
|
|
46 16F-2 0.00000 0.00000 0.39817 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.36233
|
|
48 16F-3 0.00000 0.11761 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.23629 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 1.11751 0.00000 0.00000
|
|
51 17F-1 0.85130 0.00000 0.00000 1.11751 0.00000
|
|
52 17F+2 -0.21355 0.00000 0.00000 -1.06733 0.00000
|
|
53 17F-2 0.00000 0.00000 -1.06733 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 -1.02191
|
|
55 17F-3 0.00000 -0.46974 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 -0.17831 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 1.04130 0.00000 0.00000
|
|
58 18F-1 0.88983 0.00000 0.00000 1.04130 0.00000
|
|
59 18F+2 -0.23054 0.00000 0.00000 -0.85862 0.00000
|
|
60 18F-2 0.00000 0.00000 -0.85862 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.21150
|
|
62 18F-3 0.00000 0.07239 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 -0.36704 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.20525 0.00000 0.00000
|
|
65 19G-1 -0.15923 0.00000 0.00000 0.20525 0.00000
|
|
66 19G+2 -0.31057 0.00000 0.00000 -0.12815 0.00000
|
|
67 19G-2 0.00000 0.00000 -0.12815 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 -0.12965
|
|
69 19G-3 0.00000 0.50841 0.00000 0.00000 0.00000
|
|
70 19G+4 0.36996 0.00000 0.00000 -0.04202 0.00000
|
|
71 19G-4 0.00000 0.00000 0.04202 0.00000 0.00000
|
|
72 20G 0 0.00000 0.36131 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.19502 0.00000 0.00000
|
|
74 20G-1 -0.37470 0.00000 0.00000 0.19502 0.00000
|
|
75 20G+2 0.10269 0.00000 0.00000 0.37594 0.00000
|
|
76 20G-2 0.00000 0.00000 0.37594 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 -0.59783
|
|
78 20G-3 0.00000 -0.11821 0.00000 0.00000 0.00000
|
|
79 20G+4 0.16195 0.00000 0.00000 -0.31978 0.00000
|
|
80 20G-4 0.00000 0.00000 0.31978 0.00000 0.00000
|
|
81 21H 0 0.00000 -0.20676 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 -0.41946 0.00000 0.00000
|
|
83 21H-1 0.11576 0.00000 0.00000 -0.41946 0.00000
|
|
84 21H+2 0.14379 0.00000 0.00000 -0.33975 0.00000
|
|
85 21H-2 0.00000 0.00000 -0.33975 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 1.13307
|
|
87 21H-3 0.00000 -0.00574 0.00000 0.00000 0.00000
|
|
88 21H+4 -0.25208 0.00000 0.00000 0.02670 0.00000
|
|
89 21H-4 0.00000 0.00000 -0.02670 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.10054 0.00000 0.00000
|
|
91 21H-5 0.69476 0.00000 0.00000 -0.10054 0.00000
|
|
92 2 H 1S 0.01469 0.04515 0.00000 -0.08624 0.00000
|
|
93 2S -0.54202 0.52703 0.00000 0.11922 0.00000
|
|
94 3S 2.01713 -3.12032 0.00000 1.55199 0.00000
|
|
95 4S 0.33561 -2.16580 0.00000 0.12758 0.00000
|
|
96 5S 0.10169 0.04537 0.00000 0.04422 0.00000
|
|
97 6PX 0.00000 0.00000 0.18276 0.00000 0.41684
|
|
98 6PY 0.12008 0.79112 0.00000 -0.22108 0.00000
|
|
99 6PZ 0.26840 0.22046 0.00000 0.00460 0.00000
|
|
100 7PX 0.00000 0.00000 0.19744 0.00000 -0.41469
|
|
101 7PY 0.09163 -1.07122 0.00000 0.21579 0.00000
|
|
102 7PZ -0.72203 -0.35761 0.00000 -0.24720 0.00000
|
|
103 8PX 0.00000 0.00000 -2.85522 0.00000 0.31410
|
|
104 8PY -1.04624 2.64061 0.00000 -0.62513 0.00000
|
|
105 8PZ 2.43132 -0.39098 0.00000 2.52143 0.00000
|
|
106 9PX 0.00000 0.00000 -0.56952 0.00000 0.15142
|
|
107 9PY -0.45745 1.15062 0.00000 -0.13479 0.00000
|
|
108 9PZ 0.51319 -0.15651 0.00000 0.46896 0.00000
|
|
109 10D 0 -0.10141 -0.00286 0.00000 -0.32906 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00950 0.00000 0.17922
|
|
111 10D-1 0.59855 0.08487 0.00000 0.40353 0.00000
|
|
112 10D+2 -0.03628 0.02233 0.00000 0.04673 0.00000
|
|
113 10D-2 0.00000 0.00000 -0.93448 0.00000 -0.18418
|
|
114 11D 0 0.09627 0.13075 0.00000 0.94746 0.00000
|
|
115 11D+1 0.00000 0.00000 -0.00175 0.00000 -0.53794
|
|
116 11D-1 -1.18379 0.26965 0.00000 -1.07065 0.00000
|
|
117 11D+2 0.22051 0.33966 0.00000 -0.16925 0.00000
|
|
118 11D-2 0.00000 0.00000 2.08826 0.00000 0.13042
|
|
119 12D 0 0.15258 0.40755 0.00000 0.37262 0.00000
|
|
120 12D+1 0.00000 0.00000 -0.14155 0.00000 -0.01446
|
|
121 12D-1 -0.94547 0.19185 0.00000 -0.88639 0.00000
|
|
122 12D+2 -0.25003 0.83221 0.00000 -0.16498 0.00000
|
|
123 12D-2 0.00000 0.00000 1.03789 0.00000 -0.30792
|
|
124 13F 0 -0.20288 0.09860 0.00000 0.09225 0.00000
|
|
125 13F+1 0.00000 0.00000 0.12391 0.00000 -0.21519
|
|
126 13F-1 0.01703 -0.05006 0.00000 -0.28334 0.00000
|
|
127 13F+2 0.03675 0.13052 0.00000 0.00204 0.00000
|
|
128 13F-2 0.00000 0.00000 -0.10717 0.00000 0.27768
|
|
129 13F+3 0.00000 0.00000 0.26500 0.00000 -0.13875
|
|
130 13F-3 -0.27873 -0.10200 0.00000 0.13643 0.00000
|
|
131 14F 0 -0.38511 0.10129 0.00000 -0.07970 0.00000
|
|
132 14F+1 0.00000 0.00000 0.33913 0.00000 -0.20300
|
|
133 14F-1 -0.28550 -0.16897 0.00000 -0.52728 0.00000
|
|
134 14F+2 -0.44041 0.02017 0.00000 -0.42305 0.00000
|
|
135 14F-2 0.00000 0.00000 0.10798 0.00000 0.25835
|
|
136 14F+3 0.00000 0.00000 0.90316 0.00000 -0.10947
|
|
137 14F-3 -0.23384 -0.30216 0.00000 0.17100 0.00000
|
|
138 15G 0 -0.23428 -0.05882 0.00000 -0.17688 0.00000
|
|
139 15G+1 0.00000 0.00000 -0.00477 0.00000 -0.00990
|
|
140 15G-1 0.34911 -0.16983 0.00000 -0.22329 0.00000
|
|
141 15G+2 -0.14277 -0.13571 0.00000 -0.19279 0.00000
|
|
142 15G-2 0.00000 0.00000 -0.34186 0.00000 0.47870
|
|
143 15G+3 0.00000 0.00000 -0.10362 0.00000 0.27834
|
|
144 15G-3 -0.09528 0.01327 0.00000 0.06302 0.00000
|
|
145 15G+4 -0.52428 -0.22979 0.00000 0.28518 0.00000
|
|
146 15G-4 0.00000 0.00000 -0.41541 0.00000 0.23643
|
|
147 3 H 1S -0.00734 0.04515 -0.07468 0.04312 0.00000
|
|
148 2S 0.27101 0.52703 0.10325 -0.05961 0.00000
|
|
149 3S -1.00857 -3.12032 1.34407 -0.77600 0.00000
|
|
150 4S -0.16781 -2.16580 0.11049 -0.06379 0.00000
|
|
151 5S -0.05084 0.04537 0.03829 -0.02211 0.00000
|
|
152 6PX -0.31816 0.68513 -0.12012 0.17487 -0.20842
|
|
153 6PY -0.43099 -0.39556 0.17487 0.08180 -0.36099
|
|
154 6PZ -0.13420 0.22046 0.00399 -0.00230 0.00000
|
|
155 7PX 0.36753 -0.92771 0.21120 -0.00794 0.20735
|
|
156 7PY 0.72822 0.53561 -0.00794 0.20203 0.35913
|
|
157 7PZ 0.36102 -0.35761 -0.21408 0.12360 0.00000
|
|
158 8PX -0.18046 2.28683 -1.18265 -0.96566 -0.15705
|
|
159 8PY -1.35881 -1.32030 -0.96566 -2.29769 -0.27202
|
|
160 8PZ -1.21566 -0.39098 2.18363 -1.26072 0.00000
|
|
161 9PX -0.02155 0.99646 -0.24348 -0.18824 -0.07571
|
|
162 9PY -0.49477 -0.57531 -0.18824 -0.46084 -0.13113
|
|
163 9PZ -0.25660 -0.15651 0.40613 -0.23448 0.00000
|
|
164 10D 0 0.05070 -0.00286 -0.28498 0.16453 0.00000
|
|
165 10D+1 -0.24652 0.07350 0.30502 -0.17062 -0.08961
|
|
166 10D-1 0.17157 -0.04243 -0.17062 0.10801 -0.15521
|
|
167 10D+2 -0.20384 -0.01117 -0.42487 -0.68918 0.15951
|
|
168 10D-2 -0.09674 0.01934 -0.19857 -0.42487 0.09209
|
|
169 11D 0 -0.04814 0.13075 0.82052 -0.47373 0.00000
|
|
170 11D+1 0.53832 0.23353 -0.80342 0.46285 0.26897
|
|
171 11D-1 -0.25140 -0.13483 0.46285 -0.26897 0.46587
|
|
172 11D+2 0.41279 -0.16983 0.97753 1.52388 -0.11295
|
|
173 11D-2 0.11101 0.29415 0.39513 0.97753 -0.06521
|
|
174 12D 0 -0.07629 0.40755 0.32270 -0.18631 0.00000
|
|
175 12D+1 0.39965 0.16615 -0.70018 0.32253 0.00723
|
|
176 12D-1 -0.25325 -0.09593 0.32253 -0.32776 0.01252
|
|
177 12D+2 0.46282 -0.41610 0.52086 0.73717 0.26667
|
|
178 12D-2 0.41156 0.72071 0.13574 0.52086 0.15396
|
|
179 13F 0 0.10144 0.09860 0.07989 -0.04613 0.00000
|
|
180 13F+1 0.02095 -0.04335 -0.18153 0.17635 0.10760
|
|
181 13F-1 0.05331 0.02503 0.17635 0.02210 0.18636
|
|
182 13F+2 -0.02418 -0.06526 -0.04729 -0.07987 -0.24048
|
|
183 13F-2 -0.03518 0.11304 -0.02526 -0.04729 -0.13884
|
|
184 13F+3 -0.01430 0.00000 -0.13250 -0.22950 -0.13875
|
|
185 13F-3 0.13937 -0.10200 0.11815 -0.06821 0.00000
|
|
186 14F 0 0.19255 0.10129 -0.06902 0.03985 0.00000
|
|
187 14F+1 0.17513 -0.14633 -0.31068 0.37517 0.10150
|
|
188 14F-1 0.01783 0.08449 0.37517 0.12252 0.17580
|
|
189 14F+2 -0.09216 -0.01008 0.22994 -0.02478 -0.22374
|
|
190 14F-2 0.20106 0.01746 -0.29029 0.22994 -0.12918
|
|
191 14F+3 -0.36646 0.00000 -0.45158 -0.78216 -0.10947
|
|
192 14F-3 0.11692 -0.30216 0.14809 -0.08550 0.00000
|
|
193 15G 0 0.11714 -0.05882 -0.15318 0.08844 0.00000
|
|
194 15G+1 -0.10439 -0.14707 -0.16866 0.09462 0.00495
|
|
195 15G-1 0.16830 0.08491 0.09462 -0.05940 0.00857
|
|
196 15G+2 -0.08727 0.06786 -0.06455 -0.30460 -0.41457
|
|
197 15G-2 0.03204 -0.11753 -0.23006 -0.06455 -0.23935
|
|
198 15G+3 -0.04476 0.00000 0.05181 0.08974 0.27834
|
|
199 15G-3 0.04764 0.01327 0.05457 -0.03151 0.00000
|
|
200 15G+4 0.02121 0.11490 0.05639 0.38285 0.20475
|
|
201 15G-4 -0.31494 0.19901 -0.31774 -0.05639 -0.11821
|
|
202 4 H 1S -0.00734 0.04515 0.07468 0.04312 0.00000
|
|
203 2S 0.27101 0.52703 -0.10325 -0.05961 0.00000
|
|
204 3S -1.00857 -3.12032 -1.34407 -0.77600 0.00000
|
|
205 4S -0.16781 -2.16580 -0.11049 -0.06379 0.00000
|
|
206 5S -0.05084 0.04537 -0.03829 -0.02211 0.00000
|
|
207 6PX 0.31816 -0.68513 -0.12012 -0.17487 -0.20842
|
|
208 6PY -0.43099 -0.39556 -0.17487 0.08180 0.36099
|
|
209 6PZ -0.13420 0.22046 -0.00399 -0.00230 0.00000
|
|
210 7PX -0.36753 0.92771 0.21120 0.00794 0.20735
|
|
211 7PY 0.72822 0.53561 0.00794 0.20203 -0.35913
|
|
212 7PZ 0.36102 -0.35761 0.21408 0.12360 0.00000
|
|
213 8PX 0.18046 -2.28683 -1.18265 0.96566 -0.15705
|
|
214 8PY -1.35881 -1.32030 0.96566 -2.29769 0.27202
|
|
215 8PZ -1.21566 -0.39098 -2.18363 -1.26072 0.00000
|
|
216 9PX 0.02155 -0.99646 -0.24348 0.18824 -0.07571
|
|
217 9PY -0.49477 -0.57531 0.18824 -0.46084 0.13113
|
|
218 9PZ -0.25660 -0.15651 -0.40613 -0.23448 0.00000
|
|
219 10D 0 0.05070 -0.00286 0.28498 0.16453 0.00000
|
|
220 10D+1 0.24652 -0.07350 0.30502 0.17062 -0.08961
|
|
221 10D-1 0.17157 -0.04243 0.17062 0.10801 0.15521
|
|
222 10D+2 -0.20384 -0.01117 0.42487 -0.68918 -0.15951
|
|
223 10D-2 0.09674 -0.01934 -0.19857 0.42487 0.09209
|
|
224 11D 0 -0.04814 0.13075 -0.82052 -0.47373 0.00000
|
|
225 11D+1 -0.53832 -0.23353 -0.80342 -0.46285 0.26897
|
|
226 11D-1 -0.25140 -0.13483 -0.46285 -0.26897 -0.46587
|
|
227 11D+2 0.41279 -0.16983 -0.97753 1.52388 0.11295
|
|
228 11D-2 -0.11101 -0.29415 0.39513 -0.97753 -0.06521
|
|
229 12D 0 -0.07629 0.40755 -0.32270 -0.18631 0.00000
|
|
230 12D+1 -0.39965 -0.16615 -0.70018 -0.32253 0.00723
|
|
231 12D-1 -0.25325 -0.09593 -0.32253 -0.32776 -0.01252
|
|
232 12D+2 0.46282 -0.41610 -0.52086 0.73717 -0.26667
|
|
233 12D-2 -0.41156 -0.72071 0.13574 -0.52086 0.15396
|
|
234 13F 0 0.10144 0.09860 -0.07989 -0.04613 0.00000
|
|
235 13F+1 -0.02095 0.04335 -0.18153 -0.17635 0.10760
|
|
236 13F-1 0.05331 0.02503 -0.17635 0.02210 -0.18636
|
|
237 13F+2 -0.02418 -0.06526 0.04729 -0.07987 0.24048
|
|
238 13F-2 0.03518 -0.11304 -0.02526 0.04729 -0.13884
|
|
239 13F+3 0.01430 0.00000 -0.13250 0.22950 -0.13875
|
|
240 13F-3 0.13937 -0.10200 -0.11815 -0.06821 0.00000
|
|
241 14F 0 0.19255 0.10129 0.06902 0.03985 0.00000
|
|
242 14F+1 -0.17513 0.14633 -0.31068 -0.37517 0.10150
|
|
243 14F-1 0.01783 0.08449 -0.37517 0.12252 -0.17580
|
|
244 14F+2 -0.09216 -0.01008 -0.22994 -0.02478 0.22374
|
|
245 14F-2 -0.20106 -0.01746 -0.29029 -0.22994 -0.12918
|
|
246 14F+3 0.36646 0.00000 -0.45158 0.78216 -0.10947
|
|
247 14F-3 0.11692 -0.30216 -0.14809 -0.08550 0.00000
|
|
248 15G 0 0.11714 -0.05882 0.15318 0.08844 0.00000
|
|
249 15G+1 0.10439 0.14707 -0.16866 -0.09462 0.00495
|
|
250 15G-1 0.16830 0.08491 -0.09462 -0.05940 -0.00857
|
|
251 15G+2 -0.08727 0.06786 0.06455 -0.30460 0.41457
|
|
252 15G-2 -0.03204 0.11753 -0.23006 0.06455 -0.23935
|
|
253 15G+3 0.04476 0.00000 0.05181 -0.08974 0.27834
|
|
254 15G-3 0.04764 0.01327 -0.05457 -0.03151 0.00000
|
|
255 15G+4 0.02121 0.11490 -0.05639 0.38285 -0.20475
|
|
256 15G-4 0.31494 -0.19901 -0.31774 0.05639 -0.11821
|
|
236 237 238 239 240
|
|
(E)--V (E)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 17.74559 17.74559 17.99884 18.01837 18.01837
|
|
1 1 N 1S 0.00000 0.00000 0.02034 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.04535 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 0.25505 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 0.80533 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 -4.44570 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.82964 0.00000 0.00000
|
|
7 7PX 0.00000 -0.37147 0.00000 0.13534 0.00000
|
|
8 7PY -0.37147 0.00000 0.00000 0.00000 0.13534
|
|
9 7PZ 0.00000 0.00000 -0.33934 0.00000 0.00000
|
|
10 8PX 0.00000 1.28235 0.00000 -0.54045 0.00000
|
|
11 8PY 1.28235 0.00000 0.00000 0.00000 -0.54045
|
|
12 8PZ 0.00000 0.00000 1.40413 0.00000 0.00000
|
|
13 9PX 0.00000 -2.71569 0.00000 0.97083 0.00000
|
|
14 9PY -2.71569 0.00000 0.00000 0.00000 0.97083
|
|
15 9PZ 0.00000 0.00000 -3.18451 0.00000 0.00000
|
|
16 10PX 0.00000 -2.29183 0.00000 0.04591 0.00000
|
|
17 10PY -2.29183 0.00000 0.00000 0.00000 0.04591
|
|
18 10PZ 0.00000 0.00000 -0.69969 0.00000 0.00000
|
|
19 11PX 0.00000 -0.28425 0.00000 -0.08186 0.00000
|
|
20 11PY -0.28425 0.00000 0.00000 0.00000 -0.08186
|
|
21 11PZ 0.00000 0.00000 -0.25249 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 1.15456 0.00000 0.00000
|
|
23 12D+1 0.00000 0.35211 0.00000 -0.73644 0.00000
|
|
24 12D-1 0.35211 0.00000 0.00000 0.00000 -0.73644
|
|
25 12D+2 0.09869 0.00000 0.00000 0.00000 0.70405
|
|
26 12D-2 0.00000 0.09869 0.00000 0.70405 0.00000
|
|
27 13D 0 0.00000 0.00000 -1.67431 0.00000 0.00000
|
|
28 13D+1 0.00000 -0.44770 0.00000 1.20180 0.00000
|
|
29 13D-1 -0.44770 0.00000 0.00000 0.00000 1.20180
|
|
30 13D+2 -0.08999 0.00000 0.00000 0.00000 -1.28113
|
|
31 13D-2 0.00000 -0.08999 0.00000 -1.28113 0.00000
|
|
32 14D 0 0.00000 0.00000 4.46732 0.00000 0.00000
|
|
33 14D+1 0.00000 2.40526 0.00000 -3.06796 0.00000
|
|
34 14D-1 2.40526 0.00000 0.00000 0.00000 -3.06796
|
|
35 14D+2 1.46577 0.00000 0.00000 0.00000 4.07680
|
|
36 14D-2 0.00000 1.46577 0.00000 4.07680 0.00000
|
|
37 15D 0 0.00000 0.00000 0.70159 0.00000 0.00000
|
|
38 15D+1 0.00000 1.08189 0.00000 -0.38106 0.00000
|
|
39 15D-1 1.08189 0.00000 0.00000 0.00000 -0.38106
|
|
40 15D+2 0.78949 0.00000 0.00000 0.00000 0.57134
|
|
41 15D-2 0.00000 0.78949 0.00000 0.57134 0.00000
|
|
42 16F 0 0.00000 0.00000 -0.28864 0.00000 0.00000
|
|
43 16F+1 0.00000 -0.43119 0.00000 -0.61234 0.00000
|
|
44 16F-1 -0.43119 0.00000 0.00000 0.00000 -0.61234
|
|
45 16F+2 -0.20730 0.00000 0.00000 0.00000 0.08830
|
|
46 16F-2 0.00000 -0.20730 0.00000 0.08830 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 -0.37780 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.37523 0.00000 0.00000
|
|
50 17F+1 0.00000 0.07158 0.00000 1.35564 0.00000
|
|
51 17F-1 0.07158 0.00000 0.00000 0.00000 1.35564
|
|
52 17F+2 -0.50113 0.00000 0.00000 0.00000 -0.21976
|
|
53 17F-2 0.00000 -0.50113 0.00000 -0.21976 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 1.26885 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 -0.19055 0.00000 0.00000
|
|
57 18F+1 0.00000 -0.43184 0.00000 0.88093 0.00000
|
|
58 18F-1 -0.43184 0.00000 0.00000 0.00000 0.88093
|
|
59 18F+2 -0.69943 0.00000 0.00000 0.00000 -0.17304
|
|
60 18F-2 0.00000 -0.69943 0.00000 -0.17304 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 1.18968 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 -0.12216 0.00000 0.00000
|
|
64 19G+1 0.00000 0.10658 0.00000 -0.05339 0.00000
|
|
65 19G-1 0.10658 0.00000 0.00000 0.00000 -0.05339
|
|
66 19G+2 0.39968 0.00000 0.00000 0.00000 -0.14916
|
|
67 19G-2 0.00000 0.39968 0.00000 -0.14916 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.07839 0.00000 0.00000
|
|
70 19G+4 0.33100 0.00000 0.00000 0.00000 0.17771
|
|
71 19G-4 0.00000 -0.33100 0.00000 -0.17771 0.00000
|
|
72 20G 0 0.00000 0.00000 -1.09494 0.00000 0.00000
|
|
73 20G+1 0.00000 -0.20708 0.00000 -0.13037 0.00000
|
|
74 20G-1 -0.20708 0.00000 0.00000 0.00000 -0.13037
|
|
75 20G+2 -0.04162 0.00000 0.00000 0.00000 -0.97911
|
|
76 20G-2 0.00000 -0.04162 0.00000 -0.97911 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.18574 0.00000 0.00000
|
|
79 20G+4 -0.64928 0.00000 0.00000 0.00000 0.79874
|
|
80 20G-4 0.00000 0.64928 0.00000 -0.79874 0.00000
|
|
81 21H 0 0.00000 0.00000 0.25933 0.00000 0.00000
|
|
82 21H+1 0.00000 -0.14963 0.00000 -0.27874 0.00000
|
|
83 21H-1 -0.14963 0.00000 0.00000 0.00000 -0.27874
|
|
84 21H+2 -0.05446 0.00000 0.00000 0.00000 0.54432
|
|
85 21H-2 0.00000 -0.05446 0.00000 0.54432 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 -0.65235 0.00000 0.00000
|
|
88 21H+4 0.11203 0.00000 0.00000 0.00000 -0.61341
|
|
89 21H-4 0.00000 -0.11203 0.00000 0.61341 0.00000
|
|
90 21H+5 0.00000 -0.24566 0.00000 0.43060 0.00000
|
|
91 21H-5 0.24566 0.00000 0.00000 0.00000 -0.43060
|
|
92 2 H 1S -0.16704 0.00000 -0.17693 0.00000 -0.05835
|
|
93 2S 0.46233 0.00000 0.37555 0.00000 -0.05591
|
|
94 3S 4.48085 0.00000 1.96496 0.00000 0.69453
|
|
95 4S 1.32214 0.00000 -0.65680 0.00000 0.13230
|
|
96 5S 0.08360 0.00000 0.05157 0.00000 0.06307
|
|
97 6PX 0.00000 -0.58144 0.00000 0.54226 0.00000
|
|
98 6PY 0.13193 0.00000 0.09076 0.00000 -0.07558
|
|
99 6PZ -0.90299 0.00000 -0.59535 0.00000 -0.55929
|
|
100 7PX 0.00000 0.99856 0.00000 -0.86525 0.00000
|
|
101 7PY -0.19667 0.00000 -0.11301 0.00000 0.20350
|
|
102 7PZ 1.48580 0.00000 0.84873 0.00000 0.77609
|
|
103 8PX 0.00000 -0.68182 0.00000 -1.67628 0.00000
|
|
104 8PY -2.53639 0.00000 -0.06017 0.00000 0.43462
|
|
105 8PZ -0.87755 0.00000 1.81349 0.00000 1.79055
|
|
106 9PX 0.00000 -0.07630 0.00000 -0.26304 0.00000
|
|
107 9PY -0.82145 0.00000 0.28084 0.00000 0.03110
|
|
108 9PZ -0.01648 0.00000 0.30625 0.00000 0.38863
|
|
109 10D 0 0.24197 0.00000 -0.03363 0.00000 0.05095
|
|
110 10D+1 0.00000 0.05165 0.00000 -0.01143 0.00000
|
|
111 10D-1 -0.06546 0.00000 0.12202 0.00000 0.09473
|
|
112 10D+2 0.28815 0.00000 0.09787 0.00000 0.00602
|
|
113 10D-2 0.00000 -0.23841 0.00000 0.06447 0.00000
|
|
114 11D 0 -0.44523 0.00000 0.68735 0.00000 0.54384
|
|
115 11D+1 0.00000 0.10193 0.00000 -0.63493 0.00000
|
|
116 11D-1 -0.07923 0.00000 -1.02111 0.00000 -1.03984
|
|
117 11D+2 -0.72946 0.00000 0.12036 0.00000 0.51143
|
|
118 11D-2 0.00000 0.10610 0.00000 1.03519 0.00000
|
|
119 12D 0 -0.63641 0.00000 0.47390 0.00000 0.43301
|
|
120 12D+1 0.00000 -0.18179 0.00000 -0.23933 0.00000
|
|
121 12D-1 0.56009 0.00000 -0.42643 0.00000 -0.54814
|
|
122 12D+2 -0.43623 0.00000 0.33420 0.00000 0.25851
|
|
123 12D-2 0.00000 0.38477 0.00000 0.61164 0.00000
|
|
124 13F 0 -0.03422 0.00000 -0.05632 0.00000 -0.14306
|
|
125 13F+1 0.00000 0.06211 0.00000 -0.02085 0.00000
|
|
126 13F-1 0.01769 0.00000 -0.27677 0.00000 -0.22693
|
|
127 13F+2 0.05462 0.00000 -0.13699 0.00000 -0.16481
|
|
128 13F-2 0.00000 -0.08574 0.00000 0.33694 0.00000
|
|
129 13F+3 0.00000 -0.01655 0.00000 0.25161 0.00000
|
|
130 13F-3 0.07179 0.00000 -0.03562 0.00000 -0.25631
|
|
131 14F 0 0.14919 0.00000 -0.03994 0.00000 -0.16128
|
|
132 14F+1 0.00000 0.10862 0.00000 -0.06991 0.00000
|
|
133 14F-1 0.52796 0.00000 -0.34506 0.00000 -0.28608
|
|
134 14F+2 0.17020 0.00000 -0.14983 0.00000 -0.14133
|
|
135 14F-2 0.00000 0.13494 0.00000 0.22851 0.00000
|
|
136 14F+3 0.00000 0.29884 0.00000 0.24553 0.00000
|
|
137 14F-3 0.14708 0.00000 -0.12821 0.00000 -0.19474
|
|
138 15G 0 0.22884 0.00000 -0.01332 0.00000 -0.00394
|
|
139 15G+1 0.00000 0.11491 0.00000 0.01921 0.00000
|
|
140 15G-1 0.01455 0.00000 -0.01364 0.00000 0.18021
|
|
141 15G+2 0.33752 0.00000 -0.02636 0.00000 0.06306
|
|
142 15G-2 0.00000 -0.15784 0.00000 0.12025 0.00000
|
|
143 15G+3 0.00000 0.12065 0.00000 0.05844 0.00000
|
|
144 15G-3 -0.13333 0.00000 0.02147 0.00000 -0.02779
|
|
145 15G+4 0.07213 0.00000 0.08455 0.00000 -0.18929
|
|
146 15G-4 0.00000 -0.27556 0.00000 0.10591 0.00000
|
|
147 3 H 1S 0.08352 -0.14466 -0.17693 -0.05053 0.02918
|
|
148 2S -0.23117 0.40039 0.37555 -0.04842 0.02796
|
|
149 3S -2.24043 3.88053 1.96496 0.60148 -0.34726
|
|
150 4S -0.66107 1.14501 -0.65680 0.11457 -0.06615
|
|
151 5S -0.04180 0.07240 0.05157 0.05462 -0.03154
|
|
152 6PX -0.30890 -0.04641 0.07860 0.07888 0.26754
|
|
153 6PY -0.40310 -0.30890 -0.04538 0.26754 0.38780
|
|
154 6PZ 0.45150 -0.78201 -0.59535 -0.48436 0.27964
|
|
155 7PX 0.51755 0.10214 -0.09787 -0.06369 -0.46278
|
|
156 7PY 0.69976 0.51755 0.05650 -0.46278 -0.59806
|
|
157 7PZ -0.74290 1.28674 0.84873 0.67212 -0.38805
|
|
158 8PX 0.80306 -2.07275 -0.05211 -0.09310 -0.91405
|
|
159 8PY -1.14546 0.80306 0.03008 -0.91405 -1.14856
|
|
160 8PZ 0.43877 -0.75998 1.81349 1.55067 -0.89528
|
|
161 9PX 0.32266 -0.63516 0.24321 -0.04243 -0.12737
|
|
162 9PY -0.26259 0.32266 -0.14042 -0.12737 -0.18950
|
|
163 9PZ 0.00824 -0.01427 0.30625 0.33657 -0.19432
|
|
164 10D 0 -0.12098 0.20955 -0.03363 0.04412 -0.02547
|
|
165 10D+1 0.05071 -0.03618 0.10567 0.06819 -0.04597
|
|
166 10D-1 0.02237 0.05071 -0.06101 -0.04597 0.01511
|
|
167 10D+2 -0.10677 -0.22801 -0.04894 0.02531 0.04986
|
|
168 10D-2 -0.22801 0.15651 0.08476 0.02063 0.02531
|
|
169 11D 0 0.22262 -0.38558 0.68735 0.47098 -0.27192
|
|
170 11D+1 0.07844 -0.03394 -0.88431 -0.93861 0.17533
|
|
171 11D-1 0.05664 0.07844 0.51056 0.17533 -0.73616
|
|
172 11D+2 -0.10279 0.36181 -0.06018 0.22679 0.90425
|
|
173 11D-2 0.36181 -0.52057 0.10423 0.64237 0.22679
|
|
174 12D 0 0.31821 -0.55115 0.47390 0.37500 -0.21650
|
|
175 12D+1 -0.32124 0.37462 -0.36930 -0.47094 0.13372
|
|
176 12D-1 0.00368 -0.32124 0.21322 0.13372 -0.31653
|
|
177 12D+2 0.17952 0.35550 -0.16710 0.15291 0.52336
|
|
178 12D-2 0.35550 -0.23098 0.28943 0.34680 0.15291
|
|
179 13F 0 0.01711 -0.02964 -0.05632 -0.12390 0.07153
|
|
180 13F+1 0.01924 0.02880 -0.23969 -0.17541 0.08923
|
|
181 13F-1 0.05101 0.01924 0.13838 0.08923 -0.07237
|
|
182 13F+2 -0.05065 -0.06078 0.06849 0.21726 0.21150
|
|
183 13F-2 -0.06078 0.01953 -0.11864 -0.03937 0.21726
|
|
184 13F+3 0.01433 0.00827 0.00000 -0.12580 -0.21790
|
|
185 13F-3 -0.03589 0.06217 -0.03562 -0.22197 0.12815
|
|
186 14F 0 -0.07459 0.12920 -0.03994 -0.13967 0.08064
|
|
187 14F+1 -0.18158 0.42313 -0.29883 -0.23204 0.09360
|
|
188 14F-1 0.21346 -0.18158 0.17253 0.09360 -0.12395
|
|
189 14F+2 0.14375 -0.01527 0.07491 0.16014 0.13605
|
|
190 14F-2 -0.01527 0.16138 -0.12975 -0.04887 0.16014
|
|
191 14F+3 -0.25880 -0.14942 0.00000 -0.12277 -0.21264
|
|
192 14F-3 -0.07354 0.12738 -0.12821 -0.16865 0.09737
|
|
193 15G 0 -0.11442 0.19818 -0.01332 -0.00341 0.00197
|
|
194 15G+1 0.04345 0.03964 -0.01181 0.13996 -0.06972
|
|
195 15G-1 0.08982 0.04345 0.00682 -0.06972 0.05946
|
|
196 15G+2 -0.03400 -0.21450 0.01318 0.02476 0.10595
|
|
197 15G-2 -0.21450 0.21368 -0.02283 0.07736 0.02476
|
|
198 15G+3 -0.10449 -0.06033 0.00000 -0.02922 -0.05061
|
|
199 15G-3 0.06667 -0.11547 0.02147 -0.02407 0.01390
|
|
200 15G+4 0.22470 0.08809 -0.04227 0.03611 -0.12675
|
|
201 15G-4 -0.08809 -0.12299 -0.07322 0.16845 -0.03611
|
|
202 4 H 1S 0.08352 0.14466 -0.17693 0.05053 0.02918
|
|
203 2S -0.23117 -0.40039 0.37555 0.04842 0.02796
|
|
204 3S -2.24043 -3.88053 1.96496 -0.60148 -0.34726
|
|
205 4S -0.66107 -1.14501 -0.65680 -0.11457 -0.06615
|
|
206 5S -0.04180 -0.07240 0.05157 -0.05462 -0.03154
|
|
207 6PX 0.30890 -0.04641 -0.07860 0.07888 -0.26754
|
|
208 6PY -0.40310 0.30890 -0.04538 -0.26754 0.38780
|
|
209 6PZ 0.45150 0.78201 -0.59535 0.48436 0.27964
|
|
210 7PX -0.51755 0.10214 0.09787 -0.06369 0.46278
|
|
211 7PY 0.69976 -0.51755 0.05650 0.46278 -0.59806
|
|
212 7PZ -0.74290 -1.28674 0.84873 -0.67212 -0.38805
|
|
213 8PX -0.80306 -2.07275 0.05211 -0.09310 0.91405
|
|
214 8PY -1.14546 -0.80306 0.03008 0.91405 -1.14856
|
|
215 8PZ 0.43877 0.75998 1.81349 -1.55067 -0.89528
|
|
216 9PX -0.32266 -0.63516 -0.24321 -0.04243 0.12737
|
|
217 9PY -0.26259 -0.32266 -0.14042 0.12737 -0.18950
|
|
218 9PZ 0.00824 0.01427 0.30625 -0.33657 -0.19432
|
|
219 10D 0 -0.12098 -0.20955 -0.03363 -0.04412 -0.02547
|
|
220 10D+1 -0.05071 -0.03618 -0.10567 0.06819 0.04597
|
|
221 10D-1 0.02237 -0.05071 -0.06101 0.04597 0.01511
|
|
222 10D+2 -0.10677 0.22801 -0.04894 -0.02531 0.04986
|
|
223 10D-2 0.22801 0.15651 -0.08476 0.02063 -0.02531
|
|
224 11D 0 0.22262 0.38558 0.68735 -0.47098 -0.27192
|
|
225 11D+1 -0.07844 -0.03394 0.88431 -0.93861 -0.17533
|
|
226 11D-1 0.05664 -0.07844 0.51056 -0.17533 -0.73616
|
|
227 11D+2 -0.10279 -0.36181 -0.06018 -0.22679 0.90425
|
|
228 11D-2 -0.36181 -0.52057 -0.10423 0.64237 -0.22679
|
|
229 12D 0 0.31821 0.55115 0.47390 -0.37500 -0.21650
|
|
230 12D+1 0.32124 0.37462 0.36930 -0.47094 -0.13372
|
|
231 12D-1 0.00368 0.32124 0.21322 -0.13372 -0.31653
|
|
232 12D+2 0.17952 -0.35550 -0.16710 -0.15291 0.52336
|
|
233 12D-2 -0.35550 -0.23098 -0.28943 0.34680 -0.15291
|
|
234 13F 0 0.01711 0.02964 -0.05632 0.12390 0.07153
|
|
235 13F+1 -0.01924 0.02880 0.23969 -0.17541 -0.08923
|
|
236 13F-1 0.05101 -0.01924 0.13838 -0.08923 -0.07237
|
|
237 13F+2 -0.05065 0.06078 0.06849 -0.21726 0.21150
|
|
238 13F-2 0.06078 0.01953 0.11864 -0.03937 -0.21726
|
|
239 13F+3 -0.01433 0.00827 0.00000 -0.12580 0.21790
|
|
240 13F-3 -0.03589 -0.06217 -0.03562 0.22197 0.12815
|
|
241 14F 0 -0.07459 -0.12920 -0.03994 0.13967 0.08064
|
|
242 14F+1 0.18158 0.42313 0.29883 -0.23204 -0.09360
|
|
243 14F-1 0.21346 0.18158 0.17253 -0.09360 -0.12395
|
|
244 14F+2 0.14375 0.01527 0.07491 -0.16014 0.13605
|
|
245 14F-2 0.01527 0.16138 0.12975 -0.04887 -0.16014
|
|
246 14F+3 0.25880 -0.14942 0.00000 -0.12277 0.21264
|
|
247 14F-3 -0.07354 -0.12738 -0.12821 0.16865 0.09737
|
|
248 15G 0 -0.11442 -0.19818 -0.01332 0.00341 0.00197
|
|
249 15G+1 -0.04345 0.03964 0.01181 0.13996 0.06972
|
|
250 15G-1 0.08982 -0.04345 0.00682 0.06972 0.05946
|
|
251 15G+2 -0.03400 0.21450 0.01318 -0.02476 0.10595
|
|
252 15G-2 0.21450 0.21368 0.02283 0.07736 -0.02476
|
|
253 15G+3 0.10449 -0.06033 0.00000 -0.02922 0.05061
|
|
254 15G-3 0.06667 0.11547 0.02147 0.02407 0.01390
|
|
255 15G+4 0.22470 -0.08809 -0.04227 -0.03611 -0.12675
|
|
256 15G-4 0.08809 -0.12299 0.07322 0.16845 0.03611
|
|
241 242 243 244 245
|
|
(A2)--V (E)--V (E)--V (E)--V (E)--V
|
|
Eigenvalues -- 18.40468 18.63961 18.63961 20.68229 20.68229
|
|
1 1 N 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
7 7PX 0.00000 0.00000 -0.27927 -0.05699 0.00000
|
|
8 7PY 0.00000 -0.27927 0.00000 0.00000 -0.05699
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 0.61000 -0.80361 0.00000
|
|
11 8PY 0.00000 0.61000 0.00000 0.00000 -0.80361
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 -0.01555 4.58434 0.00000
|
|
14 9PY 0.00000 -0.01555 0.00000 0.00000 4.58434
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 3.87133 0.80828 0.00000
|
|
17 10PY 0.00000 3.87133 0.00000 0.00000 0.80828
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 0.27795 0.00607 0.00000
|
|
20 11PY 0.00000 0.27795 0.00000 0.00000 0.00607
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 -0.65554 -0.37870 0.00000
|
|
24 12D-1 0.00000 -0.65554 0.00000 0.00000 -0.37870
|
|
25 12D+2 0.00000 -0.56223 0.00000 0.00000 -0.06135
|
|
26 12D-2 0.00000 0.00000 -0.56223 -0.06135 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.72822 0.29598 0.00000
|
|
29 13D-1 0.00000 0.72822 0.00000 0.00000 0.29598
|
|
30 13D+2 0.00000 0.63567 0.00000 0.00000 -0.09333
|
|
31 13D-2 0.00000 0.00000 0.63567 -0.09333 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 -0.98048 1.73051 0.00000
|
|
34 14D-1 0.00000 -0.98048 0.00000 0.00000 1.73051
|
|
35 14D+2 0.00000 -1.42162 0.00000 0.00000 1.06676
|
|
36 14D-2 0.00000 0.00000 -1.42162 1.06676 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 -1.33294 0.38497 0.00000
|
|
39 15D-1 0.00000 -1.33294 0.00000 0.00000 0.38497
|
|
40 15D+2 0.00000 -1.34398 0.00000 0.00000 0.29334
|
|
41 15D-2 0.00000 0.00000 -1.34398 0.29334 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 -0.26713 0.47887 0.00000
|
|
44 16F-1 0.00000 -0.26713 0.00000 0.00000 0.47887
|
|
45 16F+2 0.00000 -0.16584 0.00000 0.00000 0.51709
|
|
46 16F-2 0.00000 0.00000 -0.16584 0.51709 0.00000
|
|
47 16F+3 -0.63872 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.17223 -2.55461 0.00000
|
|
51 17F-1 0.00000 0.17223 0.00000 0.00000 -2.55461
|
|
52 17F+2 0.00000 0.45105 0.00000 0.00000 -2.22103
|
|
53 17F-2 0.00000 0.00000 0.45105 -2.22103 0.00000
|
|
54 17F+3 -0.26411 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.35988 -1.02849 0.00000
|
|
58 18F-1 0.00000 0.35988 0.00000 0.00000 -1.02849
|
|
59 18F+2 0.00000 1.07537 0.00000 0.00000 -0.97681
|
|
60 18F-2 0.00000 0.00000 1.07537 -0.97681 0.00000
|
|
61 18F+3 0.33895 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.03430 0.24463 0.00000
|
|
65 19G-1 0.00000 0.03430 0.00000 0.00000 0.24463
|
|
66 19G+2 0.00000 0.13168 0.00000 0.00000 0.67225
|
|
67 19G-2 0.00000 0.00000 0.13168 0.67225 0.00000
|
|
68 19G+3 0.65376 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.13787 0.00000 0.00000 0.64941
|
|
71 19G-4 0.00000 0.00000 -0.13787 -0.64941 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 -0.10554 0.32090 0.00000
|
|
74 20G-1 0.00000 -0.10554 0.00000 0.00000 0.32090
|
|
75 20G+2 0.00000 -0.63028 0.00000 0.00000 1.06749
|
|
76 20G-2 0.00000 0.00000 -0.63028 1.06749 0.00000
|
|
77 20G+3 -0.99174 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 -0.46108 0.00000 0.00000 1.17248
|
|
80 20G-4 0.00000 0.00000 0.46108 -1.17248 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 -0.00975 0.44394 0.00000
|
|
83 21H-1 0.00000 -0.00975 0.00000 0.00000 0.44394
|
|
84 21H+2 0.00000 0.17202 0.00000 0.00000 -0.16826
|
|
85 21H-2 0.00000 0.00000 0.17202 -0.16826 0.00000
|
|
86 21H+3 0.49724 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.34956 0.00000 0.00000 -0.43276
|
|
89 21H-4 0.00000 0.00000 -0.34956 0.43276 0.00000
|
|
90 21H+5 0.00000 0.00000 0.19673 0.02897 0.00000
|
|
91 21H-5 0.00000 -0.19673 0.00000 0.00000 -0.02897
|
|
92 2 H 1S 0.00000 0.27940 0.00000 0.00000 -0.01736
|
|
93 2S 0.00000 -0.29653 0.00000 0.00000 -0.12790
|
|
94 3S 0.00000 -3.72914 0.00000 0.00000 0.29017
|
|
95 4S 0.00000 -1.22296 0.00000 0.00000 -0.11889
|
|
96 5S 0.00000 -0.06201 0.00000 0.00000 0.04243
|
|
97 6PX -0.69083 0.00000 -0.39500 0.43819 0.00000
|
|
98 6PY 0.00000 -1.06259 0.00000 0.00000 0.29294
|
|
99 6PZ 0.00000 0.06405 0.00000 0.00000 0.62541
|
|
100 7PX 1.32002 0.00000 0.65861 -0.64997 0.00000
|
|
101 7PY 0.00000 1.35777 0.00000 0.00000 -0.33254
|
|
102 7PZ 0.00000 0.17301 0.00000 0.00000 -0.93145
|
|
103 8PX -0.97010 0.00000 0.25905 -1.95951 0.00000
|
|
104 8PY 0.00000 0.53005 0.00000 0.00000 -1.11627
|
|
105 8PZ 0.00000 0.03683 0.00000 0.00000 -2.67676
|
|
106 9PX -0.32153 0.00000 -0.13312 -0.30242 0.00000
|
|
107 9PY 0.00000 0.42622 0.00000 0.00000 -0.12261
|
|
108 9PZ 0.00000 -0.23394 0.00000 0.00000 -0.43116
|
|
109 10D 0 0.00000 0.01298 0.00000 0.00000 0.21904
|
|
110 10D+1 0.12592 0.00000 0.08774 0.07164 0.00000
|
|
111 10D-1 0.00000 -0.29817 0.00000 0.00000 -0.18898
|
|
112 10D+2 0.00000 -0.17336 0.00000 0.00000 0.14564
|
|
113 10D-2 -0.32617 0.00000 0.01905 -0.18387 0.00000
|
|
114 11D 0 0.00000 0.32844 0.00000 0.00000 -1.61189
|
|
115 11D+1 -0.30060 0.00000 -0.11729 -0.59631 0.00000
|
|
116 11D-1 0.00000 0.21028 0.00000 0.00000 1.72053
|
|
117 11D+2 0.00000 0.43904 0.00000 0.00000 -0.83066
|
|
118 11D-2 0.12804 0.00000 -0.47251 1.52164 0.00000
|
|
119 12D 0 0.00000 -0.23507 0.00000 0.00000 -0.66377
|
|
120 12D+1 -0.09066 0.00000 0.13289 -0.31841 0.00000
|
|
121 12D-1 0.00000 -0.17257 0.00000 0.00000 0.78697
|
|
122 12D+2 0.00000 -0.23998 0.00000 0.00000 -0.34462
|
|
123 12D-2 0.83256 0.00000 0.17127 0.66912 0.00000
|
|
124 13F 0 0.00000 0.02034 0.00000 0.00000 0.11586
|
|
125 13F+1 -0.15577 0.00000 -0.07918 0.03290 0.00000
|
|
126 13F-1 0.00000 -0.12273 0.00000 0.00000 0.73704
|
|
127 13F+2 0.00000 -0.00668 0.00000 0.00000 0.39680
|
|
128 13F-2 0.17777 0.00000 0.07952 0.26894 0.00000
|
|
129 13F+3 -0.12598 0.00000 -0.17484 0.45700 0.00000
|
|
130 13F-3 0.00000 0.02142 0.00000 0.00000 0.18423
|
|
131 14F 0 0.00000 0.07487 0.00000 0.00000 0.09695
|
|
132 14F+1 0.06244 0.00000 -0.03556 0.04434 0.00000
|
|
133 14F-1 0.00000 0.20764 0.00000 0.00000 0.86510
|
|
134 14F+2 0.00000 -0.03702 0.00000 0.00000 0.42900
|
|
135 14F-2 0.26107 0.00000 0.03209 0.36147 0.00000
|
|
136 14F+3 0.55435 0.00000 0.05663 0.54026 0.00000
|
|
137 14F-3 0.00000 -0.00082 0.00000 0.00000 0.27313
|
|
138 15G 0 0.00000 0.16298 0.00000 0.00000 0.38192
|
|
139 15G+1 0.02590 0.00000 0.02671 0.04990 0.00000
|
|
140 15G-1 0.00000 -0.06450 0.00000 0.00000 0.07373
|
|
141 15G+2 0.00000 0.14285 0.00000 0.00000 0.51446
|
|
142 15G-2 0.10341 0.00000 0.12673 -0.00137 0.00000
|
|
143 15G+3 0.36368 0.00000 0.15596 0.22937 0.00000
|
|
144 15G-3 0.00000 0.00943 0.00000 0.00000 -0.24722
|
|
145 15G+4 0.00000 -0.00460 0.00000 0.00000 0.09943
|
|
146 15G-4 -0.28532 0.00000 -0.00641 -0.32444 0.00000
|
|
147 3 H 1S 0.00000 -0.13970 0.24197 -0.01503 0.00868
|
|
148 2S 0.00000 0.14827 -0.25681 -0.11077 0.06395
|
|
149 3S 0.00000 1.86457 -3.22953 0.25129 -0.14508
|
|
150 4S 0.00000 0.61148 -1.05911 -0.10296 0.05944
|
|
151 5S 0.00000 0.03101 -0.05370 0.03675 -0.02122
|
|
152 6PX 0.34542 0.28908 -0.89569 0.32925 0.06290
|
|
153 6PY 0.59828 -0.56190 0.28908 0.06290 0.40188
|
|
154 6PZ 0.00000 -0.03203 0.05547 0.54162 -0.31271
|
|
155 7PX -0.66001 -0.30275 1.18298 -0.41190 -0.13745
|
|
156 7PY -1.14317 0.83340 -0.30275 -0.13745 -0.57061
|
|
157 7PZ 0.00000 -0.08650 0.14983 -0.80666 0.46572
|
|
158 8PX 0.48505 -0.11735 0.46230 -1.32708 -0.36513
|
|
159 8PY 0.84013 0.32680 -0.11735 -0.36513 -1.74870
|
|
160 8PZ 0.00000 -0.01842 0.03190 -2.31814 1.33838
|
|
161 9PX 0.16076 -0.24220 0.28638 -0.16757 -0.07786
|
|
162 9PY 0.27845 0.00671 -0.24220 -0.07786 -0.25747
|
|
163 9PZ 0.00000 0.11697 -0.20260 -0.37340 0.21558
|
|
164 10D 0 0.00000 -0.00649 0.01124 0.18969 -0.10952
|
|
165 10D+1 -0.06296 0.16710 -0.20169 -0.12383 0.11285
|
|
166 10D-1 -0.10905 -0.00873 0.16710 0.11285 0.00648
|
|
167 10D+2 0.28247 -0.02905 0.08332 -0.14268 -0.10149
|
|
168 10D-2 0.16308 0.08332 -0.12526 0.06326 -0.14268
|
|
169 11D 0 0.00000 -0.16422 0.28443 -1.39594 0.80594
|
|
170 11D+1 0.15030 -0.14184 0.12839 1.14132 -1.00322
|
|
171 11D-1 0.26033 -0.03540 -0.14184 -1.00322 -0.01710
|
|
172 11D+2 -0.11088 -0.24462 -0.39471 1.01857 0.93356
|
|
173 11D-2 -0.06402 -0.39471 0.21115 -0.24258 1.01857
|
|
174 12D 0 0.00000 0.11753 -0.20358 -0.57484 0.33188
|
|
175 12D+1 0.04533 0.13227 -0.09620 0.51062 -0.47865
|
|
176 12D-1 0.07851 0.05653 0.13227 -0.47865 -0.04207
|
|
177 12D+2 -0.72101 0.06846 0.17808 0.43896 0.41568
|
|
178 12D-2 -0.41628 0.17808 -0.13717 -0.09119 0.43896
|
|
179 13F 0 0.00000 -0.01017 0.01762 0.10034 -0.05793
|
|
180 13F+1 0.07789 0.01886 -0.11184 0.56101 -0.30490
|
|
181 13F-1 0.13490 -0.09006 0.01886 -0.30490 0.20894
|
|
182 13F+2 -0.15395 0.05797 0.03733 -0.05536 0.30091
|
|
183 13F-2 -0.08888 0.03733 0.01487 0.36483 -0.05536
|
|
184 13F+3 -0.12598 0.15142 0.08742 -0.22850 -0.39577
|
|
185 13F-3 0.00000 -0.01071 0.01855 0.15954 -0.09211
|
|
186 14F 0 0.00000 -0.03744 0.06484 0.08396 -0.04848
|
|
187 14F+1 -0.03122 -0.10531 0.14684 0.65991 -0.35540
|
|
188 14F-1 -0.05408 0.02524 -0.10531 -0.35540 0.24953
|
|
189 14F+2 -0.22609 0.01481 0.02993 -0.02924 0.37835
|
|
190 14F-2 -0.13054 0.02993 -0.01974 0.41212 -0.02924
|
|
191 14F+3 0.55435 -0.04904 -0.02831 -0.27013 -0.46788
|
|
192 14F-3 0.00000 0.00041 -0.00071 0.23654 -0.13656
|
|
193 15G 0 0.00000 -0.08149 0.14115 0.33075 -0.19096
|
|
194 15G+1 -0.01295 0.03949 -0.04170 0.06777 -0.01032
|
|
195 15G-1 -0.02243 0.00391 0.03949 -0.01032 0.05586
|
|
196 15G+2 -0.08955 0.13076 -0.00698 -0.22336 0.12759
|
|
197 15G-2 -0.05170 -0.00698 0.13882 0.38550 -0.22336
|
|
198 15G+3 0.36368 -0.13507 -0.07798 -0.11468 -0.19864
|
|
199 15G-3 0.00000 -0.00471 0.00816 -0.21410 0.12361
|
|
200 15G+4 -0.24710 0.00366 0.00477 0.09743 0.26819
|
|
201 15G-4 0.14266 -0.00477 0.00184 -0.15568 -0.09743
|
|
202 4 H 1S 0.00000 -0.13970 -0.24197 0.01503 0.00868
|
|
203 2S 0.00000 0.14827 0.25681 0.11077 0.06395
|
|
204 3S 0.00000 1.86457 3.22953 -0.25129 -0.14508
|
|
205 4S 0.00000 0.61148 1.05911 0.10296 0.05944
|
|
206 5S 0.00000 0.03101 0.05370 -0.03675 -0.02122
|
|
207 6PX 0.34542 -0.28908 -0.89569 0.32925 -0.06290
|
|
208 6PY -0.59828 -0.56190 -0.28908 -0.06290 0.40188
|
|
209 6PZ 0.00000 -0.03203 -0.05547 -0.54162 -0.31271
|
|
210 7PX -0.66001 0.30275 1.18298 -0.41190 0.13745
|
|
211 7PY 1.14317 0.83340 0.30275 0.13745 -0.57061
|
|
212 7PZ 0.00000 -0.08650 -0.14983 0.80666 0.46572
|
|
213 8PX 0.48505 0.11735 0.46230 -1.32708 0.36513
|
|
214 8PY -0.84013 0.32680 0.11735 0.36513 -1.74870
|
|
215 8PZ 0.00000 -0.01842 -0.03190 2.31814 1.33838
|
|
216 9PX 0.16076 0.24220 0.28638 -0.16757 0.07786
|
|
217 9PY -0.27845 0.00671 0.24220 0.07786 -0.25747
|
|
218 9PZ 0.00000 0.11697 0.20260 0.37340 0.21558
|
|
219 10D 0 0.00000 -0.00649 -0.01124 -0.18969 -0.10952
|
|
220 10D+1 -0.06296 -0.16710 -0.20169 -0.12383 -0.11285
|
|
221 10D-1 0.10905 -0.00873 -0.16710 -0.11285 0.00648
|
|
222 10D+2 -0.28247 -0.02905 -0.08332 0.14268 -0.10149
|
|
223 10D-2 0.16308 -0.08332 -0.12526 0.06326 0.14268
|
|
224 11D 0 0.00000 -0.16422 -0.28443 1.39594 0.80594
|
|
225 11D+1 0.15030 0.14184 0.12839 1.14132 1.00322
|
|
226 11D-1 -0.26033 -0.03540 0.14184 1.00322 -0.01710
|
|
227 11D+2 0.11088 -0.24462 0.39471 -1.01857 0.93356
|
|
228 11D-2 -0.06402 0.39471 0.21115 -0.24258 -1.01857
|
|
229 12D 0 0.00000 0.11753 0.20358 0.57484 0.33188
|
|
230 12D+1 0.04533 -0.13227 -0.09620 0.51062 0.47865
|
|
231 12D-1 -0.07851 0.05653 -0.13227 0.47865 -0.04207
|
|
232 12D+2 0.72101 0.06846 -0.17808 -0.43896 0.41568
|
|
233 12D-2 -0.41628 -0.17808 -0.13717 -0.09119 -0.43896
|
|
234 13F 0 0.00000 -0.01017 -0.01762 -0.10034 -0.05793
|
|
235 13F+1 0.07789 -0.01886 -0.11184 0.56101 0.30490
|
|
236 13F-1 -0.13490 -0.09006 -0.01886 0.30490 0.20894
|
|
237 13F+2 0.15395 0.05797 -0.03733 0.05536 0.30091
|
|
238 13F-2 -0.08888 -0.03733 0.01487 0.36483 0.05536
|
|
239 13F+3 -0.12598 -0.15142 0.08742 -0.22850 0.39577
|
|
240 13F-3 0.00000 -0.01071 -0.01855 -0.15954 -0.09211
|
|
241 14F 0 0.00000 -0.03744 -0.06484 -0.08396 -0.04848
|
|
242 14F+1 -0.03122 0.10531 0.14684 0.65991 0.35540
|
|
243 14F-1 0.05408 0.02524 0.10531 0.35540 0.24953
|
|
244 14F+2 0.22609 0.01481 -0.02993 0.02924 0.37835
|
|
245 14F-2 -0.13054 -0.02993 -0.01974 0.41212 0.02924
|
|
246 14F+3 0.55435 0.04904 -0.02831 -0.27013 0.46788
|
|
247 14F-3 0.00000 0.00041 0.00071 -0.23654 -0.13656
|
|
248 15G 0 0.00000 -0.08149 -0.14115 -0.33075 -0.19096
|
|
249 15G+1 -0.01295 -0.03949 -0.04170 0.06777 0.01032
|
|
250 15G-1 0.02243 0.00391 -0.03949 0.01032 0.05586
|
|
251 15G+2 0.08955 0.13076 0.00698 0.22336 0.12759
|
|
252 15G-2 -0.05170 0.00698 0.13882 0.38550 0.22336
|
|
253 15G+3 0.36368 0.13507 -0.07798 -0.11468 0.19864
|
|
254 15G-3 0.00000 -0.00471 -0.00816 0.21410 0.12361
|
|
255 15G+4 0.24710 0.00366 -0.00477 -0.09743 0.26819
|
|
256 15G-4 0.14266 0.00477 0.00184 -0.15568 0.09743
|
|
246 247 248 249 250
|
|
(A2)--V (A1)--V (E)--V (E)--V (A1)--V
|
|
Eigenvalues -- 20.68915 20.80697 21.20264 21.20264 21.24951
|
|
1 1 N 1S 0.00000 -0.07430 0.00000 0.00000 -0.07487
|
|
2 2S 0.00000 -0.31276 0.00000 0.00000 -0.34475
|
|
3 3S 0.00000 -3.09278 0.00000 0.00000 -3.56960
|
|
4 4S 0.00000 10.41400 0.00000 0.00000 13.37164
|
|
5 5S 0.00000 7.94324 0.00000 0.00000 3.57995
|
|
6 6S 0.00000 3.38204 0.00000 0.00000 1.12528
|
|
7 7PX 0.00000 0.00000 0.00000 -0.26533 0.00000
|
|
8 7PY 0.00000 0.00000 -0.26533 0.00000 0.00000
|
|
9 7PZ 0.00000 0.48701 0.00000 0.00000 0.66676
|
|
10 8PX 0.00000 0.00000 0.00000 0.28604 0.00000
|
|
11 8PY 0.00000 0.00000 0.28604 0.00000 0.00000
|
|
12 8PZ 0.00000 -0.41180 0.00000 0.00000 -3.10471
|
|
13 9PX 0.00000 0.00000 0.00000 2.90513 0.00000
|
|
14 9PY 0.00000 0.00000 2.90513 0.00000 0.00000
|
|
15 9PZ 0.00000 -8.03623 0.00000 0.00000 2.16011
|
|
16 10PX 0.00000 0.00000 0.00000 -0.26128 0.00000
|
|
17 10PY 0.00000 0.00000 -0.26128 0.00000 0.00000
|
|
18 10PZ 0.00000 -2.45306 0.00000 0.00000 0.74497
|
|
19 11PX 0.00000 0.00000 0.00000 0.00433 0.00000
|
|
20 11PY 0.00000 0.00000 0.00433 0.00000 0.00000
|
|
21 11PZ 0.00000 -0.38355 0.00000 0.00000 -0.12235
|
|
22 12D 0 0.00000 -0.39893 0.00000 0.00000 0.89990
|
|
23 12D+1 0.00000 0.00000 0.00000 0.76582 0.00000
|
|
24 12D-1 0.00000 0.00000 0.76582 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 -0.77921 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 -0.77921 0.00000
|
|
27 13D 0 0.00000 -0.34956 0.00000 0.00000 -1.65953
|
|
28 13D+1 0.00000 0.00000 0.00000 -1.08569 0.00000
|
|
29 13D-1 0.00000 0.00000 -1.08569 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.33530 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 0.33530 0.00000
|
|
32 14D 0 0.00000 3.98406 0.00000 0.00000 -1.85405
|
|
33 14D+1 0.00000 0.00000 0.00000 -2.32264 0.00000
|
|
34 14D-1 0.00000 0.00000 -2.32264 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 5.20465 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 5.20465 0.00000
|
|
37 15D 0 0.00000 0.60045 0.00000 0.00000 0.03482
|
|
38 15D+1 0.00000 0.00000 0.00000 -0.02365 0.00000
|
|
39 15D-1 0.00000 0.00000 -0.02365 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.78920 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 0.78920 0.00000
|
|
42 16F 0 0.00000 0.46204 0.00000 0.00000 0.74315
|
|
43 16F+1 0.00000 0.00000 0.00000 -0.21897 0.00000
|
|
44 16F-1 0.00000 0.00000 -0.21897 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.38331 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.38331 0.00000
|
|
47 16F+3 -0.76028 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 -1.05918 0.00000 0.00000 -0.81588
|
|
49 17F 0 0.00000 0.06469 0.00000 0.00000 -1.03565
|
|
50 17F+1 0.00000 0.00000 0.00000 1.13014 0.00000
|
|
51 17F-1 0.00000 0.00000 1.13014 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 -1.20395 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 -1.20395 0.00000
|
|
54 17F+3 3.86731 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 1.88737 0.00000 0.00000 0.14408
|
|
56 18F 0 0.00000 -0.09278 0.00000 0.00000 -0.87159
|
|
57 18F+1 0.00000 0.00000 0.00000 0.26588 0.00000
|
|
58 18F-1 0.00000 0.00000 0.26588 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 -0.51222 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 -0.51222 0.00000
|
|
61 18F+3 1.89500 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 1.19855 0.00000 0.00000 1.00230
|
|
63 19G 0 0.00000 -0.62098 0.00000 0.00000 0.45747
|
|
64 19G+1 0.00000 0.00000 0.00000 0.10287 0.00000
|
|
65 19G-1 0.00000 0.00000 0.10287 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 -0.32752 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 -0.32752 0.00000
|
|
68 19G+3 -0.94578 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.39715 0.00000 0.00000 -0.00018
|
|
70 19G+4 0.00000 0.00000 0.45504 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 -0.45504 0.00000
|
|
72 20G 0 0.00000 -0.97007 0.00000 0.00000 0.87986
|
|
73 20G+1 0.00000 0.00000 0.00000 0.04519 0.00000
|
|
74 20G-1 0.00000 0.00000 0.04519 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 -0.62106 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 -0.62106 0.00000
|
|
77 20G+3 -1.83084 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 -0.35505 0.00000 0.00000 -1.55320
|
|
79 20G+4 0.00000 0.00000 0.90394 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 -0.90394 0.00000
|
|
81 21H 0 0.00000 0.50651 0.00000 0.00000 -0.08296
|
|
82 21H+1 0.00000 0.00000 0.00000 -0.27939 0.00000
|
|
83 21H-1 0.00000 0.00000 -0.27939 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.44910 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.44910 0.00000
|
|
86 21H+3 0.54094 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 -0.68462 0.00000 0.00000 0.72128
|
|
88 21H+4 0.00000 0.00000 -0.66827 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.66827 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.73756 0.00000
|
|
91 21H-5 0.00000 0.00000 -0.73756 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.21798 -0.12159 0.00000 -0.32091
|
|
93 2S 0.00000 2.49016 0.65008 0.00000 3.40414
|
|
94 3S 0.00000 -4.84017 0.31635 0.00000 -4.12349
|
|
95 4S 0.00000 -1.97518 0.12837 0.00000 -1.02138
|
|
96 5S 0.00000 -0.05578 -0.03013 0.00000 -0.04809
|
|
97 6PX -0.59505 0.00000 0.00000 0.64970 0.00000
|
|
98 6PY 0.00000 -0.19358 -0.12590 0.00000 0.13030
|
|
99 6PZ 0.00000 -0.39265 -0.31091 0.00000 0.29158
|
|
100 7PX 0.88262 0.00000 0.00000 -1.00367 0.00000
|
|
101 7PY 0.00000 -0.77958 -0.14067 0.00000 -1.62449
|
|
102 7PZ 0.00000 0.99080 0.59401 0.00000 0.13099
|
|
103 8PX 2.60051 0.00000 0.00000 -2.77031 0.00000
|
|
104 8PY 0.00000 4.51972 0.85881 0.00000 3.16465
|
|
105 8PZ 0.00000 0.46591 1.09677 0.00000 -2.67296
|
|
106 9PX 0.40565 0.00000 0.00000 -0.32352 0.00000
|
|
107 9PY 0.00000 1.51964 0.12240 0.00000 1.04664
|
|
108 9PZ 0.00000 -0.19995 0.13033 0.00000 -0.60624
|
|
109 10D 0 0.00000 -0.30382 -0.13767 0.00000 -0.12057
|
|
110 10D+1 -0.10235 0.00000 0.00000 0.13183 0.00000
|
|
111 10D-1 0.00000 -0.19694 0.00313 0.00000 -0.53036
|
|
112 10D+2 0.00000 -0.48616 -0.18082 0.00000 -0.44765
|
|
113 10D-2 0.21856 0.00000 0.00000 -0.21935 0.00000
|
|
114 11D 0 0.00000 1.49449 0.83743 0.00000 -0.30312
|
|
115 11D+1 0.70581 0.00000 0.00000 -1.12234 0.00000
|
|
116 11D-1 0.00000 -0.34096 -0.70671 0.00000 1.80630
|
|
117 11D+2 0.00000 1.64204 0.73540 0.00000 0.62502
|
|
118 11D-2 -2.00219 0.00000 0.00000 2.20042 0.00000
|
|
119 12D 0 0.00000 0.95448 0.38993 0.00000 0.16565
|
|
120 12D+1 0.42566 0.00000 0.00000 -0.49599 0.00000
|
|
121 12D-1 0.00000 0.31639 -0.16622 0.00000 1.29315
|
|
122 12D+2 0.00000 1.36291 0.39345 0.00000 0.97456
|
|
123 12D-2 -0.87063 0.00000 0.00000 0.89131 0.00000
|
|
124 13F 0 0.00000 0.00675 -0.01641 0.00000 0.13528
|
|
125 13F+1 -0.13752 0.00000 0.00000 0.01689 0.00000
|
|
126 13F-1 0.00000 -0.50584 -0.38157 0.00000 0.31589
|
|
127 13F+2 0.00000 -0.03889 -0.10738 0.00000 0.33878
|
|
128 13F-2 -0.32310 0.00000 0.00000 0.51904 0.00000
|
|
129 13F+3 -0.65574 0.00000 0.00000 0.65574 0.00000
|
|
130 13F-3 0.00000 -0.33407 -0.24864 0.00000 0.01854
|
|
131 14F 0 0.00000 0.25207 0.00224 0.00000 0.48183
|
|
132 14F+1 -0.08089 0.00000 0.00000 -0.03851 0.00000
|
|
133 14F-1 0.00000 -0.72601 -0.48095 0.00000 0.29925
|
|
134 14F+2 0.00000 0.17431 -0.03545 0.00000 0.70252
|
|
135 14F-2 -0.43238 0.00000 0.00000 0.68286 0.00000
|
|
136 14F+3 -0.70233 0.00000 0.00000 0.74139 0.00000
|
|
137 14F-3 0.00000 -0.68615 -0.34319 0.00000 -0.33084
|
|
138 15G 0 0.00000 -0.20955 -0.17858 0.00000 0.18923
|
|
139 15G+1 -0.13450 0.00000 0.00000 0.12058 0.00000
|
|
140 15G-1 0.00000 -0.22606 -0.13195 0.00000 -0.14982
|
|
141 15G+2 0.00000 -0.30518 -0.27492 0.00000 0.29333
|
|
142 15G-2 0.10445 0.00000 0.00000 0.08975 0.00000
|
|
143 15G+3 -0.29295 0.00000 0.00000 0.48334 0.00000
|
|
144 15G-3 0.00000 -0.13295 -0.03874 0.00000 -0.28213
|
|
145 15G+4 0.00000 -0.31171 -0.24056 0.00000 -0.04428
|
|
146 15G-4 0.46058 0.00000 0.00000 -0.41796 0.00000
|
|
147 3 H 1S 0.00000 -0.21798 0.06080 -0.10530 -0.32091
|
|
148 2S 0.00000 2.49016 -0.32504 0.56299 3.40414
|
|
149 3S 0.00000 -4.84017 -0.15817 0.27396 -4.12349
|
|
150 4S 0.00000 -1.97518 -0.06418 0.11117 -1.02138
|
|
151 5S 0.00000 -0.05578 0.01506 -0.02609 -0.04809
|
|
152 6PX 0.29753 -0.16765 0.33584 0.06800 0.11285
|
|
153 6PY 0.51533 0.09679 0.45580 0.33584 -0.06515
|
|
154 6PZ 0.00000 -0.39265 0.15545 -0.26925 0.29158
|
|
155 7PX -0.44131 -0.67513 -0.37369 -0.35642 -1.40685
|
|
156 7PY -0.76437 0.38979 -0.78792 -0.37369 0.81225
|
|
157 7PZ 0.00000 0.99080 -0.29700 0.51442 0.13099
|
|
158 8PX -1.30026 3.91419 -1.57146 -0.04847 2.74067
|
|
159 8PY -2.25211 -2.25986 -1.86303 -1.57146 -1.58232
|
|
160 8PZ 0.00000 0.46591 -0.54839 0.94983 -2.67296
|
|
161 9PX -0.20283 1.31605 -0.19309 0.01092 0.90642
|
|
162 9PY -0.35131 -0.75982 -0.21204 -0.19309 -0.52332
|
|
163 9PZ 0.00000 -0.19995 -0.06517 0.11287 -0.60624
|
|
164 10D 0 0.00000 -0.30382 0.06883 -0.11922 -0.12057
|
|
165 10D+1 0.05118 -0.17055 0.05573 0.03530 -0.45931
|
|
166 10D-1 0.08864 0.09847 0.09965 0.05573 0.26518
|
|
167 10D+2 -0.18928 0.24308 -0.20972 -0.01668 0.22383
|
|
168 10D-2 -0.10928 -0.42103 -0.01668 -0.19046 -0.38768
|
|
169 11D 0 0.00000 1.49449 -0.41872 0.72524 -0.30312
|
|
170 11D+1 -0.35290 -0.29528 -0.17998 -0.81061 1.56430
|
|
171 11D-1 -0.61125 0.17048 -1.01843 -0.17998 -0.90315
|
|
172 11D+2 1.73395 -0.82102 1.83416 0.63437 -0.31251
|
|
173 11D-2 1.00110 1.42204 0.63437 1.10165 0.54128
|
|
174 12D 0 0.00000 0.95448 -0.19496 0.33769 0.16565
|
|
175 12D+1 -0.21283 0.27400 -0.14279 -0.24866 1.11990
|
|
176 12D-1 -0.36863 -0.15819 -0.41355 -0.14279 -0.64657
|
|
177 12D+2 0.75399 -0.68146 0.76684 0.21558 -0.48728
|
|
178 12D-2 0.43531 1.18032 0.21558 0.51791 0.84400
|
|
179 13F 0 0.00000 0.00675 0.00820 -0.01421 0.13528
|
|
180 13F+1 0.06876 -0.43807 0.17254 -0.28195 0.27357
|
|
181 13F-1 0.11910 0.25292 -0.08273 0.17254 -0.15795
|
|
182 13F+2 0.27981 0.01944 0.36244 0.27125 -0.16939
|
|
183 13F-2 0.16155 -0.03368 0.27125 0.04922 0.29339
|
|
184 13F+3 -0.65574 0.00000 -0.56788 -0.32787 0.00000
|
|
185 13F-3 0.00000 -0.33407 0.12432 -0.21533 0.01854
|
|
186 14F 0 0.00000 0.25207 -0.00112 0.00194 0.48183
|
|
187 14F+1 0.04045 -0.62874 0.19158 -0.37034 0.25916
|
|
188 14F-1 0.07005 0.36300 -0.14912 0.19158 -0.14962
|
|
189 14F+2 0.37446 -0.08715 0.50328 0.31104 -0.35126
|
|
190 14F-2 0.21619 0.15095 0.31104 0.14412 0.60840
|
|
191 14F+3 -0.70233 0.00000 -0.64206 -0.37069 0.00000
|
|
192 14F-3 0.00000 -0.68615 0.17160 -0.29721 -0.33084
|
|
193 15G 0 0.00000 -0.20955 0.08929 -0.15466 0.18923
|
|
194 15G+1 0.06725 -0.19578 0.10935 -0.06882 -0.12975
|
|
195 15G-1 0.11648 0.11303 0.05745 0.10935 0.07491
|
|
196 15G+2 -0.09046 0.15259 -0.00142 0.15791 -0.14666
|
|
197 15G-2 -0.05223 -0.26430 0.15791 -0.18375 0.25403
|
|
198 15G+3 -0.29295 0.00000 -0.41858 -0.24167 0.00000
|
|
199 15G-3 0.00000 -0.13295 0.01937 -0.03355 -0.28213
|
|
200 15G+4 0.39887 0.15585 0.25333 0.28515 0.02214
|
|
201 15G-4 -0.23029 0.26995 -0.28515 0.07593 0.03835
|
|
202 4 H 1S 0.00000 -0.21798 0.06080 0.10530 -0.32091
|
|
203 2S 0.00000 2.49016 -0.32504 -0.56299 3.40414
|
|
204 3S 0.00000 -4.84017 -0.15817 -0.27396 -4.12349
|
|
205 4S 0.00000 -1.97518 -0.06418 -0.11117 -1.02138
|
|
206 5S 0.00000 -0.05578 0.01506 0.02609 -0.04809
|
|
207 6PX 0.29753 0.16765 -0.33584 0.06800 -0.11285
|
|
208 6PY -0.51533 0.09679 0.45580 -0.33584 -0.06515
|
|
209 6PZ 0.00000 -0.39265 0.15545 0.26925 0.29158
|
|
210 7PX -0.44131 0.67513 0.37369 -0.35642 1.40685
|
|
211 7PY 0.76437 0.38979 -0.78792 0.37369 0.81225
|
|
212 7PZ 0.00000 0.99080 -0.29700 -0.51442 0.13099
|
|
213 8PX -1.30026 -3.91419 1.57146 -0.04847 -2.74067
|
|
214 8PY 2.25211 -2.25986 -1.86303 1.57146 -1.58232
|
|
215 8PZ 0.00000 0.46591 -0.54839 -0.94983 -2.67296
|
|
216 9PX -0.20283 -1.31605 0.19309 0.01092 -0.90642
|
|
217 9PY 0.35131 -0.75982 -0.21204 0.19309 -0.52332
|
|
218 9PZ 0.00000 -0.19995 -0.06517 -0.11287 -0.60624
|
|
219 10D 0 0.00000 -0.30382 0.06883 0.11922 -0.12057
|
|
220 10D+1 0.05118 0.17055 -0.05573 0.03530 0.45931
|
|
221 10D-1 -0.08864 0.09847 0.09965 -0.05573 0.26518
|
|
222 10D+2 0.18928 0.24308 -0.20972 0.01668 0.22383
|
|
223 10D-2 -0.10928 0.42103 0.01668 -0.19046 0.38768
|
|
224 11D 0 0.00000 1.49449 -0.41872 -0.72524 -0.30312
|
|
225 11D+1 -0.35290 0.29528 0.17998 -0.81061 -1.56430
|
|
226 11D-1 0.61125 0.17048 -1.01843 0.17998 -0.90315
|
|
227 11D+2 -1.73395 -0.82102 1.83416 -0.63437 -0.31251
|
|
228 11D-2 1.00110 -1.42204 -0.63437 1.10165 -0.54128
|
|
229 12D 0 0.00000 0.95448 -0.19496 -0.33769 0.16565
|
|
230 12D+1 -0.21283 -0.27400 0.14279 -0.24866 -1.11990
|
|
231 12D-1 0.36863 -0.15819 -0.41355 0.14279 -0.64657
|
|
232 12D+2 -0.75399 -0.68146 0.76684 -0.21558 -0.48728
|
|
233 12D-2 0.43531 -1.18032 -0.21558 0.51791 -0.84400
|
|
234 13F 0 0.00000 0.00675 0.00820 0.01421 0.13528
|
|
235 13F+1 0.06876 0.43807 -0.17254 -0.28195 -0.27357
|
|
236 13F-1 -0.11910 0.25292 -0.08273 -0.17254 -0.15795
|
|
237 13F+2 -0.27981 0.01944 0.36244 -0.27125 -0.16939
|
|
238 13F-2 0.16155 0.03368 -0.27125 0.04922 -0.29339
|
|
239 13F+3 -0.65574 0.00000 0.56788 -0.32787 0.00000
|
|
240 13F-3 0.00000 -0.33407 0.12432 0.21533 0.01854
|
|
241 14F 0 0.00000 0.25207 -0.00112 -0.00194 0.48183
|
|
242 14F+1 0.04045 0.62874 -0.19158 -0.37034 -0.25916
|
|
243 14F-1 -0.07005 0.36300 -0.14912 -0.19158 -0.14962
|
|
244 14F+2 -0.37446 -0.08715 0.50328 -0.31104 -0.35126
|
|
245 14F-2 0.21619 -0.15095 -0.31104 0.14412 -0.60840
|
|
246 14F+3 -0.70233 0.00000 0.64206 -0.37069 0.00000
|
|
247 14F-3 0.00000 -0.68615 0.17160 0.29721 -0.33084
|
|
248 15G 0 0.00000 -0.20955 0.08929 0.15466 0.18923
|
|
249 15G+1 0.06725 0.19578 -0.10935 -0.06882 0.12975
|
|
250 15G-1 -0.11648 0.11303 0.05745 -0.10935 0.07491
|
|
251 15G+2 0.09046 0.15259 -0.00142 -0.15791 -0.14666
|
|
252 15G-2 -0.05223 0.26430 -0.15791 -0.18375 -0.25403
|
|
253 15G+3 -0.29295 0.00000 0.41858 -0.24167 0.00000
|
|
254 15G-3 0.00000 -0.13295 0.01937 0.03355 -0.28213
|
|
255 15G+4 -0.39887 0.15585 0.25333 -0.28515 0.02214
|
|
256 15G-4 -0.23029 -0.26995 0.28515 0.07593 -0.03835
|
|
251 252 253 254 255
|
|
(E)--V (E)--V (A1)--V (E)--V (E)--V
|
|
Eigenvalues -- 21.98598 21.98598 22.51399 23.59589 23.59589
|
|
1 1 N 1S 0.00000 0.00000 0.13523 0.00000 0.00000
|
|
2 2S 0.00000 0.00000 -0.45970 0.00000 0.00000
|
|
3 3S 0.00000 0.00000 -2.79168 0.00000 0.00000
|
|
4 4S 0.00000 0.00000 -0.48239 0.00000 0.00000
|
|
5 5S 0.00000 0.00000 6.84441 0.00000 0.00000
|
|
6 6S 0.00000 0.00000 0.70342 0.00000 0.00000
|
|
7 7PX -1.36685 0.00000 0.00000 0.00000 0.04714
|
|
8 7PY 0.00000 -1.36685 0.00000 0.04714 0.00000
|
|
9 7PZ 0.00000 0.00000 0.14502 0.00000 0.00000
|
|
10 8PX 5.24083 0.00000 0.00000 0.00000 -3.20333
|
|
11 8PY 0.00000 5.24083 0.00000 -3.20333 0.00000
|
|
12 8PZ 0.00000 0.00000 0.87085 0.00000 0.00000
|
|
13 9PX -1.30658 0.00000 0.00000 0.00000 15.79819
|
|
14 9PY 0.00000 -1.30658 0.00000 15.79819 0.00000
|
|
15 9PZ 0.00000 0.00000 -3.49902 0.00000 0.00000
|
|
16 10PX -3.57885 0.00000 0.00000 0.00000 9.22465
|
|
17 10PY 0.00000 -3.57885 0.00000 9.22465 0.00000
|
|
18 10PZ 0.00000 0.00000 -1.69498 0.00000 0.00000
|
|
19 11PX 0.06713 0.00000 0.00000 0.00000 0.59420
|
|
20 11PY 0.00000 0.06713 0.00000 0.59420 0.00000
|
|
21 11PZ 0.00000 0.00000 0.01712 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.45639 0.00000 0.00000
|
|
23 12D+1 0.45886 0.00000 0.00000 0.00000 0.70076
|
|
24 12D-1 0.00000 0.45886 0.00000 0.70076 0.00000
|
|
25 12D+2 0.00000 0.86514 0.00000 0.81454 0.00000
|
|
26 12D-2 0.86514 0.00000 0.00000 0.00000 0.81454
|
|
27 13D 0 0.00000 0.00000 -0.55850 0.00000 0.00000
|
|
28 13D+1 -2.04512 0.00000 0.00000 0.00000 -0.61745
|
|
29 13D-1 0.00000 -2.04512 0.00000 -0.61745 0.00000
|
|
30 13D+2 0.00000 -2.76596 0.00000 -0.81302 0.00000
|
|
31 13D-2 -2.76596 0.00000 0.00000 0.00000 -0.81302
|
|
32 14D 0 0.00000 0.00000 -1.04977 0.00000 0.00000
|
|
33 14D+1 2.90738 0.00000 0.00000 0.00000 -6.18899
|
|
34 14D-1 0.00000 2.90738 0.00000 -6.18899 0.00000
|
|
35 14D+2 0.00000 2.36055 0.00000 -6.35489 0.00000
|
|
36 14D-2 2.36055 0.00000 0.00000 0.00000 -6.35489
|
|
37 15D 0 0.00000 0.00000 -0.31658 0.00000 0.00000
|
|
38 15D+1 1.19023 0.00000 0.00000 0.00000 -2.11589
|
|
39 15D-1 0.00000 1.19023 0.00000 -2.11589 0.00000
|
|
40 15D+2 0.00000 1.43214 0.00000 -2.16358 0.00000
|
|
41 15D-2 1.43214 0.00000 0.00000 0.00000 -2.16358
|
|
42 16F 0 0.00000 0.00000 -0.16300 0.00000 0.00000
|
|
43 16F+1 -0.13592 0.00000 0.00000 0.00000 0.12122
|
|
44 16F-1 0.00000 -0.13592 0.00000 0.12122 0.00000
|
|
45 16F+2 0.00000 0.96866 0.00000 -0.33366 0.00000
|
|
46 16F-2 0.96866 0.00000 0.00000 0.00000 -0.33366
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.21162 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 1.65348 0.00000 0.00000
|
|
50 17F+1 0.08523 0.00000 0.00000 0.00000 -0.57784
|
|
51 17F-1 0.00000 0.08523 0.00000 -0.57784 0.00000
|
|
52 17F+2 0.00000 -1.12394 0.00000 2.42471 0.00000
|
|
53 17F-2 -1.12394 0.00000 0.00000 0.00000 2.42471
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 -2.23305 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.78053 0.00000 0.00000
|
|
57 18F+1 0.09348 0.00000 0.00000 0.00000 -0.47998
|
|
58 18F-1 0.00000 0.09348 0.00000 -0.47998 0.00000
|
|
59 18F+2 0.00000 -1.49323 0.00000 1.25005 0.00000
|
|
60 18F-2 -1.49323 0.00000 0.00000 0.00000 1.25005
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 -1.15161 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 -0.13260 0.00000 0.00000
|
|
64 19G+1 0.06434 0.00000 0.00000 0.00000 0.45825
|
|
65 19G-1 0.00000 0.06434 0.00000 0.45825 0.00000
|
|
66 19G+2 0.00000 -0.03579 0.00000 -0.05039 0.00000
|
|
67 19G-2 -0.03579 0.00000 0.00000 0.00000 -0.05039
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.71560 0.00000 0.00000
|
|
70 19G+4 0.00000 -0.02877 0.00000 0.42260 0.00000
|
|
71 19G-4 0.02877 0.00000 0.00000 0.00000 -0.42260
|
|
72 20G 0 0.00000 0.00000 -0.30191 0.00000 0.00000
|
|
73 20G+1 -0.86117 0.00000 0.00000 0.00000 1.01611
|
|
74 20G-1 0.00000 -0.86117 0.00000 1.01611 0.00000
|
|
75 20G+2 0.00000 0.40698 0.00000 -0.03054 0.00000
|
|
76 20G-2 0.40698 0.00000 0.00000 0.00000 -0.03054
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 1.32723 0.00000 0.00000
|
|
79 20G+4 0.00000 -0.97493 0.00000 1.24758 0.00000
|
|
80 20G-4 0.97493 0.00000 0.00000 0.00000 -1.24758
|
|
81 21H 0 0.00000 0.00000 -0.27424 0.00000 0.00000
|
|
82 21H+1 0.21665 0.00000 0.00000 0.00000 -0.26211
|
|
83 21H-1 0.00000 0.21665 0.00000 -0.26211 0.00000
|
|
84 21H+2 0.00000 0.14673 0.00000 -0.35663 0.00000
|
|
85 21H-2 0.14673 0.00000 0.00000 0.00000 -0.35663
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 -0.31688 0.00000 0.00000
|
|
88 21H+4 0.00000 0.45498 0.00000 -0.66485 0.00000
|
|
89 21H-4 -0.45498 0.00000 0.00000 0.00000 0.66485
|
|
90 21H+5 0.09468 0.00000 0.00000 0.00000 -0.34410
|
|
91 21H-5 0.00000 -0.09468 0.00000 0.34410 0.00000
|
|
92 2 H 1S 0.00000 -0.66913 0.95503 1.45720 0.00000
|
|
93 2S 0.00000 5.33605 -3.43036 -4.30331 0.00000
|
|
94 3S 0.00000 -1.76659 -1.74248 -14.35286 0.00000
|
|
95 4S 0.00000 0.44185 0.15591 -4.49784 0.00000
|
|
96 5S 0.00000 -0.31666 -0.05167 -0.04718 0.00000
|
|
97 6PX -0.07960 0.00000 0.00000 0.00000 0.03551
|
|
98 6PY 0.00000 0.12744 -0.87881 -1.15329 0.00000
|
|
99 6PZ 0.00000 0.04677 0.38605 0.51340 0.00000
|
|
100 7PX 0.18297 0.00000 0.00000 0.00000 -0.13583
|
|
101 7PY 0.00000 -2.57171 2.66545 3.72522 0.00000
|
|
102 7PZ 0.00000 0.91268 -1.11136 -1.66947 0.00000
|
|
103 8PX 0.13676 0.00000 0.00000 0.00000 -0.58631
|
|
104 8PY 0.00000 3.43498 0.17366 6.45998 0.00000
|
|
105 8PZ 0.00000 -1.84383 0.17677 -2.93610 0.00000
|
|
106 9PX 0.06610 0.00000 0.00000 0.00000 -0.24013
|
|
107 9PY 0.00000 0.73114 -0.14783 2.48403 0.00000
|
|
108 9PZ 0.00000 -0.26536 0.15586 -1.16889 0.00000
|
|
109 10D 0 0.00000 -0.28625 0.17679 0.13520 0.00000
|
|
110 10D+1 -0.06521 0.00000 0.00000 0.00000 0.02564
|
|
111 10D-1 0.00000 -0.64950 0.31233 0.36006 0.00000
|
|
112 10D+2 0.00000 -0.76656 0.38337 0.40455 0.00000
|
|
113 10D-2 -0.00318 0.00000 0.00000 0.00000 0.03281
|
|
114 11D 0 0.00000 0.37468 0.19132 0.57173 0.00000
|
|
115 11D+1 0.35400 0.00000 0.00000 0.00000 -0.19946
|
|
116 11D-1 0.00000 1.38993 0.31668 1.47230 0.00000
|
|
117 11D+2 0.00000 1.34418 0.52820 1.67888 0.00000
|
|
118 11D-2 -0.22614 0.00000 0.00000 0.00000 0.24916
|
|
119 12D 0 0.00000 0.51112 -0.09999 0.22613 0.00000
|
|
120 12D+1 -0.00530 0.00000 0.00000 0.00000 -0.11312
|
|
121 12D-1 0.00000 1.26046 -0.49882 0.71695 0.00000
|
|
122 12D+2 0.00000 1.33269 -0.38416 0.72659 0.00000
|
|
123 12D-2 -0.11781 0.00000 0.00000 0.00000 0.27265
|
|
124 13F 0 0.00000 0.22931 0.23043 0.27924 0.00000
|
|
125 13F+1 0.00983 0.00000 0.00000 0.00000 0.01697
|
|
126 13F-1 0.00000 0.01835 -0.07949 -0.07843 0.00000
|
|
127 13F+2 0.00000 0.32109 0.27614 0.45392 0.00000
|
|
128 13F-2 -0.13276 0.00000 0.00000 0.00000 0.02381
|
|
129 13F+3 -0.08481 0.00000 0.00000 0.00000 0.06189
|
|
130 13F-3 0.00000 -0.27179 -0.31274 -0.43491 0.00000
|
|
131 14F 0 0.00000 0.53707 -0.12230 0.06948 0.00000
|
|
132 14F+1 0.05051 0.00000 0.00000 0.00000 -0.02386
|
|
133 14F-1 0.00000 -0.14134 -0.00449 -0.02690 0.00000
|
|
134 14F+2 0.00000 0.84991 -0.14835 0.14054 0.00000
|
|
135 14F-2 -0.14179 0.00000 0.00000 0.00000 0.11814
|
|
136 14F+3 -0.11767 0.00000 0.00000 0.00000 0.06641
|
|
137 14F-3 0.00000 -0.69197 0.06714 -0.11520 0.00000
|
|
138 15G 0 0.00000 0.07741 0.04857 -0.01784 0.00000
|
|
139 15G+1 -0.02126 0.00000 0.00000 0.00000 0.00508
|
|
140 15G-1 0.00000 -0.35245 -0.09636 -0.08169 0.00000
|
|
141 15G+2 0.00000 0.03171 -0.01445 0.00704 0.00000
|
|
142 15G-2 -0.02207 0.00000 0.00000 0.00000 -0.01166
|
|
143 15G+3 -0.14422 0.00000 0.00000 0.00000 0.02040
|
|
144 15G-3 0.00000 -0.43642 -0.07669 -0.14204 0.00000
|
|
145 15G+4 0.00000 -0.30982 -0.11710 -0.09848 0.00000
|
|
146 15G-4 0.09003 0.00000 0.00000 0.00000 -0.00841
|
|
147 3 H 1S -0.57948 0.33456 0.95503 -0.72860 1.26197
|
|
148 2S 4.62116 -2.66803 -3.43036 2.15165 -3.72677
|
|
149 3S -1.52991 0.88330 -1.74248 7.17643 -12.42994
|
|
150 4S 0.38265 -0.22092 0.15591 2.24892 -3.89525
|
|
151 5S -0.27424 0.15833 -0.05167 0.02359 -0.04086
|
|
152 6PX 0.07568 -0.08965 -0.76107 0.51476 -0.85609
|
|
153 6PY -0.08965 -0.02784 0.43940 -0.26169 0.51476
|
|
154 6PZ 0.04051 -0.02339 0.38605 -0.25670 0.44462
|
|
155 7PX -1.88304 1.19281 2.30835 -1.67188 2.75995
|
|
156 7PY 1.19281 -0.50570 -1.33272 0.82943 -1.67188
|
|
157 7PZ 0.79040 -0.45634 -1.11136 0.83474 -1.44581
|
|
158 8PX 2.61043 -1.42817 0.15039 -3.05113 4.69840
|
|
159 8PY -1.42817 0.96132 -0.08683 1.17526 -3.05113
|
|
160 8PZ -1.59680 0.92191 0.17677 1.46805 -2.54273
|
|
161 9PX 0.56488 -0.28797 -0.12802 -1.17960 1.80299
|
|
162 9PY -0.28797 0.23236 0.07391 0.44091 -1.17960
|
|
163 9PZ -0.22981 0.13268 0.15586 0.58445 -1.01229
|
|
164 10D 0 -0.24790 0.14312 0.17679 -0.06760 0.11709
|
|
165 10D+1 -0.50342 0.25301 0.27048 -0.14481 0.27646
|
|
166 10D-1 0.25301 -0.21128 -0.15616 0.10925 -0.14481
|
|
167 10D+2 0.33055 -0.19403 -0.19169 0.12574 -0.16097
|
|
168 10D-2 -0.57572 0.33055 0.33201 -0.16097 0.31162
|
|
169 11D 0 0.32448 -0.18734 0.19132 -0.28586 0.49513
|
|
170 11D+1 1.13095 -0.44857 0.27426 -0.72389 1.05436
|
|
171 11D-1 -0.44857 0.61298 -0.15834 0.21848 -0.72389
|
|
172 11D+2 -0.67997 0.16644 -0.26410 0.60659 -0.61909
|
|
173 11D-2 0.95160 -0.67997 0.45744 -0.61909 1.32145
|
|
174 12D 0 0.44264 -0.25556 -0.09999 -0.11306 0.19583
|
|
175 12D+1 0.94402 -0.54809 -0.43199 -0.35943 0.50943
|
|
176 12D-1 -0.54809 0.31114 0.24941 0.09440 -0.35943
|
|
177 12D+2 -0.62808 0.24481 0.19208 0.38613 -0.19656
|
|
178 12D-2 0.97006 -0.62808 -0.33269 -0.19656 0.61311
|
|
179 13F 0 0.19858 -0.11465 0.23043 -0.13962 0.24183
|
|
180 13F+1 0.01622 -0.00369 -0.06884 0.04131 -0.05458
|
|
181 13F-1 -0.00369 0.01196 0.03975 -0.00688 0.04131
|
|
182 13F+2 -0.19653 -0.01930 -0.13807 0.13134 -0.18624
|
|
183 13F-2 0.20763 -0.19653 0.23914 -0.18624 0.34639
|
|
184 13F+3 0.04241 0.07345 0.00000 -0.05360 -0.03095
|
|
185 13F-3 -0.23538 0.13589 -0.31274 0.21745 -0.37664
|
|
186 14F 0 0.46511 -0.26853 -0.12230 -0.03474 0.06017
|
|
187 14F+1 -0.09338 0.08307 -0.00389 0.00132 -0.02614
|
|
188 14F-1 0.08307 0.00255 0.00225 -0.02462 0.00132
|
|
189 14F+2 -0.42942 0.10614 0.07417 0.12374 -0.00970
|
|
190 14F-2 0.60199 -0.42942 -0.12847 -0.00970 0.13494
|
|
191 14F+3 0.05883 0.10190 0.00000 -0.05751 -0.03321
|
|
192 14F-3 -0.59926 0.34598 0.06714 0.05760 -0.09977
|
|
193 15G 0 0.06704 -0.03870 0.04857 0.00892 -0.01545
|
|
194 15G+1 -0.26966 0.14341 -0.08345 0.03757 -0.06000
|
|
195 15G-1 0.14341 -0.10406 0.04818 -0.01661 0.03757
|
|
196 15G+2 -0.02328 -0.00862 0.00722 -0.00698 -0.00809
|
|
197 15G-2 0.01826 -0.02328 -0.01251 -0.00809 0.00236
|
|
198 15G+3 0.07211 0.12489 0.00000 -0.01767 -0.01020
|
|
199 15G-3 -0.37795 0.21821 -0.07669 0.07102 -0.12301
|
|
200 15G+4 0.09517 -0.14498 0.05855 -0.01831 0.04628
|
|
201 15G-4 0.25487 -0.09517 0.10141 -0.04628 0.07176
|
|
202 4 H 1S 0.57948 0.33456 0.95503 -0.72860 -1.26197
|
|
203 2S -4.62116 -2.66803 -3.43036 2.15165 3.72677
|
|
204 3S 1.52991 0.88330 -1.74248 7.17643 12.42994
|
|
205 4S -0.38265 -0.22092 0.15591 2.24892 3.89525
|
|
206 5S 0.27424 0.15833 -0.05167 0.02359 0.04086
|
|
207 6PX 0.07568 0.08965 0.76107 -0.51476 -0.85609
|
|
208 6PY 0.08965 -0.02784 0.43940 -0.26169 -0.51476
|
|
209 6PZ -0.04051 -0.02339 0.38605 -0.25670 -0.44462
|
|
210 7PX -1.88304 -1.19281 -2.30835 1.67188 2.75995
|
|
211 7PY -1.19281 -0.50570 -1.33272 0.82943 1.67188
|
|
212 7PZ -0.79040 -0.45634 -1.11136 0.83474 1.44581
|
|
213 8PX 2.61043 1.42817 -0.15039 3.05113 4.69840
|
|
214 8PY 1.42817 0.96132 -0.08683 1.17526 3.05113
|
|
215 8PZ 1.59680 0.92191 0.17677 1.46805 2.54273
|
|
216 9PX 0.56488 0.28797 0.12802 1.17960 1.80299
|
|
217 9PY 0.28797 0.23236 0.07391 0.44091 1.17960
|
|
218 9PZ 0.22981 0.13268 0.15586 0.58445 1.01229
|
|
219 10D 0 0.24790 0.14312 0.17679 -0.06760 -0.11709
|
|
220 10D+1 -0.50342 -0.25301 -0.27048 0.14481 0.27646
|
|
221 10D-1 -0.25301 -0.21128 -0.15616 0.10925 0.14481
|
|
222 10D+2 -0.33055 -0.19403 -0.19169 0.12574 0.16097
|
|
223 10D-2 -0.57572 -0.33055 -0.33201 0.16097 0.31162
|
|
224 11D 0 -0.32448 -0.18734 0.19132 -0.28586 -0.49513
|
|
225 11D+1 1.13095 0.44857 -0.27426 0.72389 1.05436
|
|
226 11D-1 0.44857 0.61298 -0.15834 0.21848 0.72389
|
|
227 11D+2 0.67997 0.16644 -0.26410 0.60659 0.61909
|
|
228 11D-2 0.95160 0.67997 -0.45744 0.61909 1.32145
|
|
229 12D 0 -0.44264 -0.25556 -0.09999 -0.11306 -0.19583
|
|
230 12D+1 0.94402 0.54809 0.43199 0.35943 0.50943
|
|
231 12D-1 0.54809 0.31114 0.24941 0.09440 0.35943
|
|
232 12D+2 0.62808 0.24481 0.19208 0.38613 0.19656
|
|
233 12D-2 0.97006 0.62808 0.33269 0.19656 0.61311
|
|
234 13F 0 -0.19858 -0.11465 0.23043 -0.13962 -0.24183
|
|
235 13F+1 0.01622 0.00369 0.06884 -0.04131 -0.05458
|
|
236 13F-1 0.00369 0.01196 0.03975 -0.00688 -0.04131
|
|
237 13F+2 0.19653 -0.01930 -0.13807 0.13134 0.18624
|
|
238 13F-2 0.20763 0.19653 -0.23914 0.18624 0.34639
|
|
239 13F+3 0.04241 -0.07345 0.00000 0.05360 -0.03095
|
|
240 13F-3 0.23538 0.13589 -0.31274 0.21745 0.37664
|
|
241 14F 0 -0.46511 -0.26853 -0.12230 -0.03474 -0.06017
|
|
242 14F+1 -0.09338 -0.08307 0.00389 -0.00132 -0.02614
|
|
243 14F-1 -0.08307 0.00255 0.00225 -0.02462 -0.00132
|
|
244 14F+2 0.42942 0.10614 0.07417 0.12374 0.00970
|
|
245 14F-2 0.60199 0.42942 0.12847 0.00970 0.13494
|
|
246 14F+3 0.05883 -0.10190 0.00000 0.05751 -0.03321
|
|
247 14F-3 0.59926 0.34598 0.06714 0.05760 0.09977
|
|
248 15G 0 -0.06704 -0.03870 0.04857 0.00892 0.01545
|
|
249 15G+1 -0.26966 -0.14341 0.08345 -0.03757 -0.06000
|
|
250 15G-1 -0.14341 -0.10406 0.04818 -0.01661 -0.03757
|
|
251 15G+2 0.02328 -0.00862 0.00722 -0.00698 0.00809
|
|
252 15G-2 0.01826 0.02328 0.01251 0.00809 0.00236
|
|
253 15G+3 0.07211 -0.12489 0.00000 0.01767 -0.01020
|
|
254 15G-3 0.37795 0.21821 -0.07669 0.07102 0.12301
|
|
255 15G+4 -0.09517 -0.14498 0.05855 -0.01831 -0.04628
|
|
256 15G-4 0.25487 0.09517 -0.10141 0.04628 0.07176
|
|
256
|
|
(A1)--V
|
|
Eigenvalues -- 54.07320
|
|
1 1 N 1S -2.82661
|
|
2 2S -5.83938
|
|
3 3S -8.83961
|
|
4 4S 8.23898
|
|
5 5S 22.68355
|
|
6 6S 6.43451
|
|
7 7PX 0.00000
|
|
8 7PY 0.00000
|
|
9 7PZ 0.02718
|
|
10 8PX 0.00000
|
|
11 8PY 0.00000
|
|
12 8PZ 0.67879
|
|
13 9PX 0.00000
|
|
14 9PY 0.00000
|
|
15 9PZ -6.76912
|
|
16 10PX 0.00000
|
|
17 10PY 0.00000
|
|
18 10PZ -3.93399
|
|
19 11PX 0.00000
|
|
20 11PY 0.00000
|
|
21 11PZ -0.50723
|
|
22 12D 0 0.12453
|
|
23 12D+1 0.00000
|
|
24 12D-1 0.00000
|
|
25 12D+2 0.00000
|
|
26 12D-2 0.00000
|
|
27 13D 0 -0.24905
|
|
28 13D+1 0.00000
|
|
29 13D-1 0.00000
|
|
30 13D+2 0.00000
|
|
31 13D-2 0.00000
|
|
32 14D 0 -1.99837
|
|
33 14D+1 0.00000
|
|
34 14D-1 0.00000
|
|
35 14D+2 0.00000
|
|
36 14D-2 0.00000
|
|
37 15D 0 -0.56312
|
|
38 15D+1 0.00000
|
|
39 15D-1 0.00000
|
|
40 15D+2 0.00000
|
|
41 15D-2 0.00000
|
|
42 16F 0 -0.10960
|
|
43 16F+1 0.00000
|
|
44 16F-1 0.00000
|
|
45 16F+2 0.00000
|
|
46 16F-2 0.00000
|
|
47 16F+3 0.00000
|
|
48 16F-3 0.14256
|
|
49 17F 0 1.06658
|
|
50 17F+1 0.00000
|
|
51 17F-1 0.00000
|
|
52 17F+2 0.00000
|
|
53 17F-2 0.00000
|
|
54 17F+3 0.00000
|
|
55 17F-3 -1.45937
|
|
56 18F 0 0.60974
|
|
57 18F+1 0.00000
|
|
58 18F-1 0.00000
|
|
59 18F+2 0.00000
|
|
60 18F-2 0.00000
|
|
61 18F+3 0.00000
|
|
62 18F-3 -0.73124
|
|
63 19G 0 -0.03317
|
|
64 19G+1 0.00000
|
|
65 19G-1 0.00000
|
|
66 19G+2 0.00000
|
|
67 19G-2 0.00000
|
|
68 19G+3 0.00000
|
|
69 19G-3 0.23168
|
|
70 19G+4 0.00000
|
|
71 19G-4 0.00000
|
|
72 20G 0 -0.09559
|
|
73 20G+1 0.00000
|
|
74 20G-1 0.00000
|
|
75 20G+2 0.00000
|
|
76 20G-2 0.00000
|
|
77 20G+3 0.00000
|
|
78 20G-3 0.40933
|
|
79 20G+4 0.00000
|
|
80 20G-4 0.00000
|
|
81 21H 0 -0.07025
|
|
82 21H+1 0.00000
|
|
83 21H-1 0.00000
|
|
84 21H+2 0.00000
|
|
85 21H-2 0.00000
|
|
86 21H+3 0.00000
|
|
87 21H-3 -0.06012
|
|
88 21H+4 0.00000
|
|
89 21H-4 0.00000
|
|
90 21H+5 0.00000
|
|
91 21H-5 0.00000
|
|
92 2 H 1S 0.24672
|
|
93 2S 0.16520
|
|
94 3S -8.65535
|
|
95 4S -3.32664
|
|
96 5S -0.10816
|
|
97 6PX 0.00000
|
|
98 6PY -0.14160
|
|
99 6PZ 0.05807
|
|
100 7PX 0.00000
|
|
101 7PY 0.31774
|
|
102 7PZ -0.12963
|
|
103 8PX 0.00000
|
|
104 8PY 4.86163
|
|
105 8PZ -1.98753
|
|
106 9PX 0.00000
|
|
107 9PY 2.08252
|
|
108 9PZ -0.77706
|
|
109 10D 0 -0.01486
|
|
110 10D+1 0.00000
|
|
111 10D-1 -0.02672
|
|
112 10D+2 -0.02866
|
|
113 10D-2 0.00000
|
|
114 11D 0 0.37868
|
|
115 11D+1 0.00000
|
|
116 11D-1 0.81061
|
|
117 11D+2 0.96189
|
|
118 11D-2 0.00000
|
|
119 12D 0 0.43292
|
|
120 12D+1 0.00000
|
|
121 12D-1 0.86669
|
|
122 12D+2 1.09133
|
|
123 12D-2 0.00000
|
|
124 13F 0 0.07455
|
|
125 13F+1 0.00000
|
|
126 13F-1 -0.02209
|
|
127 13F+2 0.11647
|
|
128 13F-2 0.00000
|
|
129 13F+3 0.00000
|
|
130 13F-3 -0.10593
|
|
131 14F 0 0.22978
|
|
132 14F+1 0.00000
|
|
133 14F-1 -0.07640
|
|
134 14F+2 0.29767
|
|
135 14F-2 0.00000
|
|
136 14F+3 0.00000
|
|
137 14F-3 -0.30700
|
|
138 15G 0 0.00901
|
|
139 15G+1 0.00000
|
|
140 15G-1 -0.02529
|
|
141 15G+2 0.00321
|
|
142 15G-2 0.00000
|
|
143 15G+3 0.00000
|
|
144 15G-3 -0.02070
|
|
145 15G+4 -0.02590
|
|
146 15G-4 0.00000
|
|
147 3 H 1S 0.24672
|
|
148 2S 0.16520
|
|
149 3S -8.65535
|
|
150 4S -3.32664
|
|
151 5S -0.10816
|
|
152 6PX -0.12263
|
|
153 6PY 0.07080
|
|
154 6PZ 0.05807
|
|
155 7PX 0.27517
|
|
156 7PY -0.15887
|
|
157 7PZ -0.12963
|
|
158 8PX 4.21029
|
|
159 8PY -2.43081
|
|
160 8PZ -1.98753
|
|
161 9PX 1.80351
|
|
162 9PY -1.04126
|
|
163 9PZ -0.77706
|
|
164 10D 0 -0.01486
|
|
165 10D+1 -0.02314
|
|
166 10D-1 0.01336
|
|
167 10D+2 0.01433
|
|
168 10D-2 -0.02482
|
|
169 11D 0 0.37868
|
|
170 11D+1 0.70201
|
|
171 11D-1 -0.40531
|
|
172 11D+2 -0.48095
|
|
173 11D-2 0.83302
|
|
174 12D 0 0.43292
|
|
175 12D+1 0.75057
|
|
176 12D-1 -0.43334
|
|
177 12D+2 -0.54566
|
|
178 12D-2 0.94512
|
|
179 13F 0 0.07455
|
|
180 13F+1 -0.01913
|
|
181 13F-1 0.01104
|
|
182 13F+2 -0.05824
|
|
183 13F-2 0.10087
|
|
184 13F+3 0.00000
|
|
185 13F-3 -0.10593
|
|
186 14F 0 0.22978
|
|
187 14F+1 -0.06616
|
|
188 14F-1 0.03820
|
|
189 14F+2 -0.14884
|
|
190 14F-2 0.25779
|
|
191 14F+3 0.00000
|
|
192 14F-3 -0.30700
|
|
193 15G 0 0.00901
|
|
194 15G+1 -0.02190
|
|
195 15G-1 0.01265
|
|
196 15G+2 -0.00160
|
|
197 15G-2 0.00278
|
|
198 15G+3 0.00000
|
|
199 15G-3 -0.02070
|
|
200 15G+4 0.01295
|
|
201 15G-4 0.02243
|
|
202 4 H 1S 0.24672
|
|
203 2S 0.16520
|
|
204 3S -8.65535
|
|
205 4S -3.32664
|
|
206 5S -0.10816
|
|
207 6PX 0.12263
|
|
208 6PY 0.07080
|
|
209 6PZ 0.05807
|
|
210 7PX -0.27517
|
|
211 7PY -0.15887
|
|
212 7PZ -0.12963
|
|
213 8PX -4.21029
|
|
214 8PY -2.43081
|
|
215 8PZ -1.98753
|
|
216 9PX -1.80351
|
|
217 9PY -1.04126
|
|
218 9PZ -0.77706
|
|
219 10D 0 -0.01486
|
|
220 10D+1 0.02314
|
|
221 10D-1 0.01336
|
|
222 10D+2 0.01433
|
|
223 10D-2 0.02482
|
|
224 11D 0 0.37868
|
|
225 11D+1 -0.70201
|
|
226 11D-1 -0.40531
|
|
227 11D+2 -0.48095
|
|
228 11D-2 -0.83302
|
|
229 12D 0 0.43292
|
|
230 12D+1 -0.75057
|
|
231 12D-1 -0.43334
|
|
232 12D+2 -0.54566
|
|
233 12D-2 -0.94512
|
|
234 13F 0 0.07455
|
|
235 13F+1 0.01913
|
|
236 13F-1 0.01104
|
|
237 13F+2 -0.05824
|
|
238 13F-2 -0.10087
|
|
239 13F+3 0.00000
|
|
240 13F-3 -0.10593
|
|
241 14F 0 0.22978
|
|
242 14F+1 0.06616
|
|
243 14F-1 0.03820
|
|
244 14F+2 -0.14884
|
|
245 14F-2 -0.25779
|
|
246 14F+3 0.00000
|
|
247 14F-3 -0.30700
|
|
248 15G 0 0.00901
|
|
249 15G+1 0.02190
|
|
250 15G-1 0.01265
|
|
251 15G+2 -0.00160
|
|
252 15G-2 -0.00278
|
|
253 15G+3 0.00000
|
|
254 15G-3 -0.02070
|
|
255 15G+4 0.01295
|
|
256 15G-4 -0.02243
|
|
Alpha Density Matrix:
|
|
1 2 3 4 5
|
|
1 1 N 1S 0.33459
|
|
2 2S -0.26274 0.21772
|
|
3 3S 0.04125 -0.03170 0.00514
|
|
4 4S -0.03421 0.05890 -0.00228 0.09352
|
|
5 5S -0.04362 0.07672 -0.00291 0.12384 0.16462
|
|
6 6S -0.01095 0.01920 -0.00099 0.03101 0.04292
|
|
7 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
8 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
9 7PZ -0.00315 0.00486 0.00018 0.00686 0.00628
|
|
10 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
11 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
12 8PZ -0.00360 0.00708 0.00056 0.01204 0.01105
|
|
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
14 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
15 9PZ -0.00614 0.01100 0.00077 0.01760 0.01575
|
|
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
17 10PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
18 10PZ -0.00884 0.01561 0.00060 0.02486 0.02524
|
|
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
20 11PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
21 11PZ -0.00773 0.01389 0.00034 0.02247 0.02437
|
|
22 12D 0 -0.00005 0.00001 -0.00001 -0.00007 -0.00008
|
|
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00034 -0.00050 0.00002 -0.00068 -0.00085
|
|
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00074 -0.00124 0.00003 -0.00193 -0.00241
|
|
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00036 -0.00071 -0.00002 -0.00121 -0.00135
|
|
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00001 0.00000 0.00002 0.00004
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00002 -0.00004 0.00000 -0.00008 -0.00012
|
|
49 17F 0 -0.00012 0.00027 -0.00002 0.00049 0.00073
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00022 -0.00043 0.00002 -0.00074 -0.00103
|
|
56 18F 0 -0.00010 0.00031 -0.00001 0.00066 0.00093
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00021 -0.00048 0.00001 -0.00092 -0.00127
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 -0.00001 0.00003 0.00000 0.00006 0.00008
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 -0.00001 -0.00003 0.00000 -0.00011 -0.00017
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 -0.00007 0.00020 0.00000 0.00042 0.00058
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00001 -0.00002 0.00000 -0.00003 -0.00004
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 -0.00001 0.00000 0.00000 -0.00002 -0.00004
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S -0.00191 0.00324 -0.00019 0.00512 0.00720
|
|
93 2S -0.00424 0.00711 -0.00045 0.01111 0.01575
|
|
94 3S -0.00793 0.01299 -0.00084 0.01991 0.02815
|
|
95 4S -0.00561 0.00946 -0.00025 0.01474 0.01862
|
|
96 5S 0.00005 -0.00011 -0.00002 -0.00019 -0.00012
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00011 -0.00019 0.00001 -0.00031 -0.00043
|
|
99 6PZ -0.00007 0.00013 0.00000 0.00021 0.00026
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00038 -0.00062 0.00004 -0.00095 -0.00137
|
|
102 7PZ -0.00026 0.00044 -0.00001 0.00068 0.00085
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00155 -0.00254 0.00014 -0.00386 -0.00528
|
|
105 8PZ -0.00096 0.00174 -0.00002 0.00285 0.00351
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00165 -0.00279 0.00003 -0.00434 -0.00519
|
|
108 9PZ -0.00097 0.00172 0.00003 0.00276 0.00307
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00003 -0.00005 0.00000 -0.00007 -0.00009
|
|
112 10D+2 0.00003 -0.00004 0.00000 -0.00006 -0.00009
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00005 -0.00007 0.00001 -0.00008 -0.00013
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00013 -0.00027 0.00000 -0.00049 -0.00063
|
|
117 11D+2 0.00010 -0.00018 0.00001 -0.00028 -0.00041
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00009 -0.00012 0.00001 -0.00015 -0.00023
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00031 -0.00060 0.00000 -0.00103 -0.00124
|
|
122 12D+2 0.00040 -0.00071 0.00001 -0.00115 -0.00141
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00001 -0.00001 0.00000 -0.00002 -0.00002
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
127 13F+2 0.00001 -0.00002 0.00000 -0.00004 -0.00005
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
131 14F 0 0.00003 -0.00007 0.00000 -0.00015 -0.00019
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 -0.00001 0.00000 0.00000 -0.00002 -0.00003
|
|
134 14F+2 0.00004 -0.00010 0.00000 -0.00020 -0.00026
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 -0.00005 0.00010 0.00000 0.00019 0.00023
|
|
138 15G 0 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00001 0.00000 0.00002 0.00003
|
|
141 15G+2 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00001 0.00000 0.00003 0.00003
|
|
145 15G+4 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00191 0.00324 -0.00019 0.00512 0.00720
|
|
148 2S -0.00424 0.00711 -0.00045 0.01111 0.01575
|
|
149 3S -0.00793 0.01299 -0.00084 0.01991 0.02815
|
|
150 4S -0.00561 0.00946 -0.00025 0.01474 0.01862
|
|
151 5S 0.00005 -0.00011 -0.00002 -0.00019 -0.00012
|
|
152 6PX 0.00009 -0.00017 0.00001 -0.00027 -0.00038
|
|
153 6PY -0.00005 0.00010 -0.00001 0.00016 0.00022
|
|
154 6PZ -0.00007 0.00013 0.00000 0.00021 0.00026
|
|
155 7PX 0.00033 -0.00054 0.00004 -0.00082 -0.00118
|
|
156 7PY -0.00019 0.00031 -0.00002 0.00047 0.00068
|
|
157 7PZ -0.00026 0.00044 -0.00001 0.00068 0.00085
|
|
158 8PX 0.00135 -0.00220 0.00012 -0.00335 -0.00457
|
|
159 8PY -0.00078 0.00127 -0.00007 0.00193 0.00264
|
|
160 8PZ -0.00096 0.00174 -0.00002 0.00285 0.00351
|
|
161 9PX 0.00143 -0.00242 0.00002 -0.00376 -0.00449
|
|
162 9PY -0.00082 0.00140 -0.00001 0.00217 0.00259
|
|
163 9PZ -0.00097 0.00172 0.00003 0.00276 0.00307
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
165 10D+1 0.00003 -0.00004 0.00000 -0.00006 -0.00008
|
|
166 10D-1 -0.00002 0.00003 0.00000 0.00003 0.00004
|
|
167 10D+2 -0.00001 0.00002 0.00000 0.00003 0.00005
|
|
168 10D-2 0.00003 -0.00004 0.00000 -0.00005 -0.00008
|
|
169 11D 0 0.00005 -0.00007 0.00001 -0.00008 -0.00013
|
|
170 11D+1 0.00011 -0.00023 0.00000 -0.00042 -0.00055
|
|
171 11D-1 -0.00006 0.00014 0.00000 0.00024 0.00032
|
|
172 11D+2 -0.00005 0.00009 -0.00001 0.00014 0.00021
|
|
173 11D-2 0.00009 -0.00015 0.00001 -0.00025 -0.00036
|
|
174 12D 0 0.00009 -0.00012 0.00001 -0.00015 -0.00023
|
|
175 12D+1 0.00027 -0.00052 0.00000 -0.00089 -0.00107
|
|
176 12D-1 -0.00016 0.00030 0.00000 0.00051 0.00062
|
|
177 12D+2 -0.00020 0.00036 0.00000 0.00058 0.00071
|
|
178 12D-2 0.00035 -0.00062 0.00001 -0.00100 -0.00122
|
|
179 13F 0 0.00001 -0.00001 0.00000 -0.00002 -0.00002
|
|
180 13F+1 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
182 13F+2 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
183 13F-2 0.00001 -0.00002 0.00000 -0.00003 -0.00004
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
186 14F 0 0.00003 -0.00007 0.00000 -0.00015 -0.00019
|
|
187 14F+1 -0.00001 0.00000 0.00000 -0.00002 -0.00002
|
|
188 14F-1 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
189 14F+2 -0.00002 0.00005 0.00000 0.00010 0.00013
|
|
190 14F-2 0.00003 -0.00009 0.00000 -0.00017 -0.00022
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00005 0.00010 0.00000 0.00019 0.00023
|
|
193 15G 0 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
194 15G+1 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
195 15G-1 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
197 15G-2 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00001 0.00000 0.00003 0.00003
|
|
200 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
201 15G-4 0.00000 -0.00001 0.00000 -0.00002 -0.00002
|
|
202 4 H 1S -0.00191 0.00324 -0.00019 0.00512 0.00720
|
|
203 2S -0.00424 0.00711 -0.00045 0.01111 0.01575
|
|
204 3S -0.00793 0.01299 -0.00084 0.01991 0.02815
|
|
205 4S -0.00561 0.00946 -0.00025 0.01474 0.01862
|
|
206 5S 0.00005 -0.00011 -0.00002 -0.00019 -0.00012
|
|
207 6PX -0.00009 0.00017 -0.00001 0.00027 0.00038
|
|
208 6PY -0.00005 0.00010 -0.00001 0.00016 0.00022
|
|
209 6PZ -0.00007 0.00013 0.00000 0.00021 0.00026
|
|
210 7PX -0.00033 0.00054 -0.00004 0.00082 0.00118
|
|
211 7PY -0.00019 0.00031 -0.00002 0.00047 0.00068
|
|
212 7PZ -0.00026 0.00044 -0.00001 0.00068 0.00085
|
|
213 8PX -0.00135 0.00220 -0.00012 0.00335 0.00457
|
|
214 8PY -0.00078 0.00127 -0.00007 0.00193 0.00264
|
|
215 8PZ -0.00096 0.00174 -0.00002 0.00285 0.00351
|
|
216 9PX -0.00143 0.00242 -0.00002 0.00376 0.00449
|
|
217 9PY -0.00082 0.00140 -0.00001 0.00217 0.00259
|
|
218 9PZ -0.00097 0.00172 0.00003 0.00276 0.00307
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
220 10D+1 -0.00003 0.00004 0.00000 0.00006 0.00008
|
|
221 10D-1 -0.00002 0.00003 0.00000 0.00003 0.00004
|
|
222 10D+2 -0.00001 0.00002 0.00000 0.00003 0.00005
|
|
223 10D-2 -0.00003 0.00004 0.00000 0.00005 0.00008
|
|
224 11D 0 0.00005 -0.00007 0.00001 -0.00008 -0.00013
|
|
225 11D+1 -0.00011 0.00023 0.00000 0.00042 0.00055
|
|
226 11D-1 -0.00006 0.00014 0.00000 0.00024 0.00032
|
|
227 11D+2 -0.00005 0.00009 -0.00001 0.00014 0.00021
|
|
228 11D-2 -0.00009 0.00015 -0.00001 0.00025 0.00036
|
|
229 12D 0 0.00009 -0.00012 0.00001 -0.00015 -0.00023
|
|
230 12D+1 -0.00027 0.00052 0.00000 0.00089 0.00107
|
|
231 12D-1 -0.00016 0.00030 0.00000 0.00051 0.00062
|
|
232 12D+2 -0.00020 0.00036 0.00000 0.00058 0.00071
|
|
233 12D-2 -0.00035 0.00062 -0.00001 0.00100 0.00122
|
|
234 13F 0 0.00001 -0.00001 0.00000 -0.00002 -0.00002
|
|
235 13F+1 0.00000 0.00001 0.00000 0.00001 0.00001
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
237 13F+2 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
238 13F-2 -0.00001 0.00002 0.00000 0.00003 0.00004
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
241 14F 0 0.00003 -0.00007 0.00000 -0.00015 -0.00019
|
|
242 14F+1 0.00001 0.00000 0.00000 0.00002 0.00002
|
|
243 14F-1 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
244 14F+2 -0.00002 0.00005 0.00000 0.00010 0.00013
|
|
245 14F-2 -0.00003 0.00009 0.00000 0.00017 0.00022
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00005 0.00010 0.00000 0.00019 0.00023
|
|
248 15G 0 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
249 15G+1 0.00000 -0.00001 0.00000 -0.00002 -0.00002
|
|
250 15G-1 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00001 0.00000 0.00003 0.00003
|
|
255 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
256 15G-4 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
6 7 8 9 10
|
|
6 6S 0.01573
|
|
7 7PX 0.00000 0.00910
|
|
8 7PY 0.00000 0.00000 0.00910
|
|
9 7PZ -0.00593 0.00000 0.00000 0.01288
|
|
10 8PX 0.00000 0.01562 0.00000 0.00000 0.02683
|
|
11 8PY 0.00000 0.00000 0.01562 0.00000 0.00000
|
|
12 8PZ -0.01033 0.00000 0.00000 0.02248 0.00000
|
|
13 9PX 0.00000 0.02417 0.00000 0.00000 0.04149
|
|
14 9PY 0.00000 0.00000 0.02417 0.00000 0.00000
|
|
15 9PZ -0.01626 0.00000 0.00000 0.03459 0.00000
|
|
16 10PX 0.00000 0.01900 0.00000 0.00000 0.03262
|
|
17 10PY 0.00000 0.00000 0.01900 0.00000 0.00000
|
|
18 10PZ -0.01420 0.00000 0.00000 0.03565 0.00000
|
|
19 11PX 0.00000 0.00499 0.00000 0.00000 0.00857
|
|
20 11PY 0.00000 0.00000 0.00499 0.00000 0.00000
|
|
21 11PZ -0.00827 0.00000 0.00000 0.02535 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 -0.00004 0.00000
|
|
23 12D+1 0.00000 -0.00013 0.00000 0.00000 -0.00023
|
|
24 12D-1 0.00000 0.00000 -0.00013 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 -0.00011 0.00000 0.00000
|
|
26 12D-2 0.00000 -0.00011 0.00000 0.00000 -0.00019
|
|
27 13D 0 -0.00010 0.00000 0.00000 -0.00024 0.00000
|
|
28 13D+1 0.00000 -0.00065 0.00000 0.00000 -0.00111
|
|
29 13D-1 0.00000 0.00000 -0.00065 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 -0.00049 0.00000 0.00000
|
|
31 13D-2 0.00000 -0.00049 0.00000 0.00000 -0.00085
|
|
32 14D 0 -0.00021 0.00000 0.00000 -0.00079 0.00000
|
|
33 14D+1 0.00000 -0.00212 0.00000 0.00000 -0.00364
|
|
34 14D-1 0.00000 0.00000 -0.00212 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 -0.00170 0.00000 0.00000
|
|
36 14D-2 0.00000 -0.00170 0.00000 0.00000 -0.00292
|
|
37 15D 0 0.00034 0.00000 0.00000 -0.00121 0.00000
|
|
38 15D+1 0.00000 -0.00135 0.00000 0.00000 -0.00231
|
|
39 15D-1 0.00000 0.00000 -0.00135 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 -0.00128 0.00000 0.00000
|
|
41 15D-2 0.00000 -0.00128 0.00000 0.00000 -0.00220
|
|
42 16F 0 0.00004 0.00000 0.00000 -0.00005 0.00000
|
|
43 16F+1 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
44 16F-1 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00003 0.00000 0.00000 0.00004
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 -0.00005 0.00000 0.00000 0.00002 0.00000
|
|
49 17F 0 0.00040 0.00000 0.00000 -0.00032 0.00000
|
|
50 17F+1 0.00000 -0.00014 0.00000 0.00000 -0.00024
|
|
51 17F-1 0.00000 0.00000 -0.00014 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00022 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00022 0.00000 0.00000 0.00037
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 -0.00037 0.00000 0.00000 0.00014 0.00000
|
|
56 18F 0 0.00040 0.00000 0.00000 -0.00023 0.00000
|
|
57 18F+1 0.00000 -0.00017 0.00000 0.00000 -0.00029
|
|
58 18F-1 0.00000 0.00000 -0.00017 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00036 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00036 0.00000 0.00000 0.00063
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 -0.00044 0.00000 0.00000 0.00014 0.00000
|
|
63 19G 0 -0.00001 0.00000 0.00000 0.00003 0.00000
|
|
64 19G+1 0.00000 0.00002 0.00000 0.00000 0.00004
|
|
65 19G-1 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00004 0.00000 0.00000 -0.00003 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
71 19G-4 0.00000 -0.00002 0.00000 0.00000 -0.00004
|
|
72 20G 0 -0.00011 0.00000 0.00000 0.00010 0.00000
|
|
73 20G+1 0.00000 0.00015 0.00000 0.00000 0.00025
|
|
74 20G-1 0.00000 0.00000 0.00015 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00022 0.00000 0.00000 -0.00009 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00017 0.00000 0.00000
|
|
80 20G-4 0.00000 -0.00017 0.00000 0.00000 -0.00030
|
|
81 21H 0 -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
82 21H+1 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
83 21H-1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
85 21H-2 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 -0.00003 0.00000 0.00000 0.00003 0.00000
|
|
88 21H+4 0.00000 0.00000 -0.00004 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00004 0.00000 0.00000 0.00008
|
|
90 21H+5 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
91 21H-5 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
92 2 H 1S 0.00293 0.00000 0.00377 -0.00149 0.00000
|
|
93 2S 0.00673 0.00000 0.00894 -0.00377 0.00000
|
|
94 3S 0.01182 0.00000 0.01655 -0.00641 0.00000
|
|
95 4S 0.00226 0.00000 0.01510 0.00504 0.00000
|
|
96 5S 0.00034 0.00000 0.00297 -0.00062 0.00000
|
|
97 6PX 0.00000 0.00007 0.00000 0.00000 0.00012
|
|
98 6PY -0.00017 0.00000 -0.00013 0.00008 0.00000
|
|
99 6PZ 0.00002 0.00000 0.00008 0.00008 0.00000
|
|
100 7PX 0.00000 0.00026 0.00000 0.00000 0.00044
|
|
101 7PY -0.00064 0.00000 -0.00039 0.00042 0.00000
|
|
102 7PZ 0.00008 0.00000 0.00025 0.00027 0.00000
|
|
103 8PX 0.00000 0.00091 0.00000 0.00000 0.00157
|
|
104 8PY -0.00176 0.00000 -0.00113 0.00044 0.00000
|
|
105 8PZ 0.00015 0.00000 0.00080 0.00141 0.00000
|
|
106 9PX 0.00000 0.00118 0.00000 0.00000 0.00202
|
|
107 9PY 0.00021 0.00000 -0.00107 -0.00281 0.00000
|
|
108 9PZ -0.00081 0.00000 0.00039 0.00280 0.00000
|
|
109 10D 0 -0.00003 0.00000 -0.00001 0.00005 0.00000
|
|
110 10D+1 0.00000 0.00002 0.00000 0.00000 0.00003
|
|
111 10D-1 -0.00001 0.00000 -0.00005 -0.00002 0.00000
|
|
112 10D+2 -0.00005 0.00000 -0.00004 0.00004 0.00000
|
|
113 10D-2 0.00000 -0.00004 0.00000 0.00000 -0.00007
|
|
114 11D 0 -0.00010 0.00000 -0.00002 0.00011 0.00000
|
|
115 11D+1 0.00000 0.00001 0.00000 0.00000 0.00002
|
|
116 11D-1 -0.00012 0.00000 -0.00014 -0.00010 0.00000
|
|
117 11D+2 -0.00019 0.00000 -0.00012 0.00013 0.00000
|
|
118 11D-2 0.00000 -0.00010 0.00000 0.00000 -0.00017
|
|
119 12D 0 -0.00014 0.00000 -0.00011 0.00012 0.00000
|
|
120 12D+1 0.00000 0.00007 0.00000 0.00000 0.00011
|
|
121 12D-1 0.00003 0.00000 -0.00020 -0.00063 0.00000
|
|
122 12D+2 -0.00005 0.00000 -0.00016 -0.00058 0.00000
|
|
123 12D-2 0.00000 -0.00031 0.00000 0.00000 -0.00054
|
|
124 13F 0 -0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00001 0.00000 0.00000 -0.00003 0.00000
|
|
127 13F+2 -0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
128 13F-2 0.00000 -0.00001 0.00000 0.00000 -0.00001
|
|
129 13F+3 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
130 13F-3 0.00002 0.00000 0.00002 -0.00003 0.00000
|
|
131 14F 0 -0.00002 0.00000 -0.00005 -0.00005 0.00000
|
|
132 14F+1 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
133 14F-1 0.00001 0.00000 0.00002 -0.00003 0.00000
|
|
134 14F+2 -0.00003 0.00000 -0.00006 -0.00006 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
136 14F+3 0.00000 -0.00003 0.00000 0.00000 -0.00004
|
|
137 14F-3 0.00000 0.00000 0.00005 0.00011 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00001 0.00000 0.00001 0.00001 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
147 3 H 1S 0.00293 0.00327 -0.00189 -0.00149 0.00561
|
|
148 2S 0.00673 0.00774 -0.00447 -0.00377 0.01329
|
|
149 3S 0.01182 0.01434 -0.00828 -0.00641 0.02461
|
|
150 4S 0.00226 0.01308 -0.00755 0.00504 0.02245
|
|
151 5S 0.00034 0.00257 -0.00148 -0.00062 0.00441
|
|
152 6PX -0.00015 -0.00008 0.00009 0.00007 -0.00014
|
|
153 6PY 0.00008 0.00009 0.00002 -0.00004 0.00015
|
|
154 6PZ 0.00002 0.00007 -0.00004 0.00008 0.00013
|
|
155 7PX -0.00055 -0.00023 0.00028 0.00036 -0.00039
|
|
156 7PY 0.00032 0.00028 0.00010 -0.00021 0.00048
|
|
157 7PZ 0.00008 0.00022 -0.00013 0.00027 0.00038
|
|
158 8PX -0.00153 -0.00062 0.00088 0.00038 -0.00106
|
|
159 8PY 0.00088 0.00088 0.00040 -0.00022 0.00152
|
|
160 8PZ 0.00015 0.00069 -0.00040 0.00141 0.00118
|
|
161 9PX 0.00018 -0.00050 0.00097 -0.00243 -0.00087
|
|
162 9PY -0.00011 0.00097 0.00062 0.00140 0.00167
|
|
163 9PZ -0.00081 0.00034 -0.00020 0.00280 0.00058
|
|
164 10D 0 -0.00003 -0.00001 0.00001 0.00005 -0.00002
|
|
165 10D+1 -0.00001 -0.00003 0.00003 -0.00002 -0.00006
|
|
166 10D-1 0.00001 0.00003 0.00000 0.00001 0.00005
|
|
167 10D+2 0.00002 0.00000 -0.00004 -0.00002 0.00000
|
|
168 10D-2 -0.00004 -0.00004 0.00000 0.00003 -0.00007
|
|
169 11D 0 -0.00010 -0.00002 0.00001 0.00011 -0.00003
|
|
170 11D+1 -0.00010 -0.00010 0.00007 -0.00008 -0.00018
|
|
171 11D-1 0.00006 0.00007 -0.00003 0.00005 0.00011
|
|
172 11D+2 0.00010 0.00001 -0.00010 -0.00006 0.00001
|
|
173 11D-2 -0.00017 -0.00011 0.00001 0.00011 -0.00019
|
|
174 12D 0 -0.00014 -0.00010 0.00006 0.00012 -0.00017
|
|
175 12D+1 0.00002 -0.00013 0.00012 -0.00055 -0.00023
|
|
176 12D-1 -0.00001 0.00012 0.00000 0.00032 0.00020
|
|
177 12D+2 0.00003 -0.00007 -0.00027 0.00029 -0.00012
|
|
178 12D-2 -0.00004 -0.00020 -0.00007 -0.00050 -0.00034
|
|
179 13F 0 -0.00001 -0.00001 0.00001 0.00000 -0.00002
|
|
180 13F+1 0.00001 0.00000 0.00000 -0.00002 0.00000
|
|
181 13F-1 -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
182 13F+2 0.00001 0.00001 -0.00001 0.00000 0.00001
|
|
183 13F-2 -0.00001 -0.00002 0.00001 0.00000 -0.00003
|
|
184 13F+3 0.00000 0.00001 0.00001 0.00000 0.00001
|
|
185 13F-3 0.00002 0.00002 -0.00001 -0.00003 0.00003
|
|
186 14F 0 -0.00002 -0.00005 0.00003 -0.00005 -0.00008
|
|
187 14F+1 0.00001 0.00001 -0.00002 -0.00002 0.00002
|
|
188 14F-1 0.00000 -0.00002 -0.00001 0.00001 -0.00003
|
|
189 14F+2 0.00002 0.00003 -0.00002 0.00003 0.00004
|
|
190 14F-2 -0.00003 -0.00005 0.00003 -0.00006 -0.00009
|
|
191 14F+3 0.00000 0.00001 0.00002 0.00000 0.00002
|
|
192 14F-3 0.00000 0.00005 -0.00003 0.00011 0.00008
|
|
193 15G 0 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
194 15G+1 0.00001 0.00001 -0.00001 0.00000 0.00001
|
|
195 15G-1 0.00000 -0.00001 0.00000 0.00000 -0.00001
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00001 0.00001 0.00000 0.00001 0.00001
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
202 4 H 1S 0.00293 -0.00327 -0.00189 -0.00149 -0.00561
|
|
203 2S 0.00673 -0.00774 -0.00447 -0.00377 -0.01329
|
|
204 3S 0.01182 -0.01434 -0.00828 -0.00641 -0.02461
|
|
205 4S 0.00226 -0.01308 -0.00755 0.00504 -0.02245
|
|
206 5S 0.00034 -0.00257 -0.00148 -0.00062 -0.00441
|
|
207 6PX 0.00015 -0.00008 -0.00009 -0.00007 -0.00014
|
|
208 6PY 0.00008 -0.00009 0.00002 -0.00004 -0.00015
|
|
209 6PZ 0.00002 -0.00007 -0.00004 0.00008 -0.00013
|
|
210 7PX 0.00055 -0.00023 -0.00028 -0.00036 -0.00039
|
|
211 7PY 0.00032 -0.00028 0.00010 -0.00021 -0.00048
|
|
212 7PZ 0.00008 -0.00022 -0.00013 0.00027 -0.00038
|
|
213 8PX 0.00153 -0.00062 -0.00088 -0.00038 -0.00106
|
|
214 8PY 0.00088 -0.00088 0.00040 -0.00022 -0.00152
|
|
215 8PZ 0.00015 -0.00069 -0.00040 0.00141 -0.00118
|
|
216 9PX -0.00018 -0.00050 -0.00097 0.00243 -0.00087
|
|
217 9PY -0.00011 -0.00097 0.00062 0.00140 -0.00167
|
|
218 9PZ -0.00081 -0.00034 -0.00020 0.00280 -0.00058
|
|
219 10D 0 -0.00003 0.00001 0.00001 0.00005 0.00002
|
|
220 10D+1 0.00001 -0.00003 -0.00003 0.00002 -0.00006
|
|
221 10D-1 0.00001 -0.00003 0.00000 0.00001 -0.00005
|
|
222 10D+2 0.00002 0.00000 -0.00004 -0.00002 0.00000
|
|
223 10D-2 0.00004 -0.00004 0.00000 -0.00003 -0.00007
|
|
224 11D 0 -0.00010 0.00002 0.00001 0.00011 0.00003
|
|
225 11D+1 0.00010 -0.00010 -0.00007 0.00008 -0.00018
|
|
226 11D-1 0.00006 -0.00007 -0.00003 0.00005 -0.00011
|
|
227 11D+2 0.00010 -0.00001 -0.00010 -0.00006 -0.00001
|
|
228 11D-2 0.00017 -0.00011 -0.00001 -0.00011 -0.00019
|
|
229 12D 0 -0.00014 0.00010 0.00006 0.00012 0.00017
|
|
230 12D+1 -0.00002 -0.00013 -0.00012 0.00055 -0.00023
|
|
231 12D-1 -0.00001 -0.00012 0.00000 0.00032 -0.00020
|
|
232 12D+2 0.00003 0.00007 -0.00027 0.00029 0.00012
|
|
233 12D-2 0.00004 -0.00020 0.00007 0.00050 -0.00034
|
|
234 13F 0 -0.00001 0.00001 0.00001 0.00000 0.00002
|
|
235 13F+1 -0.00001 0.00000 0.00000 0.00002 0.00000
|
|
236 13F-1 -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
237 13F+2 0.00001 -0.00001 -0.00001 0.00000 -0.00001
|
|
238 13F-2 0.00001 -0.00002 -0.00001 0.00000 -0.00003
|
|
239 13F+3 0.00000 0.00001 -0.00001 0.00000 0.00001
|
|
240 13F-3 0.00002 -0.00002 -0.00001 -0.00003 -0.00003
|
|
241 14F 0 -0.00002 0.00005 0.00003 -0.00005 0.00008
|
|
242 14F+1 -0.00001 0.00001 0.00002 0.00002 0.00002
|
|
243 14F-1 0.00000 0.00002 -0.00001 0.00001 0.00003
|
|
244 14F+2 0.00002 -0.00003 -0.00002 0.00003 -0.00004
|
|
245 14F-2 0.00003 -0.00005 -0.00003 0.00006 -0.00009
|
|
246 14F+3 0.00000 0.00001 -0.00002 0.00000 0.00002
|
|
247 14F-3 0.00000 -0.00005 -0.00003 0.00011 -0.00008
|
|
248 15G 0 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
249 15G+1 -0.00001 0.00001 0.00001 0.00000 0.00001
|
|
250 15G-1 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00001 -0.00001 0.00000 0.00001 -0.00001
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
11 12 13 14 15
|
|
11 8PY 0.02683
|
|
12 8PZ 0.00000 0.03925
|
|
13 9PX 0.00000 0.00000 0.06417
|
|
14 9PY 0.04149 0.00000 0.00000 0.06417
|
|
15 9PZ 0.00000 0.06039 0.00000 0.00000 0.09294
|
|
16 10PX 0.00000 0.00000 0.05045 0.00000 0.00000
|
|
17 10PY 0.03262 0.00000 0.00000 0.05045 0.00000
|
|
18 10PZ 0.00000 0.06223 0.00000 0.00000 0.09570
|
|
19 11PX 0.00000 0.00000 0.01326 0.00000 0.00000
|
|
20 11PY 0.00857 0.00000 0.00000 0.01326 0.00000
|
|
21 11PZ 0.00000 0.04426 0.00000 0.00000 0.06801
|
|
22 12D 0 0.00000 -0.00008 0.00000 0.00000 -0.00012
|
|
23 12D+1 0.00000 0.00000 -0.00035 0.00000 0.00000
|
|
24 12D-1 -0.00023 0.00000 0.00000 -0.00035 0.00000
|
|
25 12D+2 -0.00019 0.00000 0.00000 -0.00029 0.00000
|
|
26 12D-2 0.00000 0.00000 -0.00029 0.00000 0.00000
|
|
27 13D 0 0.00000 -0.00041 0.00000 0.00000 -0.00063
|
|
28 13D+1 0.00000 0.00000 -0.00171 0.00000 0.00000
|
|
29 13D-1 -0.00111 0.00000 0.00000 -0.00171 0.00000
|
|
30 13D+2 -0.00085 0.00000 0.00000 -0.00131 0.00000
|
|
31 13D-2 0.00000 0.00000 -0.00131 0.00000 0.00000
|
|
32 14D 0 0.00000 -0.00138 0.00000 0.00000 -0.00211
|
|
33 14D+1 0.00000 0.00000 -0.00563 0.00000 0.00000
|
|
34 14D-1 -0.00364 0.00000 0.00000 -0.00563 0.00000
|
|
35 14D+2 -0.00292 0.00000 0.00000 -0.00452 0.00000
|
|
36 14D-2 0.00000 0.00000 -0.00452 0.00000 0.00000
|
|
37 15D 0 0.00000 -0.00212 0.00000 0.00000 -0.00326
|
|
38 15D+1 0.00000 0.00000 -0.00357 0.00000 0.00000
|
|
39 15D-1 -0.00231 0.00000 0.00000 -0.00357 0.00000
|
|
40 15D+2 -0.00220 0.00000 0.00000 -0.00340 0.00000
|
|
41 15D-2 0.00000 0.00000 -0.00340 0.00000 0.00000
|
|
42 16F 0 0.00000 -0.00009 0.00000 0.00000 -0.00014
|
|
43 16F+1 0.00000 0.00000 -0.00005 0.00000 0.00000
|
|
44 16F-1 -0.00003 0.00000 0.00000 -0.00005 0.00000
|
|
45 16F+2 0.00004 0.00000 0.00000 0.00007 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00007 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00004 0.00000 0.00000 0.00007
|
|
49 17F 0 0.00000 -0.00055 0.00000 0.00000 -0.00086
|
|
50 17F+1 0.00000 0.00000 -0.00037 0.00000 0.00000
|
|
51 17F-1 -0.00024 0.00000 0.00000 -0.00037 0.00000
|
|
52 17F+2 0.00037 0.00000 0.00000 0.00057 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00057 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00024 0.00000 0.00000 0.00038
|
|
56 18F 0 0.00000 -0.00040 0.00000 0.00000 -0.00063
|
|
57 18F+1 0.00000 0.00000 -0.00046 0.00000 0.00000
|
|
58 18F-1 -0.00029 0.00000 0.00000 -0.00046 0.00000
|
|
59 18F+2 0.00063 0.00000 0.00000 0.00097 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00097 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00023 0.00000 0.00000 0.00037
|
|
63 19G 0 0.00000 0.00004 0.00000 0.00000 0.00007
|
|
64 19G+1 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
65 19G-1 0.00004 0.00000 0.00000 0.00006 0.00000
|
|
66 19G+2 0.00001 0.00000 0.00000 0.00001 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 -0.00005 0.00000 0.00000 -0.00008
|
|
70 19G+4 0.00004 0.00000 0.00000 0.00006 0.00000
|
|
71 19G-4 0.00000 0.00000 -0.00006 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00018 0.00000 0.00000 0.00028
|
|
73 20G+1 0.00000 0.00000 0.00039 0.00000 0.00000
|
|
74 20G-1 0.00025 0.00000 0.00000 0.00039 0.00000
|
|
75 20G+2 0.00001 0.00000 0.00000 0.00002 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 -0.00016 0.00000 0.00000 -0.00026
|
|
79 20G+4 0.00030 0.00000 0.00000 0.00046 0.00000
|
|
80 20G-4 0.00000 0.00000 -0.00046 0.00000 0.00000
|
|
81 21H 0 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
82 21H+1 0.00000 0.00000 -0.00003 0.00000 0.00000
|
|
83 21H-1 -0.00002 0.00000 0.00000 -0.00003 0.00000
|
|
84 21H+2 -0.00003 0.00000 0.00000 -0.00005 0.00000
|
|
85 21H-2 0.00000 0.00000 -0.00005 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00006 0.00000 0.00000 0.00009
|
|
88 21H+4 -0.00008 0.00000 0.00000 -0.00012 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00012 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
91 21H-5 0.00002 0.00000 0.00000 0.00002 0.00000
|
|
92 2 H 1S 0.00648 -0.00259 0.00000 0.01002 -0.00405
|
|
93 2S 0.01535 -0.00658 0.00000 0.02374 -0.01026
|
|
94 3S 0.02842 -0.01117 0.00000 0.04396 -0.01743
|
|
95 4S 0.02593 0.00880 0.00000 0.04010 0.01341
|
|
96 5S 0.00509 -0.00108 0.00000 0.00788 -0.00167
|
|
97 6PX 0.00000 0.00000 0.00018 0.00000 0.00000
|
|
98 6PY -0.00023 0.00013 0.00000 -0.00036 0.00021
|
|
99 6PZ 0.00014 0.00015 0.00000 0.00022 0.00022
|
|
100 7PX 0.00000 0.00000 0.00068 0.00000 0.00000
|
|
101 7PY -0.00067 0.00073 0.00000 -0.00103 0.00113
|
|
102 7PZ 0.00043 0.00048 0.00000 0.00067 0.00073
|
|
103 8PX 0.00000 0.00000 0.00243 0.00000 0.00000
|
|
104 8PY -0.00194 0.00077 0.00000 -0.00299 0.00123
|
|
105 8PZ 0.00137 0.00247 0.00000 0.00211 0.00377
|
|
106 9PX 0.00000 0.00000 0.00313 0.00000 0.00000
|
|
107 9PY -0.00183 -0.00490 0.00000 -0.00283 -0.00752
|
|
108 9PZ 0.00067 0.00490 0.00000 0.00104 0.00752
|
|
109 10D 0 -0.00002 0.00008 0.00000 -0.00003 0.00013
|
|
110 10D+1 0.00000 0.00000 0.00004 0.00000 0.00000
|
|
111 10D-1 -0.00009 -0.00003 0.00000 -0.00013 -0.00005
|
|
112 10D+2 -0.00007 0.00006 0.00000 -0.00011 0.00010
|
|
113 10D-2 0.00000 0.00000 -0.00011 0.00000 0.00000
|
|
114 11D 0 -0.00003 0.00020 0.00000 -0.00005 0.00030
|
|
115 11D+1 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
116 11D-1 -0.00024 -0.00017 0.00000 -0.00037 -0.00026
|
|
117 11D+2 -0.00020 0.00023 0.00000 -0.00031 0.00035
|
|
118 11D-2 0.00000 0.00000 -0.00027 0.00000 0.00000
|
|
119 12D 0 -0.00019 0.00021 0.00000 -0.00030 0.00032
|
|
120 12D+1 0.00000 0.00000 0.00018 0.00000 0.00000
|
|
121 12D-1 -0.00034 -0.00110 0.00000 -0.00053 -0.00169
|
|
122 12D+2 -0.00027 -0.00102 0.00000 -0.00042 -0.00156
|
|
123 12D-2 0.00000 0.00000 -0.00083 0.00000 0.00000
|
|
124 13F 0 -0.00003 0.00001 0.00000 -0.00004 0.00001
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 -0.00005 0.00000 -0.00001 -0.00007
|
|
127 13F+2 -0.00004 -0.00001 0.00000 -0.00006 -0.00001
|
|
128 13F-2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 -0.00004 0.00000 0.00000
|
|
130 13F-3 0.00003 -0.00005 0.00000 0.00005 -0.00007
|
|
131 14F 0 -0.00009 -0.00008 0.00000 -0.00014 -0.00012
|
|
132 14F+1 0.00000 0.00000 -0.00004 0.00000 0.00000
|
|
133 14F-1 0.00003 -0.00005 0.00000 0.00005 -0.00007
|
|
134 14F+2 -0.00011 -0.00011 0.00000 -0.00017 -0.00017
|
|
135 14F-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 -0.00007 0.00000 0.00000
|
|
137 14F-3 0.00009 0.00019 0.00000 0.00014 0.00029
|
|
138 15G 0 -0.00001 -0.00001 0.00000 -0.00001 -0.00002
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00002 0.00000 0.00000 0.00003 0.00001
|
|
141 15G+2 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
144 15G-3 0.00002 0.00001 0.00000 0.00002 0.00002
|
|
145 15G+4 0.00001 0.00001 0.00000 0.00002 0.00001
|
|
146 15G-4 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
147 3 H 1S -0.00324 -0.00259 0.00868 -0.00501 -0.00405
|
|
148 2S -0.00768 -0.00658 0.02056 -0.01187 -0.01026
|
|
149 3S -0.01421 -0.01117 0.03807 -0.02198 -0.01743
|
|
150 4S -0.01296 0.00880 0.03473 -0.02005 0.01341
|
|
151 5S -0.00255 -0.00108 0.00682 -0.00394 -0.00167
|
|
152 6PX 0.00015 0.00012 -0.00022 0.00023 0.00018
|
|
153 6PY 0.00003 -0.00007 0.00023 0.00005 -0.00010
|
|
154 6PZ -0.00007 0.00015 0.00019 -0.00011 0.00022
|
|
155 7PX 0.00048 0.00063 -0.00060 0.00074 0.00098
|
|
156 7PY 0.00016 -0.00036 0.00074 0.00025 -0.00056
|
|
157 7PZ -0.00022 0.00048 0.00058 -0.00034 0.00073
|
|
158 8PX 0.00152 0.00067 -0.00164 0.00235 0.00107
|
|
159 8PY 0.00069 -0.00039 0.00235 0.00107 -0.00062
|
|
160 8PZ -0.00068 0.00247 0.00183 -0.00106 0.00377
|
|
161 9PX 0.00167 -0.00425 -0.00134 0.00258 -0.00651
|
|
162 9PY 0.00106 0.00245 0.00258 0.00164 0.00376
|
|
163 9PZ -0.00034 0.00490 0.00090 -0.00052 0.00752
|
|
164 10D 0 0.00001 0.00008 -0.00002 0.00001 0.00013
|
|
165 10D+1 0.00005 -0.00003 -0.00009 0.00008 -0.00005
|
|
166 10D-1 0.00000 0.00002 0.00008 0.00000 0.00003
|
|
167 10D+2 -0.00007 -0.00003 0.00000 -0.00011 -0.00005
|
|
168 10D-2 0.00000 0.00006 -0.00011 0.00000 0.00009
|
|
169 11D 0 0.00002 0.00020 -0.00004 0.00003 0.00030
|
|
170 11D+1 0.00011 -0.00015 -0.00027 0.00018 -0.00022
|
|
171 11D-1 -0.00005 0.00009 0.00018 -0.00007 0.00013
|
|
172 11D+2 -0.00018 -0.00011 0.00002 -0.00028 -0.00018
|
|
173 11D-2 0.00001 0.00020 -0.00030 0.00002 0.00031
|
|
174 12D 0 0.00010 0.00021 -0.00026 0.00015 0.00032
|
|
175 12D+1 0.00020 -0.00096 -0.00035 0.00031 -0.00146
|
|
176 12D-1 0.00000 0.00055 0.00031 0.00000 0.00085
|
|
177 12D+2 -0.00047 0.00051 -0.00018 -0.00073 0.00078
|
|
178 12D-2 -0.00012 -0.00088 -0.00052 -0.00018 -0.00135
|
|
179 13F 0 0.00001 0.00001 -0.00004 0.00002 0.00001
|
|
180 13F+1 0.00000 -0.00004 -0.00001 0.00000 -0.00006
|
|
181 13F-1 0.00000 0.00002 0.00000 0.00000 0.00004
|
|
182 13F+2 -0.00002 0.00000 0.00002 -0.00003 0.00001
|
|
183 13F-2 0.00001 -0.00001 -0.00005 0.00002 -0.00001
|
|
184 13F+3 0.00002 0.00000 0.00002 0.00004 0.00000
|
|
185 13F-3 -0.00002 -0.00005 0.00004 -0.00002 -0.00007
|
|
186 14F 0 0.00004 -0.00008 -0.00012 0.00007 -0.00012
|
|
187 14F+1 -0.00003 -0.00004 0.00003 -0.00004 -0.00006
|
|
188 14F-1 -0.00001 0.00002 -0.00004 -0.00002 0.00004
|
|
189 14F+2 -0.00003 0.00006 0.00007 -0.00005 0.00009
|
|
190 14F-2 0.00004 -0.00010 -0.00013 0.00007 -0.00015
|
|
191 14F+3 0.00004 0.00000 0.00003 0.00006 0.00000
|
|
192 14F-3 -0.00005 0.00019 0.00012 -0.00007 0.00029
|
|
193 15G 0 0.00000 -0.00001 -0.00001 0.00000 -0.00002
|
|
194 15G+1 -0.00001 0.00000 0.00002 -0.00001 0.00001
|
|
195 15G-1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
197 15G-2 0.00000 -0.00001 0.00000 0.00000 -0.00001
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 -0.00001 0.00001 0.00002 -0.00001 0.00002
|
|
200 15G+4 0.00000 0.00000 -0.00001 0.00000 -0.00001
|
|
201 15G-4 0.00001 -0.00001 -0.00001 0.00001 -0.00001
|
|
202 4 H 1S -0.00324 -0.00259 -0.00868 -0.00501 -0.00405
|
|
203 2S -0.00768 -0.00658 -0.02056 -0.01187 -0.01026
|
|
204 3S -0.01421 -0.01117 -0.03807 -0.02198 -0.01743
|
|
205 4S -0.01296 0.00880 -0.03473 -0.02005 0.01341
|
|
206 5S -0.00255 -0.00108 -0.00682 -0.00394 -0.00167
|
|
207 6PX -0.00015 -0.00012 -0.00022 -0.00023 -0.00018
|
|
208 6PY 0.00003 -0.00007 -0.00023 0.00005 -0.00010
|
|
209 6PZ -0.00007 0.00015 -0.00019 -0.00011 0.00022
|
|
210 7PX -0.00048 -0.00063 -0.00060 -0.00074 -0.00098
|
|
211 7PY 0.00016 -0.00036 -0.00074 0.00025 -0.00056
|
|
212 7PZ -0.00022 0.00048 -0.00058 -0.00034 0.00073
|
|
213 8PX -0.00152 -0.00067 -0.00164 -0.00235 -0.00107
|
|
214 8PY 0.00069 -0.00039 -0.00235 0.00107 -0.00062
|
|
215 8PZ -0.00068 0.00247 -0.00183 -0.00106 0.00377
|
|
216 9PX -0.00167 0.00425 -0.00134 -0.00258 0.00651
|
|
217 9PY 0.00106 0.00245 -0.00258 0.00164 0.00376
|
|
218 9PZ -0.00034 0.00490 -0.00090 -0.00052 0.00752
|
|
219 10D 0 0.00001 0.00008 0.00002 0.00001 0.00013
|
|
220 10D+1 -0.00005 0.00003 -0.00009 -0.00008 0.00005
|
|
221 10D-1 0.00000 0.00002 -0.00008 0.00000 0.00003
|
|
222 10D+2 -0.00007 -0.00003 0.00000 -0.00011 -0.00005
|
|
223 10D-2 0.00000 -0.00006 -0.00011 0.00000 -0.00009
|
|
224 11D 0 0.00002 0.00020 0.00004 0.00003 0.00030
|
|
225 11D+1 -0.00011 0.00015 -0.00027 -0.00018 0.00022
|
|
226 11D-1 -0.00005 0.00009 -0.00018 -0.00007 0.00013
|
|
227 11D+2 -0.00018 -0.00011 -0.00002 -0.00028 -0.00018
|
|
228 11D-2 -0.00001 -0.00020 -0.00030 -0.00002 -0.00031
|
|
229 12D 0 0.00010 0.00021 0.00026 0.00015 0.00032
|
|
230 12D+1 -0.00020 0.00096 -0.00035 -0.00031 0.00146
|
|
231 12D-1 0.00000 0.00055 -0.00031 0.00000 0.00085
|
|
232 12D+2 -0.00047 0.00051 0.00018 -0.00073 0.00078
|
|
233 12D-2 0.00012 0.00088 -0.00052 0.00018 0.00135
|
|
234 13F 0 0.00001 0.00001 0.00004 0.00002 0.00001
|
|
235 13F+1 0.00000 0.00004 -0.00001 0.00000 0.00006
|
|
236 13F-1 0.00000 0.00002 0.00000 0.00000 0.00004
|
|
237 13F+2 -0.00002 0.00000 -0.00002 -0.00003 0.00001
|
|
238 13F-2 -0.00001 0.00001 -0.00005 -0.00002 0.00001
|
|
239 13F+3 -0.00002 0.00000 0.00002 -0.00004 0.00000
|
|
240 13F-3 -0.00002 -0.00005 -0.00004 -0.00002 -0.00007
|
|
241 14F 0 0.00004 -0.00008 0.00012 0.00007 -0.00012
|
|
242 14F+1 0.00003 0.00004 0.00003 0.00004 0.00006
|
|
243 14F-1 -0.00001 0.00002 0.00004 -0.00002 0.00004
|
|
244 14F+2 -0.00003 0.00006 -0.00007 -0.00005 0.00009
|
|
245 14F-2 -0.00004 0.00010 -0.00013 -0.00007 0.00015
|
|
246 14F+3 -0.00004 0.00000 0.00003 -0.00006 0.00000
|
|
247 14F-3 -0.00005 0.00019 -0.00012 -0.00007 0.00029
|
|
248 15G 0 0.00000 -0.00001 0.00001 0.00000 -0.00002
|
|
249 15G+1 0.00001 0.00000 0.00002 0.00001 -0.00001
|
|
250 15G-1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
252 15G-2 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 -0.00001 0.00001 -0.00002 -0.00001 0.00002
|
|
255 15G+4 0.00000 0.00000 0.00001 0.00000 -0.00001
|
|
256 15G-4 -0.00001 0.00001 -0.00001 -0.00001 0.00001
|
|
16 17 18 19 20
|
|
16 10PX 0.03967
|
|
17 10PY 0.00000 0.03967
|
|
18 10PZ 0.00000 0.00000 0.09905
|
|
19 11PX 0.01043 0.00000 0.00000 0.00274
|
|
20 11PY 0.00000 0.01043 0.00000 0.00000 0.00274
|
|
21 11PZ 0.00000 0.00000 0.07075 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 -0.00013 0.00000 0.00000
|
|
23 12D+1 -0.00028 0.00000 0.00000 -0.00007 0.00000
|
|
24 12D-1 0.00000 -0.00028 0.00000 0.00000 -0.00007
|
|
25 12D+2 0.00000 -0.00023 0.00000 0.00000 -0.00006
|
|
26 12D-2 -0.00023 0.00000 0.00000 -0.00006 0.00000
|
|
27 13D 0 0.00000 0.00000 -0.00069 0.00000 0.00000
|
|
28 13D+1 -0.00135 0.00000 0.00000 -0.00035 0.00000
|
|
29 13D-1 0.00000 -0.00135 0.00000 0.00000 -0.00035
|
|
30 13D+2 0.00000 -0.00103 0.00000 0.00000 -0.00027
|
|
31 13D-2 -0.00103 0.00000 0.00000 -0.00027 0.00000
|
|
32 14D 0 0.00000 0.00000 -0.00229 0.00000 0.00000
|
|
33 14D+1 -0.00443 0.00000 0.00000 -0.00116 0.00000
|
|
34 14D-1 0.00000 -0.00443 0.00000 0.00000 -0.00116
|
|
35 14D+2 0.00000 -0.00355 0.00000 0.00000 -0.00093
|
|
36 14D-2 -0.00355 0.00000 0.00000 -0.00093 0.00000
|
|
37 15D 0 0.00000 0.00000 -0.00340 0.00000 0.00000
|
|
38 15D+1 -0.00281 0.00000 0.00000 -0.00074 0.00000
|
|
39 15D-1 0.00000 -0.00281 0.00000 0.00000 -0.00074
|
|
40 15D+2 0.00000 -0.00267 0.00000 0.00000 -0.00070
|
|
41 15D-2 -0.00267 0.00000 0.00000 -0.00070 0.00000
|
|
42 16F 0 0.00000 0.00000 -0.00014 0.00000 0.00000
|
|
43 16F+1 -0.00004 0.00000 0.00000 -0.00001 0.00000
|
|
44 16F-1 0.00000 -0.00004 0.00000 0.00000 -0.00001
|
|
45 16F+2 0.00000 0.00005 0.00000 0.00000 0.00001
|
|
46 16F-2 0.00005 0.00000 0.00000 0.00001 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 -0.00084 0.00000 0.00000
|
|
50 17F+1 -0.00029 0.00000 0.00000 -0.00008 0.00000
|
|
51 17F-1 0.00000 -0.00029 0.00000 0.00000 -0.00008
|
|
52 17F+2 0.00000 0.00045 0.00000 0.00000 0.00012
|
|
53 17F-2 0.00045 0.00000 0.00000 0.00012 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00033 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 -0.00059 0.00000 0.00000
|
|
57 18F+1 -0.00036 0.00000 0.00000 -0.00009 0.00000
|
|
58 18F-1 0.00000 -0.00036 0.00000 0.00000 -0.00009
|
|
59 18F+2 0.00000 0.00076 0.00000 0.00000 0.00020
|
|
60 18F-2 0.00076 0.00000 0.00000 0.00020 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00031 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00007 0.00000 0.00000
|
|
64 19G+1 0.00005 0.00000 0.00000 0.00001 0.00000
|
|
65 19G-1 0.00000 0.00005 0.00000 0.00000 0.00001
|
|
66 19G+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 -0.00007 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00005 0.00000 0.00000 0.00001
|
|
71 19G-4 -0.00005 0.00000 0.00000 -0.00001 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00027 0.00000 0.00000
|
|
73 20G+1 0.00031 0.00000 0.00000 0.00008 0.00000
|
|
74 20G-1 0.00000 0.00031 0.00000 0.00000 0.00008
|
|
75 20G+2 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 -0.00023 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00036 0.00000 0.00000 0.00010
|
|
80 20G-4 -0.00036 0.00000 0.00000 -0.00010 0.00000
|
|
81 21H 0 0.00000 0.00000 -0.00003 0.00000 0.00000
|
|
82 21H+1 -0.00002 0.00000 0.00000 -0.00001 0.00000
|
|
83 21H-1 0.00000 -0.00002 0.00000 0.00000 -0.00001
|
|
84 21H+2 0.00000 -0.00004 0.00000 0.00000 -0.00001
|
|
85 21H-2 -0.00004 0.00000 0.00000 -0.00001 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00009 0.00000 0.00000
|
|
88 21H+4 0.00000 -0.00009 0.00000 0.00000 -0.00002
|
|
89 21H-4 0.00009 0.00000 0.00000 0.00002 0.00000
|
|
90 21H+5 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00788 -0.00373 0.00000 0.00207
|
|
93 2S 0.00000 0.01867 -0.00959 0.00000 0.00491
|
|
94 3S 0.00000 0.03456 -0.01621 0.00000 0.00908
|
|
95 4S 0.00000 0.03153 0.01472 0.00000 0.00829
|
|
96 5S 0.00000 0.00620 -0.00171 0.00000 0.00163
|
|
97 6PX 0.00014 0.00000 0.00000 0.00004 0.00000
|
|
98 6PY 0.00000 -0.00028 0.00019 0.00000 -0.00007
|
|
99 6PZ 0.00000 0.00018 0.00024 0.00000 0.00005
|
|
100 7PX 0.00054 0.00000 0.00000 0.00014 0.00000
|
|
101 7PY 0.00000 -0.00081 0.00108 0.00000 -0.00021
|
|
102 7PZ 0.00000 0.00053 0.00079 0.00000 0.00014
|
|
103 8PX 0.00191 0.00000 0.00000 0.00050 0.00000
|
|
104 8PY 0.00000 -0.00235 0.00096 0.00000 -0.00062
|
|
105 8PZ 0.00000 0.00166 0.00405 0.00000 0.00044
|
|
106 9PX 0.00246 0.00000 0.00000 0.00065 0.00000
|
|
107 9PY 0.00000 -0.00223 -0.00796 0.00000 -0.00059
|
|
108 9PZ 0.00000 0.00082 0.00785 0.00000 0.00022
|
|
109 10D 0 0.00000 -0.00002 0.00013 0.00000 -0.00001
|
|
110 10D+1 0.00003 0.00000 0.00000 0.00001 0.00000
|
|
111 10D-1 0.00000 -0.00010 -0.00006 0.00000 -0.00003
|
|
112 10D+2 0.00000 -0.00009 0.00010 0.00000 -0.00002
|
|
113 10D-2 -0.00008 0.00000 0.00000 -0.00002 0.00000
|
|
114 11D 0 0.00000 -0.00004 0.00030 0.00000 -0.00001
|
|
115 11D+1 0.00002 0.00000 0.00000 0.00001 0.00000
|
|
116 11D-1 0.00000 -0.00029 -0.00030 0.00000 -0.00008
|
|
117 11D+2 0.00000 -0.00024 0.00034 0.00000 -0.00006
|
|
118 11D-2 -0.00021 0.00000 0.00000 -0.00006 0.00000
|
|
119 12D 0 0.00000 -0.00023 0.00031 0.00000 -0.00006
|
|
120 12D+1 0.00014 0.00000 0.00000 0.00004 0.00000
|
|
121 12D-1 0.00000 -0.00042 -0.00179 0.00000 -0.00011
|
|
122 12D+2 0.00000 -0.00033 -0.00167 0.00000 -0.00009
|
|
123 12D-2 -0.00065 0.00000 0.00000 -0.00017 0.00000
|
|
124 13F 0 0.00000 -0.00003 0.00001 0.00000 -0.00001
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 -0.00007 0.00000 0.00000
|
|
127 13F+2 0.00000 -0.00005 -0.00001 0.00000 -0.00001
|
|
128 13F-2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 -0.00003 0.00000 0.00000 -0.00001 0.00000
|
|
130 13F-3 0.00000 0.00004 -0.00007 0.00000 0.00001
|
|
131 14F 0 0.00000 -0.00011 -0.00014 0.00000 -0.00003
|
|
132 14F+1 -0.00004 0.00000 0.00000 -0.00001 0.00000
|
|
133 14F-1 0.00000 0.00004 -0.00007 0.00000 0.00001
|
|
134 14F+2 0.00000 -0.00014 -0.00019 0.00000 -0.00004
|
|
135 14F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 -0.00005 0.00000 0.00000 -0.00001 0.00000
|
|
137 14F-3 0.00000 0.00011 0.00031 0.00000 0.00003
|
|
138 15G 0 0.00000 -0.00001 -0.00002 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00002 0.00001 0.00000 0.00001
|
|
141 15G+2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00002 0.00002 0.00000 0.00001
|
|
145 15G+4 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
146 15G-4 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00682 -0.00394 -0.00373 0.00179 -0.00104
|
|
148 2S 0.01617 -0.00933 -0.00959 0.00425 -0.00245
|
|
149 3S 0.02993 -0.01728 -0.01621 0.00787 -0.00454
|
|
150 4S 0.02730 -0.01576 0.01472 0.00718 -0.00414
|
|
151 5S 0.00537 -0.00310 -0.00171 0.00141 -0.00081
|
|
152 6PX -0.00018 0.00018 0.00016 -0.00005 0.00005
|
|
153 6PY 0.00018 0.00004 -0.00010 0.00005 0.00001
|
|
154 6PZ 0.00015 -0.00009 0.00024 0.00004 -0.00002
|
|
155 7PX -0.00047 0.00058 0.00093 -0.00012 0.00015
|
|
156 7PY 0.00058 0.00020 -0.00054 0.00015 0.00005
|
|
157 7PZ 0.00046 -0.00026 0.00079 0.00012 -0.00007
|
|
158 8PX -0.00129 0.00185 0.00083 -0.00034 0.00049
|
|
159 8PY 0.00185 0.00084 -0.00048 0.00049 0.00022
|
|
160 8PZ 0.00144 -0.00083 0.00405 0.00038 -0.00022
|
|
161 9PX -0.00105 0.00203 -0.00689 -0.00028 0.00053
|
|
162 9PY 0.00203 0.00129 0.00398 0.00053 0.00034
|
|
163 9PZ 0.00071 -0.00041 0.00785 0.00019 -0.00011
|
|
164 10D 0 -0.00002 0.00001 0.00013 -0.00001 0.00000
|
|
165 10D+1 -0.00007 0.00006 -0.00005 -0.00002 0.00002
|
|
166 10D-1 0.00006 0.00000 0.00003 0.00002 0.00000
|
|
167 10D+2 0.00000 -0.00008 -0.00005 0.00000 -0.00002
|
|
168 10D-2 -0.00008 0.00000 0.00008 -0.00002 0.00000
|
|
169 11D 0 -0.00003 0.00002 0.00030 -0.00001 0.00001
|
|
170 11D+1 -0.00021 0.00014 -0.00026 -0.00006 0.00004
|
|
171 11D-1 0.00014 -0.00006 0.00015 0.00004 -0.00001
|
|
172 11D+2 0.00001 -0.00022 -0.00017 0.00000 -0.00006
|
|
173 11D-2 -0.00023 0.00001 0.00029 -0.00006 0.00000
|
|
174 12D 0 -0.00020 0.00012 0.00031 -0.00005 0.00003
|
|
175 12D+1 -0.00028 0.00024 -0.00155 -0.00007 0.00006
|
|
176 12D-1 0.00024 0.00000 0.00090 0.00006 0.00000
|
|
177 12D+2 -0.00014 -0.00057 0.00083 -0.00004 -0.00015
|
|
178 12D-2 -0.00041 -0.00014 -0.00145 -0.00011 -0.00004
|
|
179 13F 0 -0.00003 0.00002 0.00001 -0.00001 0.00000
|
|
180 13F+1 0.00000 0.00000 -0.00006 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00004 0.00000 0.00000
|
|
182 13F+2 0.00001 -0.00002 0.00001 0.00000 -0.00001
|
|
183 13F-2 -0.00004 0.00001 -0.00001 -0.00001 0.00000
|
|
184 13F+3 0.00002 0.00003 0.00000 0.00000 0.00001
|
|
185 13F-3 0.00003 -0.00002 -0.00007 0.00001 -0.00001
|
|
186 14F 0 -0.00009 0.00005 -0.00014 -0.00002 0.00001
|
|
187 14F+1 0.00002 -0.00003 -0.00006 0.00001 -0.00001
|
|
188 14F-1 -0.00003 -0.00002 0.00004 -0.00001 0.00000
|
|
189 14F+2 0.00005 -0.00004 0.00010 0.00001 -0.00001
|
|
190 14F-2 -0.00010 0.00005 -0.00016 -0.00003 0.00001
|
|
191 14F+3 0.00003 0.00005 0.00000 0.00001 0.00001
|
|
192 14F-3 0.00010 -0.00006 0.00031 0.00003 -0.00001
|
|
193 15G 0 -0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
194 15G+1 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
195 15G-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00002 -0.00001 0.00002 0.00000 0.00000
|
|
200 15G+4 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
201 15G-4 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
202 4 H 1S -0.00682 -0.00394 -0.00373 -0.00179 -0.00104
|
|
203 2S -0.01617 -0.00933 -0.00959 -0.00425 -0.00245
|
|
204 3S -0.02993 -0.01728 -0.01621 -0.00787 -0.00454
|
|
205 4S -0.02730 -0.01576 0.01472 -0.00718 -0.00414
|
|
206 5S -0.00537 -0.00310 -0.00171 -0.00141 -0.00081
|
|
207 6PX -0.00018 -0.00018 -0.00016 -0.00005 -0.00005
|
|
208 6PY -0.00018 0.00004 -0.00010 -0.00005 0.00001
|
|
209 6PZ -0.00015 -0.00009 0.00024 -0.00004 -0.00002
|
|
210 7PX -0.00047 -0.00058 -0.00093 -0.00012 -0.00015
|
|
211 7PY -0.00058 0.00020 -0.00054 -0.00015 0.00005
|
|
212 7PZ -0.00046 -0.00026 0.00079 -0.00012 -0.00007
|
|
213 8PX -0.00129 -0.00185 -0.00083 -0.00034 -0.00049
|
|
214 8PY -0.00185 0.00084 -0.00048 -0.00049 0.00022
|
|
215 8PZ -0.00144 -0.00083 0.00405 -0.00038 -0.00022
|
|
216 9PX -0.00105 -0.00203 0.00689 -0.00028 -0.00053
|
|
217 9PY -0.00203 0.00129 0.00398 -0.00053 0.00034
|
|
218 9PZ -0.00071 -0.00041 0.00785 -0.00019 -0.00011
|
|
219 10D 0 0.00002 0.00001 0.00013 0.00001 0.00000
|
|
220 10D+1 -0.00007 -0.00006 0.00005 -0.00002 -0.00002
|
|
221 10D-1 -0.00006 0.00000 0.00003 -0.00002 0.00000
|
|
222 10D+2 0.00000 -0.00008 -0.00005 0.00000 -0.00002
|
|
223 10D-2 -0.00008 0.00000 -0.00008 -0.00002 0.00000
|
|
224 11D 0 0.00003 0.00002 0.00030 0.00001 0.00001
|
|
225 11D+1 -0.00021 -0.00014 0.00026 -0.00006 -0.00004
|
|
226 11D-1 -0.00014 -0.00006 0.00015 -0.00004 -0.00001
|
|
227 11D+2 -0.00001 -0.00022 -0.00017 0.00000 -0.00006
|
|
228 11D-2 -0.00023 -0.00001 -0.00029 -0.00006 0.00000
|
|
229 12D 0 0.00020 0.00012 0.00031 0.00005 0.00003
|
|
230 12D+1 -0.00028 -0.00024 0.00155 -0.00007 -0.00006
|
|
231 12D-1 -0.00024 0.00000 0.00090 -0.00006 0.00000
|
|
232 12D+2 0.00014 -0.00057 0.00083 0.00004 -0.00015
|
|
233 12D-2 -0.00041 0.00014 0.00145 -0.00011 0.00004
|
|
234 13F 0 0.00003 0.00002 0.00001 0.00001 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00004 0.00000 0.00000
|
|
237 13F+2 -0.00001 -0.00002 0.00001 0.00000 -0.00001
|
|
238 13F-2 -0.00004 -0.00001 0.00001 -0.00001 0.00000
|
|
239 13F+3 0.00002 -0.00003 0.00000 0.00000 -0.00001
|
|
240 13F-3 -0.00003 -0.00002 -0.00007 -0.00001 -0.00001
|
|
241 14F 0 0.00009 0.00005 -0.00014 0.00002 0.00001
|
|
242 14F+1 0.00002 0.00003 0.00006 0.00001 0.00001
|
|
243 14F-1 0.00003 -0.00002 0.00004 0.00001 0.00000
|
|
244 14F+2 -0.00005 -0.00004 0.00010 -0.00001 -0.00001
|
|
245 14F-2 -0.00010 -0.00005 0.00016 -0.00003 -0.00001
|
|
246 14F+3 0.00003 -0.00005 0.00000 0.00001 -0.00001
|
|
247 14F-3 -0.00010 -0.00006 0.00031 -0.00003 -0.00001
|
|
248 15G 0 0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
249 15G+1 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
250 15G-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 -0.00002 -0.00001 0.00002 0.00000 0.00000
|
|
255 15G+4 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
256 15G-4 -0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
21 22 23 24 25
|
|
21 11PZ 0.05079
|
|
22 12D 0 -0.00009 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 -0.00052 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
31 13D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
32 14D 0 -0.00171 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00003 0.00003
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
36 14D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
37 15D 0 -0.00245 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
41 15D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
42 16F 0 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 -0.00056 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00019 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 -0.00038 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
60 18F-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00017 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00005 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00018 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 -0.00014 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00006 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S -0.00234 0.00000 0.00000 -0.00005 -0.00005
|
|
93 2S -0.00612 0.00001 0.00000 -0.00013 -0.00011
|
|
94 3S -0.01029 0.00001 0.00000 -0.00024 -0.00020
|
|
95 4S 0.01111 -0.00002 0.00000 -0.00022 -0.00018
|
|
96 5S -0.00121 0.00000 0.00000 -0.00004 -0.00004
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00018 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00070 0.00000 0.00000 0.00001 0.00000
|
|
102 7PZ 0.00059 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
104 8PY 0.00047 0.00000 0.00000 0.00002 0.00001
|
|
105 8PZ 0.00299 -0.00001 0.00000 -0.00001 -0.00001
|
|
106 9PX 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
107 9PY -0.00581 0.00001 0.00000 0.00002 0.00001
|
|
108 9PZ 0.00565 -0.00001 0.00000 -0.00001 0.00000
|
|
109 10D 0 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00006 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 -0.00024 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00022 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 -0.00131 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 -0.00123 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 -0.00014 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00022 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00234 0.00000 -0.00005 0.00003 0.00002
|
|
148 2S -0.00612 0.00001 -0.00011 0.00006 0.00005
|
|
149 3S -0.01029 0.00001 -0.00021 0.00012 0.00010
|
|
150 4S 0.01111 -0.00002 -0.00019 0.00011 0.00009
|
|
151 5S -0.00121 0.00000 -0.00004 0.00002 0.00002
|
|
152 6PX 0.00010 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY -0.00006 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00018 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00061 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY -0.00035 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00059 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00040 0.00000 0.00001 -0.00001 -0.00001
|
|
159 8PY -0.00023 0.00000 -0.00001 -0.00001 0.00000
|
|
160 8PZ 0.00299 -0.00001 -0.00001 0.00001 0.00000
|
|
161 9PX -0.00503 0.00001 0.00001 -0.00001 -0.00001
|
|
162 9PY 0.00291 -0.00001 -0.00001 -0.00001 -0.00001
|
|
163 9PZ 0.00565 -0.00001 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00006 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 -0.00021 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 -0.00011 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00019 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 -0.00114 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00066 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00062 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 -0.00107 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00007 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 -0.00012 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00022 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00234 0.00000 0.00005 0.00003 0.00002
|
|
203 2S -0.00612 0.00001 0.00011 0.00006 0.00005
|
|
204 3S -0.01029 0.00001 0.00021 0.00012 0.00010
|
|
205 4S 0.01111 -0.00002 0.00019 0.00011 0.00009
|
|
206 5S -0.00121 0.00000 0.00004 0.00002 0.00002
|
|
207 6PX -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY -0.00006 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00018 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX -0.00061 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY -0.00035 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00059 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX -0.00040 0.00000 0.00001 0.00001 0.00001
|
|
214 8PY -0.00023 0.00000 0.00001 -0.00001 0.00000
|
|
215 8PZ 0.00299 -0.00001 0.00001 0.00001 0.00000
|
|
216 9PX 0.00503 -0.00001 0.00001 0.00001 0.00001
|
|
217 9PY 0.00291 -0.00001 0.00001 -0.00001 -0.00001
|
|
218 9PZ 0.00565 -0.00001 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 -0.00006 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 -0.00011 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 -0.00019 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00114 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00066 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00062 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00107 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00005 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00005 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00007 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00022 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
26 27 28 29 30
|
|
26 12D-2 0.00000
|
|
27 13D 0 0.00000 0.00001
|
|
28 13D+1 0.00001 0.00000 0.00005
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00005
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00003 0.00003
|
|
31 13D-2 0.00001 0.00000 0.00003 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00003 0.00000 0.00015 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00015 0.00011
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00012 0.00009
|
|
36 14D-2 0.00002 0.00000 0.00012 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00002 0.00000 0.00010 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00010 0.00007
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00009 0.00007
|
|
41 15D-2 0.00002 0.00000 0.00009 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
52 17F+2 0.00000 0.00000 0.00000 -0.00002 -0.00001
|
|
53 17F-2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.00003 -0.00002
|
|
60 18F-2 0.00000 0.00000 -0.00003 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
80 20G-4 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00001 0.00000 -0.00027 -0.00020
|
|
93 2S 0.00000 -0.00001 0.00000 -0.00063 -0.00048
|
|
94 3S 0.00000 -0.00003 0.00000 -0.00117 -0.00090
|
|
95 4S 0.00000 -0.00017 0.00000 -0.00107 -0.00082
|
|
96 5S 0.00000 0.00001 0.00000 -0.00021 -0.00016
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
99 6PZ 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
100 7PX 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
102 7PZ 0.00000 -0.00001 0.00000 -0.00002 -0.00001
|
|
103 8PX -0.00001 0.00000 -0.00006 0.00000 0.00000
|
|
104 8PY 0.00000 0.00002 0.00000 0.00008 0.00006
|
|
105 8PZ 0.00000 -0.00004 0.00000 -0.00006 -0.00004
|
|
106 9PX -0.00001 0.00000 -0.00008 0.00000 0.00000
|
|
107 9PY 0.00000 0.00007 0.00000 0.00008 0.00006
|
|
108 9PZ 0.00000 -0.00006 0.00000 -0.00003 -0.00002
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
118 11D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00002 0.00000 0.00001 0.00001
|
|
122 12D+2 0.00000 0.00002 0.00000 0.00001 0.00001
|
|
123 12D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00004 -0.00001 -0.00023 0.00013 0.00010
|
|
148 2S -0.00009 -0.00001 -0.00055 0.00032 0.00024
|
|
149 3S -0.00017 -0.00003 -0.00102 0.00059 0.00045
|
|
150 4S -0.00016 -0.00017 -0.00093 0.00054 0.00041
|
|
151 5S -0.00003 0.00001 -0.00018 0.00011 0.00008
|
|
152 6PX 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
153 6PY 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00002 -0.00002 -0.00002
|
|
156 7PY 0.00000 0.00000 -0.00002 -0.00001 -0.00001
|
|
157 7PZ 0.00000 -0.00001 -0.00002 0.00001 0.00001
|
|
158 8PX 0.00001 0.00001 0.00004 -0.00006 -0.00005
|
|
159 8PY -0.00001 -0.00001 -0.00006 -0.00003 -0.00002
|
|
160 8PZ -0.00001 -0.00004 -0.00005 0.00003 0.00002
|
|
161 9PX 0.00001 0.00006 0.00004 -0.00007 -0.00005
|
|
162 9PY -0.00001 -0.00003 -0.00007 -0.00004 -0.00003
|
|
163 9PZ 0.00000 -0.00006 -0.00002 0.00001 0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
173 11D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00001 0.00001 -0.00001 -0.00001
|
|
176 12D-1 0.00000 -0.00001 -0.00001 0.00000 0.00000
|
|
177 12D+2 0.00000 -0.00001 0.00000 0.00002 0.00001
|
|
178 12D-2 0.00000 0.00001 0.00001 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00004 -0.00001 0.00023 0.00013 0.00010
|
|
203 2S 0.00009 -0.00001 0.00055 0.00032 0.00024
|
|
204 3S 0.00017 -0.00003 0.00102 0.00059 0.00045
|
|
205 4S 0.00016 -0.00017 0.00093 0.00054 0.00041
|
|
206 5S 0.00003 0.00001 0.00018 0.00011 0.00008
|
|
207 6PX 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
208 6PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00002 0.00002 0.00002
|
|
211 7PY 0.00000 0.00000 0.00002 -0.00001 -0.00001
|
|
212 7PZ 0.00000 -0.00001 0.00002 0.00001 0.00001
|
|
213 8PX 0.00001 -0.00001 0.00004 0.00006 0.00005
|
|
214 8PY 0.00001 -0.00001 0.00006 -0.00003 -0.00002
|
|
215 8PZ 0.00001 -0.00004 0.00005 0.00003 0.00002
|
|
216 9PX 0.00001 -0.00006 0.00004 0.00007 0.00005
|
|
217 9PY 0.00001 -0.00003 0.00007 -0.00004 -0.00003
|
|
218 9PZ 0.00000 -0.00006 0.00002 0.00001 0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
228 11D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
230 12D+1 0.00000 -0.00001 0.00001 0.00001 0.00001
|
|
231 12D-1 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
232 12D+2 0.00000 -0.00001 0.00000 0.00002 0.00001
|
|
233 12D-2 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
31 32 33 34 35
|
|
31 13D-2 0.00003
|
|
32 14D 0 0.00000 0.00007
|
|
33 14D+1 0.00011 0.00000 0.00049
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00049
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00040 0.00032
|
|
36 14D-2 0.00009 0.00000 0.00040 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00008 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00007 0.00000 0.00031 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00031 0.00025
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00030 0.00024
|
|
41 15D-2 0.00007 0.00000 0.00030 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
46 16F-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00001 0.00000 0.00003 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00003 0.00003
|
|
52 17F+2 0.00000 0.00000 0.00000 -0.00005 -0.00004
|
|
53 17F-2 -0.00001 0.00000 -0.00005 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00001 0.00000 0.00004 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00004 0.00003
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.00008 -0.00007
|
|
60 18F-2 -0.00002 0.00000 -0.00008 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 -0.00001 0.00000 -0.00003 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 -0.00003 -0.00003
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 -0.00004 -0.00003
|
|
80 20G-4 0.00001 0.00000 0.00004 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
89 21H-4 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00001 0.00000 -0.00088 -0.00071
|
|
93 2S 0.00000 0.00001 0.00000 -0.00208 -0.00167
|
|
94 3S 0.00000 0.00000 0.00000 -0.00386 -0.00309
|
|
95 4S 0.00000 -0.00051 0.00000 -0.00352 -0.00282
|
|
96 5S 0.00000 0.00004 0.00000 -0.00069 -0.00055
|
|
97 6PX 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00003 0.00003
|
|
99 6PZ 0.00000 -0.00001 0.00000 -0.00002 -0.00002
|
|
100 7PX -0.00001 0.00000 -0.00006 0.00000 0.00000
|
|
101 7PY 0.00000 -0.00001 0.00000 0.00009 0.00007
|
|
102 7PZ 0.00000 -0.00003 0.00000 -0.00006 -0.00005
|
|
103 8PX -0.00005 0.00000 -0.00021 0.00000 0.00000
|
|
104 8PY 0.00000 0.00004 0.00000 0.00026 0.00021
|
|
105 8PZ 0.00000 -0.00012 0.00000 -0.00019 -0.00015
|
|
106 9PX -0.00006 0.00000 -0.00027 0.00000 0.00000
|
|
107 9PY 0.00000 0.00022 0.00000 0.00025 0.00020
|
|
108 9PZ 0.00000 -0.00019 0.00000 -0.00009 -0.00007
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
113 10D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00001 0.00000 0.00003 0.00003
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
118 11D-2 0.00001 0.00000 0.00002 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
120 12D+1 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00005 0.00000 0.00005 0.00004
|
|
122 12D+2 0.00000 0.00005 0.00000 0.00004 0.00003
|
|
123 12D-2 0.00002 0.00000 0.00007 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00001 0.00000 0.00002 0.00001
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
137 14F-3 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00018 -0.00001 -0.00076 0.00044 0.00035
|
|
148 2S -0.00042 0.00001 -0.00180 0.00104 0.00084
|
|
149 3S -0.00078 0.00000 -0.00334 0.00193 0.00155
|
|
150 4S -0.00071 -0.00051 -0.00305 0.00176 0.00141
|
|
151 5S -0.00014 0.00004 -0.00060 0.00035 0.00028
|
|
152 6PX 0.00000 0.00000 0.00002 -0.00002 -0.00002
|
|
153 6PY 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
154 6PZ 0.00000 -0.00001 -0.00002 0.00001 0.00001
|
|
155 7PX 0.00001 -0.00001 0.00005 -0.00007 -0.00005
|
|
156 7PY -0.00002 0.00000 -0.00007 -0.00002 -0.00002
|
|
157 7PZ -0.00001 -0.00003 -0.00005 0.00003 0.00002
|
|
158 8PX 0.00003 0.00004 0.00014 -0.00021 -0.00017
|
|
159 8PY -0.00005 -0.00002 -0.00021 -0.00009 -0.00008
|
|
160 8PZ -0.00004 -0.00012 -0.00016 0.00009 0.00007
|
|
161 9PX 0.00003 0.00019 0.00012 -0.00023 -0.00018
|
|
162 9PY -0.00005 -0.00011 -0.00023 -0.00014 -0.00012
|
|
163 9PZ -0.00002 -0.00019 -0.00008 0.00005 0.00004
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00001 -0.00001 -0.00001
|
|
166 10D-1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
168 10D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00001 0.00001 0.00002 -0.00002 -0.00001
|
|
171 11D-1 0.00000 -0.00001 -0.00002 0.00001 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
173 11D-2 0.00001 0.00000 0.00003 0.00000 0.00000
|
|
174 12D 0 0.00001 0.00000 0.00002 -0.00001 -0.00001
|
|
175 12D+1 0.00001 0.00004 0.00003 -0.00003 -0.00002
|
|
176 12D-1 -0.00001 -0.00003 -0.00003 0.00000 0.00000
|
|
177 12D+2 0.00000 -0.00002 0.00002 0.00006 0.00005
|
|
178 12D-2 0.00001 0.00004 0.00005 0.00002 0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00001 0.00001 -0.00001 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
192 14F-3 0.00000 -0.00001 -0.00001 0.00001 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00018 -0.00001 0.00076 0.00044 0.00035
|
|
203 2S 0.00042 0.00001 0.00180 0.00104 0.00084
|
|
204 3S 0.00078 0.00000 0.00334 0.00193 0.00155
|
|
205 4S 0.00071 -0.00051 0.00305 0.00176 0.00141
|
|
206 5S 0.00014 0.00004 0.00060 0.00035 0.00028
|
|
207 6PX 0.00000 0.00000 0.00002 0.00002 0.00002
|
|
208 6PY 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
209 6PZ 0.00000 -0.00001 0.00002 0.00001 0.00001
|
|
210 7PX 0.00001 0.00001 0.00005 0.00007 0.00005
|
|
211 7PY 0.00002 0.00000 0.00007 -0.00002 -0.00002
|
|
212 7PZ 0.00001 -0.00003 0.00005 0.00003 0.00002
|
|
213 8PX 0.00003 -0.00004 0.00014 0.00021 0.00017
|
|
214 8PY 0.00005 -0.00002 0.00021 -0.00009 -0.00008
|
|
215 8PZ 0.00004 -0.00012 0.00016 0.00009 0.00007
|
|
216 9PX 0.00003 -0.00019 0.00012 0.00023 0.00018
|
|
217 9PY 0.00005 -0.00011 0.00023 -0.00014 -0.00012
|
|
218 9PZ 0.00002 -0.00019 0.00008 0.00005 0.00004
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
221 10D-1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
223 10D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00001 -0.00001 0.00002 0.00002 0.00001
|
|
226 11D-1 0.00000 -0.00001 0.00002 0.00001 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
228 11D-2 0.00001 0.00000 0.00003 0.00000 0.00000
|
|
229 12D 0 -0.00001 0.00000 -0.00002 -0.00001 -0.00001
|
|
230 12D+1 0.00001 -0.00004 0.00003 0.00003 0.00002
|
|
231 12D-1 0.00001 -0.00003 0.00003 0.00000 0.00000
|
|
232 12D+2 0.00000 -0.00002 -0.00002 0.00006 0.00005
|
|
233 12D-2 0.00001 -0.00004 0.00005 -0.00002 -0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
245 14F-2 0.00000 -0.00001 0.00001 0.00001 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
247 14F-3 0.00000 -0.00001 0.00001 0.00001 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
36 37 38 39 40
|
|
36 14D-2 0.00032
|
|
37 15D 0 0.00000 0.00012
|
|
38 15D+1 0.00025 0.00000 0.00020
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00020
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00019 0.00018
|
|
41 15D-2 0.00024 0.00000 0.00019 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00003 0.00000 0.00002 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
52 17F+2 0.00000 0.00000 0.00000 -0.00003 -0.00003
|
|
53 17F-2 -0.00004 0.00000 -0.00003 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00003 0.00000 0.00003 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.00005 -0.00005
|
|
60 18F-2 -0.00007 0.00000 -0.00005 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
73 20G+1 -0.00003 0.00000 -0.00002 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 -0.00002 -0.00002
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 -0.00003 -0.00002
|
|
80 20G-4 0.00003 0.00000 0.00003 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
89 21H-4 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00010 0.00000 -0.00056 -0.00053
|
|
93 2S 0.00000 0.00027 0.00000 -0.00132 -0.00126
|
|
94 3S 0.00000 0.00046 0.00000 -0.00245 -0.00233
|
|
95 4S 0.00000 -0.00055 0.00000 -0.00223 -0.00212
|
|
96 5S 0.00000 0.00006 0.00000 -0.00044 -0.00042
|
|
97 6PX -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
98 6PY 0.00000 -0.00001 0.00000 0.00002 0.00002
|
|
99 6PZ 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
100 7PX -0.00005 0.00000 -0.00004 0.00000 0.00000
|
|
101 7PY 0.00000 -0.00003 0.00000 0.00006 0.00005
|
|
102 7PZ 0.00000 -0.00003 0.00000 -0.00004 -0.00004
|
|
103 8PX -0.00017 0.00000 -0.00014 0.00000 0.00000
|
|
104 8PY 0.00000 -0.00002 0.00000 0.00017 0.00016
|
|
105 8PZ 0.00000 -0.00015 0.00000 -0.00012 -0.00011
|
|
106 9PX -0.00022 0.00000 -0.00017 0.00000 0.00000
|
|
107 9PY 0.00000 0.00028 0.00000 0.00016 0.00015
|
|
108 9PZ 0.00000 -0.00027 0.00000 -0.00006 -0.00006
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
113 10D-2 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
114 11D 0 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
117 11D+2 0.00000 -0.00001 0.00000 0.00002 0.00002
|
|
118 11D-2 0.00002 0.00000 0.00001 0.00000 0.00000
|
|
119 12D 0 0.00000 -0.00001 0.00000 0.00002 0.00002
|
|
120 12D+1 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00006 0.00000 0.00003 0.00003
|
|
122 12D+2 0.00000 0.00006 0.00000 0.00002 0.00002
|
|
123 12D-2 0.00006 0.00000 0.00005 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00001 0.00000 0.00001 0.00001
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00001 0.00000 0.00001 0.00001
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00061 0.00010 -0.00048 0.00028 0.00027
|
|
148 2S -0.00145 0.00027 -0.00114 0.00066 0.00063
|
|
149 3S -0.00268 0.00046 -0.00212 0.00122 0.00116
|
|
150 4S -0.00245 -0.00055 -0.00193 0.00112 0.00106
|
|
151 5S -0.00048 0.00006 -0.00038 0.00022 0.00021
|
|
152 6PX 0.00002 0.00000 0.00001 -0.00001 -0.00001
|
|
153 6PY -0.00002 0.00000 -0.00001 0.00000 0.00000
|
|
154 6PZ -0.00001 -0.00001 -0.00001 0.00001 0.00001
|
|
155 7PX 0.00004 -0.00003 0.00003 -0.00004 -0.00004
|
|
156 7PY -0.00005 0.00002 -0.00004 -0.00001 -0.00001
|
|
157 7PZ -0.00004 -0.00003 -0.00003 0.00002 0.00002
|
|
158 8PX 0.00012 -0.00001 0.00009 -0.00013 -0.00012
|
|
159 8PY -0.00017 0.00001 -0.00013 -0.00006 -0.00006
|
|
160 8PZ -0.00013 -0.00015 -0.00010 0.00006 0.00006
|
|
161 9PX 0.00009 0.00024 0.00007 -0.00014 -0.00014
|
|
162 9PY -0.00018 -0.00014 -0.00014 -0.00009 -0.00009
|
|
163 9PZ -0.00006 -0.00027 -0.00005 0.00003 0.00003
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
168 10D-2 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
169 11D 0 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00002 0.00001 0.00002 -0.00001 -0.00001
|
|
171 11D-1 -0.00001 -0.00001 -0.00001 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00001 0.00000 0.00002 0.00001
|
|
173 11D-2 0.00002 -0.00001 0.00002 0.00000 0.00000
|
|
174 12D 0 0.00002 -0.00001 0.00001 -0.00001 -0.00001
|
|
175 12D+1 0.00002 0.00006 0.00002 -0.00002 -0.00002
|
|
176 12D-1 -0.00002 -0.00003 -0.00002 0.00000 0.00000
|
|
177 12D+2 0.00001 -0.00003 0.00001 0.00004 0.00004
|
|
178 12D-2 0.00004 0.00005 0.00003 0.00001 0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00001 0.00001 0.00001 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00001 0.00001 0.00001 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 -0.00001 -0.00001 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00061 0.00010 0.00048 0.00028 0.00027
|
|
203 2S 0.00145 0.00027 0.00114 0.00066 0.00063
|
|
204 3S 0.00268 0.00046 0.00212 0.00122 0.00116
|
|
205 4S 0.00245 -0.00055 0.00193 0.00112 0.00106
|
|
206 5S 0.00048 0.00006 0.00038 0.00022 0.00021
|
|
207 6PX 0.00002 0.00000 0.00001 0.00001 0.00001
|
|
208 6PY 0.00002 0.00000 0.00001 0.00000 0.00000
|
|
209 6PZ 0.00001 -0.00001 0.00001 0.00001 0.00001
|
|
210 7PX 0.00004 0.00003 0.00003 0.00004 0.00004
|
|
211 7PY 0.00005 0.00002 0.00004 -0.00001 -0.00001
|
|
212 7PZ 0.00004 -0.00003 0.00003 0.00002 0.00002
|
|
213 8PX 0.00012 0.00001 0.00009 0.00013 0.00012
|
|
214 8PY 0.00017 0.00001 0.00013 -0.00006 -0.00006
|
|
215 8PZ 0.00013 -0.00015 0.00010 0.00006 0.00006
|
|
216 9PX 0.00009 -0.00024 0.00007 0.00014 0.00014
|
|
217 9PY 0.00018 -0.00014 0.00014 -0.00009 -0.00009
|
|
218 9PZ 0.00006 -0.00027 0.00005 0.00003 0.00003
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
223 10D-2 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
224 11D 0 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00002 -0.00001 0.00002 0.00001 0.00001
|
|
226 11D-1 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00001 0.00000 0.00002 0.00001
|
|
228 11D-2 0.00002 0.00001 0.00002 0.00000 0.00000
|
|
229 12D 0 -0.00002 -0.00001 -0.00001 -0.00001 -0.00001
|
|
230 12D+1 0.00002 -0.00006 0.00002 0.00002 0.00002
|
|
231 12D-1 0.00002 -0.00003 0.00002 0.00000 0.00000
|
|
232 12D+2 -0.00001 -0.00003 -0.00001 0.00004 0.00004
|
|
233 12D-2 0.00004 -0.00005 0.00003 -0.00001 -0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 42 43 44 45
|
|
41 15D-2 0.00018
|
|
42 16F 0 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00001 0.00000 -0.00001 0.00001
|
|
93 2S 0.00000 0.00002 0.00000 -0.00002 0.00002
|
|
94 3S 0.00000 0.00004 0.00000 -0.00003 0.00005
|
|
95 4S 0.00000 -0.00001 0.00000 -0.00003 0.00004
|
|
96 5S 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
97 6PX -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX -0.00013 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX -0.00017 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00046 0.00001 -0.00001 0.00000 -0.00001
|
|
148 2S -0.00109 0.00002 -0.00002 0.00001 -0.00001
|
|
149 3S -0.00201 0.00004 -0.00003 0.00002 -0.00002
|
|
150 4S -0.00184 -0.00001 -0.00003 0.00002 -0.00002
|
|
151 5S -0.00036 0.00000 -0.00001 0.00000 0.00000
|
|
152 6PX 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY -0.00012 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00007 0.00001 0.00000 0.00000 0.00000
|
|
162 9PY -0.00014 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ -0.00005 -0.00001 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00046 0.00001 0.00001 0.00000 -0.00001
|
|
203 2S 0.00109 0.00002 0.00002 0.00001 -0.00001
|
|
204 3S 0.00201 0.00004 0.00003 0.00002 -0.00002
|
|
205 4S 0.00184 -0.00001 0.00003 0.00002 -0.00002
|
|
206 5S 0.00036 0.00000 0.00001 0.00000 0.00000
|
|
207 6PX 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00010 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00007 -0.00001 0.00000 0.00000 0.00000
|
|
217 9PY 0.00014 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00005 -0.00001 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 47 48 49 50
|
|
46 16F-2 0.00000
|
|
47 16F+3 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00001
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 -0.00001 0.00008 0.00000
|
|
93 2S 0.00000 0.00000 -0.00002 0.00019 0.00000
|
|
94 3S 0.00000 0.00000 -0.00004 0.00033 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 -0.00004 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
104 8PY 0.00000 0.00000 0.00001 -0.00004 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
107 9PY 0.00000 0.00000 0.00000 0.00005 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 -0.00006 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00001 0.00000 -0.00001 0.00008 -0.00005
|
|
148 2S 0.00002 0.00000 -0.00002 0.00019 -0.00012
|
|
149 3S 0.00004 0.00000 -0.00004 0.00033 -0.00022
|
|
150 4S 0.00004 0.00000 0.00000 -0.00004 -0.00020
|
|
151 5S 0.00001 0.00000 0.00000 0.00002 -0.00004
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 -0.00004 0.00001
|
|
159 8PY 0.00000 0.00000 0.00000 0.00002 -0.00001
|
|
160 8PZ 0.00000 0.00000 0.00000 -0.00002 -0.00001
|
|
161 9PX 0.00000 0.00000 0.00000 0.00004 0.00001
|
|
162 9PY 0.00000 0.00000 0.00000 -0.00002 -0.00001
|
|
163 9PZ 0.00000 0.00000 0.00000 -0.00006 -0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00001 0.00000 -0.00001 0.00008 0.00005
|
|
203 2S -0.00002 0.00000 -0.00002 0.00019 0.00012
|
|
204 3S -0.00004 0.00000 -0.00004 0.00033 0.00022
|
|
205 4S -0.00004 0.00000 0.00000 -0.00004 0.00020
|
|
206 5S -0.00001 0.00000 0.00000 0.00002 0.00004
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00004 0.00001
|
|
214 8PY 0.00000 0.00000 0.00000 0.00002 0.00001
|
|
215 8PZ 0.00000 0.00000 0.00000 -0.00002 0.00001
|
|
216 9PX 0.00000 0.00000 0.00000 -0.00004 0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 -0.00002 0.00001
|
|
218 9PZ 0.00000 0.00000 0.00000 -0.00006 0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 52 53 54 55
|
|
51 17F-1 0.00000
|
|
52 17F+2 0.00000 0.00001
|
|
53 17F-2 0.00000 0.00000 0.00001
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 -0.00001 0.00001 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S -0.00006 0.00009 0.00000 0.00000 -0.00007
|
|
93 2S -0.00014 0.00021 0.00000 0.00000 -0.00016
|
|
94 3S -0.00025 0.00039 0.00000 0.00000 -0.00028
|
|
95 4S -0.00023 0.00036 0.00000 0.00000 -0.00006
|
|
96 5S -0.00005 0.00007 0.00000 0.00000 -0.00001
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
101 7PY 0.00001 -0.00001 0.00000 0.00000 0.00002
|
|
102 7PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
104 8PY 0.00002 -0.00003 0.00000 0.00000 0.00004
|
|
105 8PZ -0.00001 0.00002 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
107 9PY 0.00002 -0.00003 0.00000 0.00000 0.00000
|
|
108 9PZ -0.00001 0.00001 0.00000 0.00000 0.00002
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00003 -0.00004 0.00008 0.00000 -0.00007
|
|
148 2S 0.00007 -0.00011 0.00018 0.00000 -0.00016
|
|
149 3S 0.00013 -0.00020 0.00034 0.00000 -0.00028
|
|
150 4S 0.00012 -0.00018 0.00031 0.00000 -0.00006
|
|
151 5S 0.00002 -0.00004 0.00006 0.00000 -0.00001
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00001 -0.00001 0.00000 0.00001
|
|
156 7PY 0.00000 0.00000 0.00001 0.00000 -0.00001
|
|
157 7PZ 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
158 8PX -0.00001 0.00002 -0.00001 0.00000 0.00004
|
|
159 8PY -0.00001 0.00001 0.00002 0.00000 -0.00002
|
|
160 8PZ 0.00001 -0.00001 0.00002 0.00000 0.00000
|
|
161 9PX -0.00001 0.00002 -0.00001 0.00000 0.00000
|
|
162 9PY -0.00001 0.00001 0.00002 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00001 0.00000 0.00002
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00003 -0.00004 -0.00008 0.00000 -0.00007
|
|
203 2S 0.00007 -0.00011 -0.00018 0.00000 -0.00016
|
|
204 3S 0.00013 -0.00020 -0.00034 0.00000 -0.00028
|
|
205 4S 0.00012 -0.00018 -0.00031 0.00000 -0.00006
|
|
206 5S 0.00002 -0.00004 -0.00006 0.00000 -0.00001
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 -0.00001 -0.00001 0.00000 -0.00001
|
|
211 7PY 0.00000 0.00000 -0.00001 0.00000 -0.00001
|
|
212 7PZ 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
213 8PX 0.00001 -0.00002 -0.00001 0.00000 -0.00004
|
|
214 8PY -0.00001 0.00001 -0.00002 0.00000 -0.00002
|
|
215 8PZ 0.00001 -0.00001 -0.00002 0.00000 0.00000
|
|
216 9PX 0.00001 -0.00002 -0.00001 0.00000 0.00000
|
|
217 9PY -0.00001 0.00001 -0.00002 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 -0.00001 0.00000 0.00002
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 57 58 59 60
|
|
56 18F 0 0.00001
|
|
57 18F+1 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 -0.00001 0.00001
|
|
60 18F-2 0.00000 -0.00001 0.00000 0.00000 0.00001
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00008 0.00000 -0.00007 0.00015 0.00000
|
|
93 2S 0.00018 0.00000 -0.00017 0.00036 0.00000
|
|
94 3S 0.00032 0.00000 -0.00031 0.00066 0.00000
|
|
95 4S 0.00001 0.00000 -0.00028 0.00060 0.00000
|
|
96 5S 0.00001 0.00000 -0.00006 0.00012 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
101 7PY -0.00002 0.00000 0.00001 -0.00002 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
103 8PX 0.00000 -0.00002 0.00000 0.00000 0.00004
|
|
104 8PY -0.00004 0.00000 0.00002 -0.00005 0.00000
|
|
105 8PZ -0.00001 0.00000 -0.00001 0.00003 0.00000
|
|
106 9PX 0.00000 -0.00002 0.00000 0.00000 0.00005
|
|
107 9PY 0.00003 0.00000 0.00002 -0.00004 0.00000
|
|
108 9PZ -0.00004 0.00000 -0.00001 0.00002 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
117 11D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
123 12D-2 0.00000 0.00001 0.00000 0.00000 -0.00001
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00008 -0.00006 0.00004 -0.00008 0.00013
|
|
148 2S 0.00018 -0.00015 0.00008 -0.00018 0.00031
|
|
149 3S 0.00032 -0.00027 0.00016 -0.00033 0.00057
|
|
150 4S 0.00001 -0.00025 0.00014 -0.00030 0.00052
|
|
151 5S 0.00001 -0.00005 0.00003 -0.00006 0.00010
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX -0.00002 0.00000 -0.00001 0.00001 -0.00001
|
|
156 7PY 0.00001 -0.00001 0.00000 0.00000 0.00001
|
|
157 7PZ 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
158 8PX -0.00004 0.00001 -0.00002 0.00004 -0.00002
|
|
159 8PY 0.00002 -0.00002 -0.00001 0.00002 0.00004
|
|
160 8PZ -0.00001 -0.00001 0.00001 -0.00002 0.00003
|
|
161 9PX 0.00002 0.00001 -0.00002 0.00004 -0.00002
|
|
162 9PY -0.00001 -0.00002 -0.00001 0.00002 0.00004
|
|
163 9PZ -0.00004 -0.00001 0.00000 -0.00001 0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00008 0.00006 0.00004 -0.00008 -0.00013
|
|
203 2S 0.00018 0.00015 0.00008 -0.00018 -0.00031
|
|
204 3S 0.00032 0.00027 0.00016 -0.00033 -0.00057
|
|
205 4S 0.00001 0.00025 0.00014 -0.00030 -0.00052
|
|
206 5S 0.00001 0.00005 0.00003 -0.00006 -0.00010
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00002 0.00000 0.00001 -0.00001 -0.00001
|
|
211 7PY 0.00001 0.00001 0.00000 0.00000 -0.00001
|
|
212 7PZ 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
213 8PX 0.00004 0.00001 0.00002 -0.00004 -0.00002
|
|
214 8PY 0.00002 0.00002 -0.00001 0.00002 -0.00004
|
|
215 8PZ -0.00001 0.00001 0.00001 -0.00002 -0.00003
|
|
216 9PX -0.00002 0.00001 0.00002 -0.00004 -0.00002
|
|
217 9PY -0.00001 0.00002 -0.00001 0.00002 -0.00004
|
|
218 9PZ -0.00004 0.00001 0.00000 -0.00001 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 62 63 64 65
|
|
61 18F+3 0.00000
|
|
62 18F-3 0.00000 0.00001
|
|
63 19G 0 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00008 0.00000 0.00000 0.00001
|
|
93 2S 0.00000 -0.00018 -0.00001 0.00000 0.00002
|
|
94 3S 0.00000 -0.00033 -0.00001 0.00000 0.00004
|
|
95 4S 0.00000 -0.00008 0.00001 0.00000 0.00004
|
|
96 5S 0.00000 -0.00001 0.00000 0.00000 0.00001
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00005 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 -0.00008 0.00000 0.00001 0.00000
|
|
148 2S 0.00000 -0.00018 -0.00001 0.00002 -0.00001
|
|
149 3S 0.00000 -0.00033 -0.00001 0.00003 -0.00002
|
|
150 4S 0.00000 -0.00008 0.00001 0.00003 -0.00002
|
|
151 5S 0.00000 -0.00001 0.00000 0.00001 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00004 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 -0.00003 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 -0.00008 0.00000 -0.00001 0.00000
|
|
203 2S 0.00000 -0.00018 -0.00001 -0.00002 -0.00001
|
|
204 3S 0.00000 -0.00033 -0.00001 -0.00003 -0.00002
|
|
205 4S 0.00000 -0.00008 0.00001 -0.00003 -0.00002
|
|
206 5S 0.00000 -0.00001 0.00000 -0.00001 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 -0.00004 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 -0.00003 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 67 68 69 70
|
|
66 19G+2 0.00000
|
|
67 19G-2 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
93 2S 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
94 3S 0.00001 0.00000 0.00000 0.00003 0.00004
|
|
95 4S 0.00001 0.00000 0.00000 0.00000 0.00004
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00002 -0.00001
|
|
149 3S 0.00000 0.00001 0.00000 0.00003 -0.00002
|
|
150 4S 0.00000 0.00001 0.00000 0.00000 -0.00002
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00002 -0.00001
|
|
204 3S 0.00000 -0.00001 0.00000 0.00003 -0.00002
|
|
205 4S 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 72 73 74 75
|
|
71 19G-4 0.00000
|
|
72 20G 0 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00002 0.00000 0.00006 0.00000
|
|
93 2S 0.00000 -0.00005 0.00000 0.00014 0.00001
|
|
94 3S 0.00000 -0.00009 0.00000 0.00027 0.00001
|
|
95 4S 0.00000 0.00002 0.00000 0.00024 0.00001
|
|
96 5S 0.00000 -0.00001 0.00000 0.00005 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00001 0.00000 -0.00001 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
104 8PY 0.00000 0.00001 0.00000 -0.00002 0.00000
|
|
105 8PZ 0.00000 0.00001 0.00000 0.00001 0.00000
|
|
106 9PX 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
107 9PY 0.00000 -0.00002 0.00000 -0.00002 0.00000
|
|
108 9PZ 0.00000 0.00002 0.00000 0.00001 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00001 -0.00002 0.00005 -0.00003 0.00000
|
|
148 2S -0.00002 -0.00005 0.00012 -0.00007 0.00000
|
|
149 3S -0.00004 -0.00009 0.00023 -0.00013 -0.00001
|
|
150 4S -0.00003 0.00002 0.00021 -0.00012 -0.00001
|
|
151 5S -0.00001 -0.00001 0.00004 -0.00002 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00001 -0.00001 0.00001 0.00000
|
|
159 8PY 0.00000 -0.00001 0.00001 0.00001 0.00000
|
|
160 8PZ 0.00000 0.00001 0.00001 -0.00001 0.00000
|
|
161 9PX 0.00000 -0.00001 -0.00001 0.00002 0.00000
|
|
162 9PY 0.00000 0.00001 0.00002 0.00001 0.00000
|
|
163 9PZ 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 -0.00002 -0.00005 -0.00003 0.00000
|
|
203 2S 0.00002 -0.00005 -0.00012 -0.00007 0.00000
|
|
204 3S 0.00004 -0.00009 -0.00023 -0.00013 -0.00001
|
|
205 4S 0.00003 0.00002 -0.00021 -0.00012 -0.00001
|
|
206 5S 0.00001 -0.00001 -0.00004 -0.00002 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 -0.00001 -0.00001 -0.00001 0.00000
|
|
214 8PY 0.00000 -0.00001 -0.00001 0.00001 0.00000
|
|
215 8PZ 0.00000 0.00001 -0.00001 -0.00001 0.00000
|
|
216 9PX 0.00000 0.00001 -0.00001 -0.00002 0.00000
|
|
217 9PY 0.00000 0.00001 -0.00002 0.00001 0.00000
|
|
218 9PZ 0.00000 0.00002 -0.00001 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 77 78 79 80
|
|
76 20G-2 0.00000
|
|
77 20G+3 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00004 0.00007 0.00000
|
|
93 2S 0.00000 0.00000 0.00010 0.00017 0.00000
|
|
94 3S 0.00000 0.00000 0.00017 0.00032 0.00000
|
|
95 4S 0.00000 0.00000 0.00003 0.00029 0.00000
|
|
96 5S 0.00000 0.00000 0.00001 0.00006 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
104 8PY 0.00000 0.00000 -0.00002 -0.00002 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
107 9PY 0.00000 0.00000 0.00001 -0.00002 0.00000
|
|
108 9PZ 0.00000 0.00000 -0.00001 0.00001 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00004 -0.00004 -0.00006
|
|
148 2S 0.00001 0.00000 0.00010 -0.00009 -0.00015
|
|
149 3S 0.00001 0.00000 0.00017 -0.00016 -0.00027
|
|
150 4S 0.00001 0.00000 0.00003 -0.00014 -0.00025
|
|
151 5S 0.00000 0.00000 0.00001 -0.00003 -0.00005
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 -0.00001 0.00001 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 -0.00002 0.00002 0.00001
|
|
159 8PY 0.00000 0.00000 0.00001 0.00001 -0.00002
|
|
160 8PZ 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
161 9PX 0.00000 0.00000 0.00000 0.00002 0.00001
|
|
162 9PY 0.00000 0.00000 0.00000 0.00001 -0.00002
|
|
163 9PZ 0.00000 0.00000 -0.00001 0.00000 -0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00004 -0.00004 0.00006
|
|
203 2S -0.00001 0.00000 0.00010 -0.00009 0.00015
|
|
204 3S -0.00001 0.00000 0.00017 -0.00016 0.00027
|
|
205 4S -0.00001 0.00000 0.00003 -0.00014 0.00025
|
|
206 5S 0.00000 0.00000 0.00001 -0.00003 0.00005
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00002 -0.00002 0.00001
|
|
214 8PY 0.00000 0.00000 0.00001 0.00001 0.00002
|
|
215 8PZ 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
216 9PX 0.00000 0.00000 0.00000 -0.00002 0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 0.00001 0.00002
|
|
218 9PZ 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 82 83 84 85
|
|
81 21H 0 0.00000
|
|
82 21H+1 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
93 2S 0.00000 0.00000 -0.00001 -0.00002 0.00000
|
|
94 3S 0.00000 0.00000 -0.00002 -0.00003 0.00000
|
|
95 4S -0.00001 0.00000 -0.00002 -0.00003 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
148 2S 0.00000 -0.00001 0.00001 0.00001 -0.00002
|
|
149 3S 0.00000 -0.00002 0.00001 0.00002 -0.00003
|
|
150 4S -0.00001 -0.00002 0.00001 0.00001 -0.00003
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
203 2S 0.00000 0.00001 0.00001 0.00001 0.00002
|
|
204 3S 0.00000 0.00002 0.00001 0.00002 0.00003
|
|
205 4S -0.00001 0.00002 0.00001 0.00001 0.00003
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 87 88 89 90
|
|
86 21H+3 0.00000
|
|
87 21H-3 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00001 -0.00002 0.00000 0.00000
|
|
93 2S 0.00000 -0.00002 -0.00004 0.00000 0.00000
|
|
94 3S 0.00000 -0.00003 -0.00008 0.00000 0.00000
|
|
95 4S 0.00000 0.00001 -0.00007 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
107 9PY 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 -0.00001 0.00001 0.00002 0.00000
|
|
148 2S 0.00000 -0.00002 0.00002 0.00004 -0.00001
|
|
149 3S 0.00000 -0.00003 0.00004 0.00007 -0.00001
|
|
150 4S 0.00000 0.00001 0.00004 0.00006 -0.00001
|
|
151 5S 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 -0.00001 0.00001 -0.00002 0.00000
|
|
203 2S 0.00000 -0.00002 0.00002 -0.00004 0.00001
|
|
204 3S 0.00000 -0.00003 0.00004 -0.00007 0.00001
|
|
205 4S 0.00000 0.00001 0.00004 -0.00006 0.00001
|
|
206 5S 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 92 93 94 95
|
|
91 21H-5 0.00000
|
|
92 2 H 1S 0.00000 0.00212
|
|
93 2S 0.00001 0.00501 0.01181
|
|
94 3S 0.00002 0.00914 0.02155 0.03935
|
|
95 4S 0.00001 0.00647 0.01512 0.02809 0.02864
|
|
96 5S 0.00000 0.00131 0.00312 0.00574 0.00470
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 -0.00009 -0.00021 -0.00037 -0.00024
|
|
99 6PZ 0.00000 0.00004 0.00008 0.00015 0.00019
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 -0.00029 -0.00067 -0.00122 -0.00064
|
|
102 7PZ 0.00000 0.00011 0.00025 0.00046 0.00060
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 -0.00079 -0.00184 -0.00334 -0.00225
|
|
105 8PZ 0.00000 0.00031 0.00067 0.00129 0.00216
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 -0.00031 -0.00064 -0.00128 -0.00325
|
|
108 9PZ 0.00000 -0.00008 -0.00025 -0.00035 0.00192
|
|
109 10D 0 0.00000 -0.00001 -0.00003 -0.00005 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 -0.00002 -0.00005 -0.00010 -0.00010
|
|
112 10D+2 0.00000 -0.00003 -0.00006 -0.00011 -0.00006
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 -0.00003 -0.00007 -0.00013 -0.00001
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 -0.00008 -0.00017 -0.00032 -0.00033
|
|
117 11D+2 0.00000 -0.00009 -0.00020 -0.00037 -0.00019
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 -0.00007 -0.00018 -0.00032 -0.00017
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 -0.00006 -0.00011 -0.00023 -0.00067
|
|
122 12D+2 0.00000 -0.00005 -0.00011 -0.00021 -0.00060
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 -0.00001 -0.00002 -0.00004 -0.00003
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00001 0.00001 -0.00001
|
|
127 13F+2 0.00000 -0.00001 -0.00003 -0.00005 -0.00005
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00001 0.00003 0.00005 0.00002
|
|
131 14F 0 0.00000 -0.00002 -0.00006 -0.00010 -0.00012
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00001 0.00003 0.00005 0.00002
|
|
134 14F+2 0.00000 -0.00003 -0.00007 -0.00013 -0.00016
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00002 0.00004 0.00008 0.00015
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
145 15G+4 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 -0.00022 -0.00055 -0.00116 -0.00292
|
|
148 2S 0.00000 -0.00055 -0.00137 -0.00285 -0.00713
|
|
149 3S -0.00001 -0.00116 -0.00285 -0.00581 -0.01311
|
|
150 4S -0.00001 -0.00292 -0.00713 -0.01311 -0.00894
|
|
151 5S 0.00000 -0.00053 -0.00126 -0.00236 -0.00269
|
|
152 6PX 0.00000 0.00001 0.00002 0.00005 0.00013
|
|
153 6PY 0.00000 0.00002 0.00005 0.00010 0.00004
|
|
154 6PZ 0.00000 -0.00002 -0.00004 -0.00008 -0.00002
|
|
155 7PX 0.00000 0.00001 0.00002 0.00007 0.00047
|
|
156 7PY 0.00000 0.00010 0.00024 0.00043 0.00016
|
|
157 7PZ 0.00000 -0.00005 -0.00013 -0.00023 -0.00003
|
|
158 8PX 0.00000 0.00009 0.00024 0.00049 0.00114
|
|
159 8PY 0.00000 0.00033 0.00076 0.00138 0.00086
|
|
160 8PZ 0.00000 -0.00019 -0.00050 -0.00088 0.00017
|
|
161 9PX 0.00000 0.00052 0.00131 0.00234 0.00033
|
|
162 9PY 0.00000 0.00019 0.00040 0.00079 0.00177
|
|
163 9PZ 0.00000 -0.00032 -0.00083 -0.00142 0.00094
|
|
164 10D 0 0.00000 0.00000 -0.00001 -0.00002 0.00002
|
|
165 10D+1 0.00000 0.00001 0.00003 0.00005 0.00003
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
167 10D+2 0.00000 -0.00001 -0.00003 -0.00005 -0.00007
|
|
168 10D-2 0.00000 -0.00001 -0.00002 -0.00003 0.00000
|
|
169 11D 0 0.00000 -0.00002 -0.00004 -0.00007 0.00004
|
|
170 11D+1 0.00000 0.00001 0.00003 0.00006 0.00003
|
|
171 11D-1 0.00000 0.00000 -0.00001 -0.00002 0.00000
|
|
172 11D+2 0.00000 -0.00002 -0.00006 -0.00011 -0.00017
|
|
173 11D-2 0.00000 -0.00003 -0.00007 -0.00012 0.00001
|
|
174 12D 0 0.00000 0.00000 -0.00001 -0.00001 0.00011
|
|
175 12D+1 0.00000 0.00007 0.00019 0.00033 -0.00010
|
|
176 12D-1 0.00000 -0.00001 -0.00004 -0.00007 0.00017
|
|
177 12D+2 0.00000 -0.00012 -0.00029 -0.00053 -0.00028
|
|
178 12D-2 0.00000 -0.00002 -0.00002 -0.00006 -0.00041
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
180 13F+1 0.00000 0.00000 0.00001 0.00001 -0.00001
|
|
181 13F-1 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
182 13F+2 0.00000 0.00000 -0.00001 -0.00002 -0.00002
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
184 13F+3 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
186 14F 0 0.00000 0.00001 0.00002 0.00004 0.00001
|
|
187 14F+1 0.00000 0.00000 -0.00001 -0.00002 -0.00004
|
|
188 14F-1 0.00000 0.00000 -0.00001 -0.00002 -0.00001
|
|
189 14F+2 0.00000 -0.00001 -0.00002 -0.00003 -0.00001
|
|
190 14F-2 0.00000 0.00001 0.00002 0.00004 0.00000
|
|
191 14F+3 0.00000 0.00001 0.00002 0.00004 0.00004
|
|
192 14F-3 0.00000 -0.00001 -0.00004 -0.00007 0.00002
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
202 4 H 1S 0.00000 -0.00022 -0.00055 -0.00116 -0.00292
|
|
203 2S 0.00000 -0.00055 -0.00137 -0.00285 -0.00713
|
|
204 3S -0.00001 -0.00116 -0.00285 -0.00581 -0.01311
|
|
205 4S -0.00001 -0.00292 -0.00713 -0.01311 -0.00894
|
|
206 5S 0.00000 -0.00053 -0.00126 -0.00236 -0.00269
|
|
207 6PX 0.00000 -0.00001 -0.00002 -0.00005 -0.00013
|
|
208 6PY 0.00000 0.00002 0.00005 0.00010 0.00004
|
|
209 6PZ 0.00000 -0.00002 -0.00004 -0.00008 -0.00002
|
|
210 7PX 0.00000 -0.00001 -0.00002 -0.00007 -0.00047
|
|
211 7PY 0.00000 0.00010 0.00024 0.00043 0.00016
|
|
212 7PZ 0.00000 -0.00005 -0.00013 -0.00023 -0.00003
|
|
213 8PX 0.00000 -0.00009 -0.00024 -0.00049 -0.00114
|
|
214 8PY 0.00000 0.00033 0.00076 0.00138 0.00086
|
|
215 8PZ 0.00000 -0.00019 -0.00050 -0.00088 0.00017
|
|
216 9PX 0.00000 -0.00052 -0.00131 -0.00234 -0.00033
|
|
217 9PY 0.00000 0.00019 0.00040 0.00079 0.00177
|
|
218 9PZ 0.00000 -0.00032 -0.00083 -0.00142 0.00094
|
|
219 10D 0 0.00000 0.00000 -0.00001 -0.00002 0.00002
|
|
220 10D+1 0.00000 -0.00001 -0.00003 -0.00005 -0.00003
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
222 10D+2 0.00000 -0.00001 -0.00003 -0.00005 -0.00007
|
|
223 10D-2 0.00000 0.00001 0.00002 0.00003 0.00000
|
|
224 11D 0 0.00000 -0.00002 -0.00004 -0.00007 0.00004
|
|
225 11D+1 0.00000 -0.00001 -0.00003 -0.00006 -0.00003
|
|
226 11D-1 0.00000 0.00000 -0.00001 -0.00002 0.00000
|
|
227 11D+2 0.00000 -0.00002 -0.00006 -0.00011 -0.00017
|
|
228 11D-2 0.00000 0.00003 0.00007 0.00012 -0.00001
|
|
229 12D 0 0.00000 0.00000 -0.00001 -0.00001 0.00011
|
|
230 12D+1 0.00000 -0.00007 -0.00019 -0.00033 0.00010
|
|
231 12D-1 0.00000 -0.00001 -0.00004 -0.00007 0.00017
|
|
232 12D+2 0.00000 -0.00012 -0.00029 -0.00053 -0.00028
|
|
233 12D-2 0.00000 0.00002 0.00002 0.00006 0.00041
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
235 13F+1 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
236 13F-1 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
237 13F+2 0.00000 0.00000 -0.00001 -0.00002 -0.00002
|
|
238 13F-2 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
239 13F+3 0.00000 -0.00001 -0.00001 -0.00002 -0.00002
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
241 14F 0 0.00000 0.00001 0.00002 0.00004 0.00001
|
|
242 14F+1 0.00000 0.00000 0.00001 0.00002 0.00004
|
|
243 14F-1 0.00000 0.00000 -0.00001 -0.00002 -0.00001
|
|
244 14F+2 0.00000 -0.00001 -0.00002 -0.00003 -0.00001
|
|
245 14F-2 0.00000 -0.00001 -0.00002 -0.00004 0.00000
|
|
246 14F+3 0.00000 -0.00001 -0.00002 -0.00004 -0.00004
|
|
247 14F-3 0.00000 -0.00001 -0.00004 -0.00007 0.00002
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
96 97 98 99 100
|
|
96 5S 0.00100
|
|
97 6PX 0.00000 0.00000
|
|
98 6PY -0.00005 0.00000 0.00000
|
|
99 6PZ 0.00002 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
101 7PY -0.00015 0.00000 0.00001 0.00000 0.00000
|
|
102 7PZ 0.00007 0.00000 0.00000 0.00001 0.00000
|
|
103 8PX 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
104 8PY -0.00040 0.00000 0.00004 -0.00002 0.00000
|
|
105 8PZ 0.00019 0.00000 -0.00001 0.00002 0.00000
|
|
106 9PX 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
107 9PY -0.00022 0.00000 0.00001 -0.00003 0.00000
|
|
108 9PZ -0.00001 0.00000 0.00001 0.00002 0.00000
|
|
109 10D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 -0.00004 0.00000 0.00000 -0.00001 0.00000
|
|
122 12D+2 -0.00002 0.00000 0.00000 -0.00001 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
124 13F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00053 0.00002 0.00000 -0.00002 0.00009
|
|
148 2S -0.00126 0.00006 -0.00001 -0.00004 0.00022
|
|
149 3S -0.00236 0.00011 -0.00001 -0.00008 0.00041
|
|
150 4S -0.00269 0.00010 0.00009 -0.00002 0.00037
|
|
151 5S -0.00045 0.00002 0.00002 -0.00002 0.00007
|
|
152 6PX 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00007 0.00000 0.00000 0.00000 -0.00001
|
|
156 7PY 0.00004 0.00000 0.00000 0.00000 0.00001
|
|
157 7PZ -0.00005 0.00000 0.00000 0.00000 0.00001
|
|
158 8PX 0.00026 0.00000 0.00000 0.00000 -0.00002
|
|
159 8PY 0.00015 0.00001 -0.00002 0.00001 0.00002
|
|
160 8PZ -0.00019 0.00001 0.00001 0.00001 0.00002
|
|
161 9PX 0.00043 0.00000 -0.00002 -0.00001 -0.00001
|
|
162 9PY 0.00014 0.00001 -0.00001 0.00002 0.00003
|
|
163 9PZ -0.00020 0.00000 0.00001 0.00002 0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00006 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00053 -0.00002 0.00000 -0.00002 -0.00009
|
|
203 2S -0.00126 -0.00006 -0.00001 -0.00004 -0.00022
|
|
204 3S -0.00236 -0.00011 -0.00001 -0.00008 -0.00041
|
|
205 4S -0.00269 -0.00010 0.00009 -0.00002 -0.00037
|
|
206 5S -0.00045 -0.00002 0.00002 -0.00002 -0.00007
|
|
207 6PX -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX -0.00007 0.00000 0.00000 0.00000 -0.00001
|
|
211 7PY 0.00004 0.00000 0.00000 0.00000 -0.00001
|
|
212 7PZ -0.00005 0.00000 0.00000 0.00000 -0.00001
|
|
213 8PX -0.00026 0.00000 0.00000 0.00000 -0.00002
|
|
214 8PY 0.00015 -0.00001 -0.00002 0.00001 -0.00002
|
|
215 8PZ -0.00019 -0.00001 0.00001 0.00001 -0.00002
|
|
216 9PX -0.00043 0.00000 0.00002 0.00001 -0.00001
|
|
217 9PY 0.00014 -0.00001 -0.00001 0.00002 -0.00003
|
|
218 9PZ -0.00020 0.00000 0.00001 0.00002 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 -0.00006 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 102 103 104 105
|
|
101 7PY 0.00005
|
|
102 7PZ -0.00001 0.00002
|
|
103 8PX 0.00000 0.00000 0.00009
|
|
104 8PY 0.00012 -0.00005 0.00000 0.00034
|
|
105 8PZ -0.00002 0.00006 0.00000 -0.00015 0.00027
|
|
106 9PX 0.00000 0.00000 0.00012 0.00000 0.00000
|
|
107 9PY -0.00001 -0.00011 0.00000 0.00016 -0.00047
|
|
108 9PZ 0.00006 0.00008 0.00000 -0.00001 0.00037
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00001 -0.00001 0.00000 0.00003 -0.00003
|
|
117 11D+2 0.00001 0.00000 0.00000 0.00003 0.00000
|
|
118 11D-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
119 12D 0 0.00001 0.00000 0.00000 0.00003 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
121 12D-1 0.00000 -0.00002 0.00000 0.00003 -0.00010
|
|
122 12D+2 0.00000 -0.00002 0.00000 0.00004 -0.00010
|
|
123 12D-2 0.00000 0.00000 -0.00003 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00001 -0.00002
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 -0.00001 0.00002
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00004 -0.00005 0.00033 -0.00009 -0.00019
|
|
148 2S -0.00010 -0.00013 0.00078 -0.00018 -0.00050
|
|
149 3S -0.00016 -0.00023 0.00144 -0.00026 -0.00088
|
|
150 4S 0.00033 -0.00003 0.00131 0.00056 0.00017
|
|
151 5S 0.00004 -0.00005 0.00026 0.00016 -0.00019
|
|
152 6PX 0.00000 0.00000 -0.00001 0.00001 0.00001
|
|
153 6PY 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
155 7PX 0.00001 0.00001 -0.00002 0.00002 0.00004
|
|
156 7PY -0.00002 0.00000 0.00003 -0.00005 0.00000
|
|
157 7PZ 0.00001 0.00001 0.00002 0.00000 0.00003
|
|
158 8PX 0.00002 0.00001 -0.00006 0.00007 0.00004
|
|
159 8PY -0.00005 0.00002 0.00009 -0.00015 0.00006
|
|
160 8PZ 0.00004 0.00003 0.00007 0.00000 0.00017
|
|
161 9PX -0.00009 -0.00004 -0.00005 -0.00009 -0.00024
|
|
162 9PY 0.00000 0.00006 0.00010 -0.00009 0.00024
|
|
163 9PZ 0.00008 0.00006 0.00003 0.00006 0.00032
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
170 11D+1 0.00000 0.00000 -0.00001 0.00001 -0.00001
|
|
171 11D-1 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
173 11D-2 0.00001 0.00000 -0.00001 0.00002 0.00001
|
|
174 12D 0 0.00000 0.00000 -0.00001 0.00001 0.00001
|
|
175 12D+1 -0.00001 -0.00001 -0.00001 -0.00001 -0.00006
|
|
176 12D-1 0.00001 0.00001 0.00001 0.00000 0.00004
|
|
177 12D+2 0.00002 0.00000 -0.00001 0.00002 0.00002
|
|
178 12D-2 0.00000 -0.00002 -0.00002 0.00002 -0.00008
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00004 -0.00005 -0.00033 -0.00009 -0.00019
|
|
203 2S -0.00010 -0.00013 -0.00078 -0.00018 -0.00050
|
|
204 3S -0.00016 -0.00023 -0.00144 -0.00026 -0.00088
|
|
205 4S 0.00033 -0.00003 -0.00131 0.00056 0.00017
|
|
206 5S 0.00004 -0.00005 -0.00026 0.00016 -0.00019
|
|
207 6PX 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
208 6PY 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
209 6PZ 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
210 7PX -0.00001 -0.00001 -0.00002 -0.00002 -0.00004
|
|
211 7PY -0.00002 0.00000 -0.00003 -0.00005 0.00000
|
|
212 7PZ 0.00001 0.00001 -0.00002 0.00000 0.00003
|
|
213 8PX -0.00002 -0.00001 -0.00006 -0.00007 -0.00004
|
|
214 8PY -0.00005 0.00002 -0.00009 -0.00015 0.00006
|
|
215 8PZ 0.00004 0.00003 -0.00007 0.00000 0.00017
|
|
216 9PX 0.00009 0.00004 -0.00005 0.00009 0.00024
|
|
217 9PY 0.00000 0.00006 -0.00010 -0.00009 0.00024
|
|
218 9PZ 0.00008 0.00006 -0.00003 0.00006 0.00032
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
225 11D+1 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
226 11D-1 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
228 11D-2 -0.00001 0.00000 -0.00001 -0.00002 -0.00001
|
|
229 12D 0 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
230 12D+1 0.00001 0.00001 -0.00001 0.00001 0.00006
|
|
231 12D-1 0.00001 0.00001 -0.00001 0.00000 0.00004
|
|
232 12D+2 0.00002 0.00000 0.00001 0.00002 0.00002
|
|
233 12D-2 0.00000 0.00002 -0.00002 -0.00002 0.00008
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 107 108 109 110
|
|
106 9PX 0.00015
|
|
107 9PY 0.00000 0.00083
|
|
108 9PZ 0.00000 -0.00070 0.00065
|
|
109 10D 0 0.00000 -0.00001 0.00001 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
113 10D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 -0.00002 0.00002 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00005 -0.00003 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
118 11D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 -0.00001 0.00002 0.00000 0.00000
|
|
120 12D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00018 -0.00016 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00017 -0.00015 0.00000 0.00000
|
|
123 12D-2 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00002 -0.00001 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00003 -0.00002 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 -0.00003 0.00003 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00042 0.00036 -0.00032 0.00000 0.00001
|
|
148 2S 0.00100 0.00093 -0.00083 -0.00001 0.00001
|
|
149 3S 0.00186 0.00163 -0.00142 -0.00002 0.00002
|
|
150 4S 0.00169 -0.00060 0.00094 0.00002 0.00002
|
|
151 5S 0.00033 0.00030 -0.00020 0.00000 0.00000
|
|
152 6PX -0.00001 -0.00002 0.00001 0.00000 0.00000
|
|
153 6PY 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
154 6PZ 0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
155 7PX -0.00003 -0.00008 0.00008 0.00000 0.00000
|
|
156 7PY 0.00004 0.00002 -0.00003 0.00000 0.00000
|
|
157 7PZ 0.00003 -0.00006 0.00006 0.00000 0.00000
|
|
158 8PX -0.00008 -0.00008 0.00007 0.00000 0.00000
|
|
159 8PY 0.00011 -0.00006 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00009 -0.00033 0.00032 0.00001 0.00000
|
|
161 9PX -0.00007 0.00049 -0.00052 -0.00001 0.00000
|
|
162 9PY 0.00013 -0.00042 0.00035 0.00000 0.00000
|
|
163 9PZ 0.00004 -0.00063 0.00062 0.00001 0.00000
|
|
164 10D 0 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
168 10D-2 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
169 11D 0 0.00000 -0.00002 0.00002 0.00000 0.00000
|
|
170 11D+1 -0.00001 0.00002 -0.00002 0.00000 0.00000
|
|
171 11D-1 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00002 -0.00002 0.00000 0.00000
|
|
173 11D-2 -0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
174 12D 0 -0.00001 -0.00003 0.00003 0.00000 0.00000
|
|
175 12D+1 -0.00002 0.00012 -0.00012 0.00000 0.00000
|
|
176 12D-1 0.00001 -0.00008 0.00007 0.00000 0.00000
|
|
177 12D+2 -0.00001 -0.00004 0.00006 0.00000 0.00000
|
|
178 12D-2 -0.00003 0.00014 -0.00012 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
186 14F 0 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
190 14F-2 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00042 0.00036 -0.00032 0.00000 -0.00001
|
|
203 2S -0.00100 0.00093 -0.00083 -0.00001 -0.00001
|
|
204 3S -0.00186 0.00163 -0.00142 -0.00002 -0.00002
|
|
205 4S -0.00169 -0.00060 0.00094 0.00002 -0.00002
|
|
206 5S -0.00033 0.00030 -0.00020 0.00000 0.00000
|
|
207 6PX -0.00001 0.00002 -0.00001 0.00000 0.00000
|
|
208 6PY -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
209 6PZ -0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
210 7PX -0.00003 0.00008 -0.00008 0.00000 0.00000
|
|
211 7PY -0.00004 0.00002 -0.00003 0.00000 0.00000
|
|
212 7PZ -0.00003 -0.00006 0.00006 0.00000 0.00000
|
|
213 8PX -0.00008 0.00008 -0.00007 0.00000 0.00000
|
|
214 8PY -0.00011 -0.00006 0.00000 0.00000 0.00000
|
|
215 8PZ -0.00009 -0.00033 0.00032 0.00001 0.00000
|
|
216 9PX -0.00007 -0.00049 0.00052 0.00001 0.00000
|
|
217 9PY -0.00013 -0.00042 0.00035 0.00000 0.00000
|
|
218 9PZ -0.00004 -0.00063 0.00062 0.00001 0.00000
|
|
219 10D 0 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
223 10D-2 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
224 11D 0 0.00000 -0.00002 0.00002 0.00000 0.00000
|
|
225 11D+1 -0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
226 11D-1 -0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00002 -0.00002 0.00000 0.00000
|
|
228 11D-2 -0.00001 0.00002 -0.00002 0.00000 0.00000
|
|
229 12D 0 0.00001 -0.00003 0.00003 0.00000 0.00000
|
|
230 12D+1 -0.00002 -0.00012 0.00012 0.00000 0.00000
|
|
231 12D-1 -0.00001 -0.00008 0.00007 0.00000 0.00000
|
|
232 12D+2 0.00001 -0.00004 0.00006 0.00000 0.00000
|
|
233 12D-2 -0.00003 -0.00014 0.00012 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
241 14F 0 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
242 14F+1 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
245 14F-2 -0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 112 113 114 115
|
|
111 10D-1 0.00000
|
|
112 10D+2 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00001 0.00000 -0.00001 -0.00002 0.00000
|
|
148 2S 0.00002 0.00000 -0.00003 -0.00004 0.00001
|
|
149 3S 0.00004 0.00000 -0.00006 -0.00007 0.00002
|
|
150 4S 0.00003 0.00004 -0.00006 0.00004 0.00002
|
|
151 5S 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
161 9PX 0.00000 -0.00001 0.00000 -0.00002 0.00000
|
|
162 9PY -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
163 9PZ 0.00000 0.00001 0.00000 0.00002 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 0.00000 0.00001 -0.00002 0.00000
|
|
203 2S 0.00002 0.00000 0.00003 -0.00004 -0.00001
|
|
204 3S 0.00004 0.00000 0.00006 -0.00007 -0.00002
|
|
205 4S 0.00003 0.00004 0.00006 0.00004 -0.00002
|
|
206 5S 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
216 9PX 0.00000 0.00001 0.00000 0.00002 0.00000
|
|
217 9PY -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
218 9PZ 0.00000 0.00001 0.00000 0.00002 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 117 118 119 120
|
|
116 11D-1 0.00001
|
|
117 11D+2 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00001 -0.00001 -0.00004 0.00000 0.00002
|
|
148 2S 0.00003 -0.00003 -0.00009 -0.00001 0.00006
|
|
149 3S 0.00006 -0.00005 -0.00016 -0.00001 0.00011
|
|
150 4S 0.00002 0.00010 -0.00014 0.00011 0.00010
|
|
151 5S 0.00003 0.00001 -0.00003 0.00001 0.00002
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00001 0.00001 0.00000 0.00000
|
|
159 8PY -0.00001 -0.00002 -0.00001 -0.00001 0.00001
|
|
160 8PZ -0.00001 0.00001 -0.00001 0.00001 0.00001
|
|
161 9PX 0.00002 -0.00003 0.00001 -0.00003 0.00000
|
|
162 9PY -0.00003 0.00000 -0.00001 0.00000 0.00001
|
|
163 9PZ -0.00002 0.00003 0.00000 0.00003 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
178 12D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 -0.00001 0.00004 0.00000 -0.00002
|
|
203 2S 0.00003 -0.00003 0.00009 -0.00001 -0.00006
|
|
204 3S 0.00006 -0.00005 0.00016 -0.00001 -0.00011
|
|
205 4S 0.00002 0.00010 0.00014 0.00011 -0.00010
|
|
206 5S 0.00003 0.00001 0.00003 0.00001 -0.00002
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
214 8PY -0.00001 -0.00002 0.00001 -0.00001 -0.00001
|
|
215 8PZ -0.00001 0.00001 0.00001 0.00001 -0.00001
|
|
216 9PX -0.00002 0.00003 0.00001 0.00003 0.00000
|
|
217 9PY -0.00003 0.00000 0.00001 0.00000 -0.00001
|
|
218 9PZ -0.00002 0.00003 0.00000 0.00003 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
233 12D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 122 123 124 125
|
|
121 12D-1 0.00004
|
|
122 12D+2 0.00004 0.00004
|
|
123 12D-2 0.00000 0.00000 0.00001
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00001 0.00001 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00007 0.00004 -0.00011 0.00000 0.00000
|
|
148 2S 0.00018 0.00013 -0.00027 0.00000 0.00000
|
|
149 3S 0.00032 0.00021 -0.00049 0.00001 0.00000
|
|
150 4S -0.00017 -0.00021 -0.00045 0.00001 0.00000
|
|
151 5S 0.00006 0.00005 -0.00009 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX -0.00002 -0.00001 0.00001 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
157 7PZ -0.00001 -0.00002 -0.00001 0.00000 0.00000
|
|
158 8PX -0.00001 0.00000 0.00002 0.00000 0.00000
|
|
159 8PY -0.00001 -0.00002 -0.00003 0.00000 0.00000
|
|
160 8PZ -0.00008 -0.00008 -0.00002 0.00000 0.00000
|
|
161 9PX 0.00012 0.00012 0.00002 0.00000 0.00000
|
|
162 9PY -0.00009 -0.00009 -0.00003 0.00000 0.00000
|
|
163 9PZ -0.00014 -0.00014 -0.00001 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00001 0.00001 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00003 0.00003 0.00000 0.00000 0.00000
|
|
176 12D-1 -0.00002 -0.00002 0.00000 0.00000 0.00000
|
|
177 12D+2 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00003 0.00003 0.00001 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00007 0.00004 0.00011 0.00000 0.00000
|
|
203 2S 0.00018 0.00013 0.00027 0.00000 0.00000
|
|
204 3S 0.00032 0.00021 0.00049 0.00001 0.00000
|
|
205 4S -0.00017 -0.00021 0.00045 0.00001 0.00000
|
|
206 5S 0.00006 0.00005 0.00009 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00002 0.00001 0.00001 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
212 7PZ -0.00001 -0.00002 0.00001 0.00000 0.00000
|
|
213 8PX 0.00001 0.00000 0.00002 0.00000 0.00000
|
|
214 8PY -0.00001 -0.00002 0.00003 0.00000 0.00000
|
|
215 8PZ -0.00008 -0.00008 0.00002 0.00000 0.00000
|
|
216 9PX -0.00012 -0.00012 0.00002 0.00000 0.00000
|
|
217 9PY -0.00009 -0.00009 0.00003 0.00000 0.00000
|
|
218 9PZ -0.00014 -0.00014 0.00001 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 -0.00003 -0.00003 0.00000 0.00000 0.00000
|
|
231 12D-1 -0.00002 -0.00002 0.00000 0.00000 0.00000
|
|
232 12D+2 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
233 12D-2 -0.00003 -0.00003 0.00001 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 127 128 129 130
|
|
126 13F-1 0.00000
|
|
127 13F+2 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
148 2S 0.00001 0.00001 -0.00001 -0.00001 0.00000
|
|
149 3S 0.00002 0.00002 -0.00001 -0.00002 0.00000
|
|
150 4S -0.00001 0.00001 -0.00001 -0.00002 -0.00002
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
203 2S 0.00001 0.00001 0.00001 0.00001 0.00000
|
|
204 3S 0.00002 0.00002 0.00001 0.00002 0.00000
|
|
205 4S -0.00001 0.00001 0.00001 0.00002 -0.00002
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 132 133 134 135
|
|
131 14F 0 0.00000
|
|
132 14F+1 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00001 -0.00001 0.00000 0.00001 0.00000
|
|
148 2S 0.00002 -0.00001 0.00000 0.00003 0.00000
|
|
149 3S 0.00004 -0.00003 -0.00001 0.00005 -0.00001
|
|
150 4S 0.00001 -0.00002 -0.00003 0.00001 -0.00001
|
|
151 5S 0.00001 0.00000 0.00000 0.00001 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
160 8PZ -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
161 9PX 0.00001 0.00000 0.00001 0.00001 0.00000
|
|
162 9PY -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
163 9PZ -0.00001 0.00000 -0.00001 -0.00002 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 0.00001 0.00000 0.00001 0.00000
|
|
203 2S 0.00002 0.00001 0.00000 0.00003 0.00000
|
|
204 3S 0.00004 0.00003 -0.00001 0.00005 0.00001
|
|
205 4S 0.00001 0.00002 -0.00003 0.00001 0.00001
|
|
206 5S 0.00001 0.00000 0.00000 0.00001 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
215 8PZ -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
216 9PX -0.00001 0.00000 -0.00001 -0.00001 0.00000
|
|
217 9PY -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
218 9PZ -0.00001 0.00000 -0.00001 -0.00002 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 137 138 139 140
|
|
136 14F+3 0.00000
|
|
137 14F-3 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
148 2S -0.00002 -0.00004 0.00000 0.00000 0.00000
|
|
149 3S -0.00004 -0.00007 0.00000 0.00000 -0.00001
|
|
150 4S -0.00004 0.00002 0.00000 0.00000 0.00000
|
|
151 5S -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
203 2S 0.00002 -0.00004 0.00000 0.00000 0.00000
|
|
204 3S 0.00004 -0.00007 0.00000 0.00000 -0.00001
|
|
205 4S 0.00004 0.00002 0.00000 0.00000 0.00000
|
|
206 5S 0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 142 143 144 145
|
|
141 15G+2 0.00000
|
|
142 15G-2 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 147 148 149 150
|
|
146 15G-4 0.00000
|
|
147 3 H 1S 0.00000 0.00212
|
|
148 2S 0.00000 0.00501 0.01181
|
|
149 3S 0.00001 0.00914 0.02155 0.03935
|
|
150 4S 0.00001 0.00647 0.01512 0.02809 0.02864
|
|
151 5S 0.00000 0.00131 0.00312 0.00574 0.00470
|
|
152 6PX 0.00000 -0.00008 -0.00018 -0.00032 -0.00021
|
|
153 6PY 0.00000 0.00004 0.00010 0.00019 0.00012
|
|
154 6PZ 0.00000 0.00004 0.00008 0.00015 0.00019
|
|
155 7PX 0.00000 -0.00025 -0.00058 -0.00105 -0.00055
|
|
156 7PY 0.00000 0.00014 0.00034 0.00061 0.00032
|
|
157 7PZ 0.00000 0.00011 0.00025 0.00046 0.00060
|
|
158 8PX 0.00000 -0.00068 -0.00159 -0.00289 -0.00195
|
|
159 8PY 0.00000 0.00039 0.00092 0.00167 0.00112
|
|
160 8PZ 0.00000 0.00031 0.00067 0.00129 0.00216
|
|
161 9PX 0.00000 -0.00026 -0.00055 -0.00111 -0.00281
|
|
162 9PY 0.00000 0.00015 0.00032 0.00064 0.00162
|
|
163 9PZ 0.00000 -0.00008 -0.00025 -0.00035 0.00192
|
|
164 10D 0 0.00000 -0.00001 -0.00003 -0.00005 0.00000
|
|
165 10D+1 0.00000 -0.00002 -0.00004 -0.00008 -0.00009
|
|
166 10D-1 0.00000 0.00001 0.00003 0.00005 0.00005
|
|
167 10D+2 0.00000 0.00001 0.00003 0.00006 0.00003
|
|
168 10D-2 0.00000 -0.00002 -0.00005 -0.00010 -0.00006
|
|
169 11D 0 0.00000 -0.00003 -0.00007 -0.00013 -0.00001
|
|
170 11D+1 0.00000 -0.00007 -0.00015 -0.00028 -0.00029
|
|
171 11D-1 0.00000 0.00004 0.00009 0.00016 0.00017
|
|
172 11D+2 0.00000 0.00004 0.00010 0.00018 0.00009
|
|
173 11D-2 0.00000 -0.00007 -0.00018 -0.00032 -0.00016
|
|
174 12D 0 0.00000 -0.00007 -0.00018 -0.00032 -0.00017
|
|
175 12D+1 0.00000 -0.00005 -0.00010 -0.00020 -0.00058
|
|
176 12D-1 0.00000 0.00003 0.00006 0.00012 0.00034
|
|
177 12D+2 0.00000 0.00003 0.00005 0.00011 0.00030
|
|
178 12D-2 0.00000 -0.00005 -0.00009 -0.00019 -0.00052
|
|
179 13F 0 0.00000 -0.00001 -0.00002 -0.00004 -0.00003
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
182 13F+2 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
183 13F-2 0.00000 -0.00001 -0.00002 -0.00004 -0.00004
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00001 0.00003 0.00005 0.00002
|
|
186 14F 0 0.00000 -0.00002 -0.00006 -0.00010 -0.00012
|
|
187 14F+1 0.00000 0.00001 0.00002 0.00004 0.00002
|
|
188 14F-1 0.00000 -0.00001 -0.00001 -0.00002 -0.00001
|
|
189 14F+2 0.00000 0.00002 0.00003 0.00006 0.00008
|
|
190 14F-2 0.00000 -0.00003 -0.00006 -0.00011 -0.00013
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00002 0.00004 0.00008 0.00015
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
194 15G+1 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
195 15G-1 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
200 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
201 15G-4 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
202 4 H 1S 0.00000 -0.00022 -0.00055 -0.00116 -0.00292
|
|
203 2S 0.00000 -0.00055 -0.00137 -0.00285 -0.00713
|
|
204 3S -0.00001 -0.00116 -0.00285 -0.00581 -0.01311
|
|
205 4S -0.00001 -0.00292 -0.00713 -0.01311 -0.00894
|
|
206 5S 0.00000 -0.00053 -0.00126 -0.00236 -0.00269
|
|
207 6PX 0.00000 0.00002 0.00004 0.00006 -0.00003
|
|
208 6PY 0.00000 -0.00002 -0.00005 -0.00009 -0.00013
|
|
209 6PZ 0.00000 -0.00002 -0.00004 -0.00008 -0.00002
|
|
210 7PX 0.00000 0.00008 0.00020 0.00034 -0.00010
|
|
211 7PY 0.00000 -0.00006 -0.00014 -0.00027 -0.00048
|
|
212 7PZ 0.00000 -0.00005 -0.00013 -0.00023 -0.00003
|
|
213 8PX 0.00000 0.00024 0.00054 0.00095 0.00017
|
|
214 8PY 0.00000 -0.00024 -0.00059 -0.00112 -0.00142
|
|
215 8PZ 0.00000 -0.00019 -0.00050 -0.00088 0.00017
|
|
216 9PX 0.00000 -0.00010 -0.00031 -0.00048 0.00136
|
|
217 9PY 0.00000 -0.00055 -0.00133 -0.00242 -0.00117
|
|
218 9PZ 0.00000 -0.00032 -0.00083 -0.00142 0.00094
|
|
219 10D 0 0.00000 0.00000 -0.00001 -0.00002 0.00002
|
|
220 10D+1 0.00000 0.00000 -0.00001 -0.00002 -0.00001
|
|
221 10D-1 0.00000 -0.00001 -0.00002 -0.00004 -0.00003
|
|
222 10D+2 0.00000 0.00001 0.00003 0.00006 0.00003
|
|
223 10D-2 0.00000 -0.00001 -0.00001 -0.00003 -0.00006
|
|
224 11D 0 0.00000 -0.00002 -0.00004 -0.00007 0.00004
|
|
225 11D+1 0.00000 -0.00001 -0.00002 -0.00005 -0.00001
|
|
226 11D-1 0.00000 -0.00001 -0.00003 -0.00005 -0.00002
|
|
227 11D+2 0.00000 0.00004 0.00009 0.00016 0.00008
|
|
228 11D-2 0.00000 -0.00001 -0.00001 -0.00004 -0.00016
|
|
229 12D 0 0.00000 0.00000 -0.00001 -0.00001 0.00011
|
|
230 12D+1 0.00000 -0.00005 -0.00013 -0.00022 0.00020
|
|
231 12D-1 0.00000 -0.00006 -0.00014 -0.00025 0.00000
|
|
232 12D+2 0.00000 0.00008 0.00017 0.00032 0.00049
|
|
233 12D-2 0.00000 -0.00009 -0.00024 -0.00043 -0.00004
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
235 13F+1 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
236 13F-1 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 -0.00001 -0.00002 -0.00002
|
|
239 13F+3 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
241 14F 0 0.00000 0.00001 0.00002 0.00004 0.00001
|
|
242 14F+1 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
243 14F-1 0.00000 0.00001 0.00001 0.00003 0.00004
|
|
244 14F+2 0.00000 0.00000 -0.00001 -0.00002 0.00000
|
|
245 14F-2 0.00000 -0.00001 -0.00002 -0.00004 -0.00001
|
|
246 14F+3 0.00000 0.00001 0.00002 0.00004 0.00004
|
|
247 14F-3 0.00000 -0.00001 -0.00004 -0.00007 0.00002
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 152 153 154 155
|
|
151 5S 0.00100
|
|
152 6PX -0.00004 0.00000
|
|
153 6PY 0.00002 0.00000 0.00000
|
|
154 6PZ 0.00002 0.00000 0.00000 0.00000
|
|
155 7PX -0.00013 0.00001 0.00000 0.00000 0.00004
|
|
156 7PY 0.00007 0.00000 0.00000 0.00000 -0.00002
|
|
157 7PZ 0.00007 0.00000 0.00000 0.00001 -0.00001
|
|
158 8PX -0.00034 0.00003 -0.00001 -0.00001 0.00009
|
|
159 8PY 0.00020 -0.00001 0.00001 0.00001 -0.00004
|
|
160 8PZ 0.00019 -0.00001 0.00001 0.00002 -0.00001
|
|
161 9PX -0.00019 0.00001 0.00000 -0.00003 0.00000
|
|
162 9PY 0.00011 0.00000 0.00001 0.00002 0.00002
|
|
163 9PZ -0.00001 0.00001 0.00000 0.00002 0.00005
|
|
164 10D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 -0.00001 0.00000 0.00000 0.00000 0.00001
|
|
170 11D+1 -0.00004 0.00000 0.00000 0.00000 0.00001
|
|
171 11D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00002 0.00000 0.00000 0.00000 -0.00001
|
|
173 11D-2 -0.00004 0.00000 0.00000 0.00000 0.00001
|
|
174 12D 0 -0.00004 0.00000 0.00000 0.00000 0.00001
|
|
175 12D+1 -0.00003 0.00000 0.00000 -0.00001 0.00000
|
|
176 12D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 -0.00002 0.00000 0.00000 -0.00001 0.00000
|
|
179 13F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00053 -0.00002 -0.00002 -0.00002 -0.00008
|
|
203 2S -0.00126 -0.00004 -0.00005 -0.00004 -0.00020
|
|
204 3S -0.00236 -0.00006 -0.00009 -0.00008 -0.00034
|
|
205 4S -0.00269 0.00003 -0.00013 -0.00002 0.00010
|
|
206 5S -0.00045 0.00001 -0.00003 -0.00002 0.00000
|
|
207 6PX -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
208 6PY -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
211 7PY -0.00008 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX -0.00001 -0.00002 0.00000 0.00000 -0.00006
|
|
214 8PY -0.00030 0.00000 0.00000 -0.00001 0.00001
|
|
215 8PZ -0.00019 0.00000 -0.00001 0.00001 0.00002
|
|
216 9PX -0.00010 0.00000 -0.00001 0.00002 0.00002
|
|
217 9PY -0.00044 0.00002 -0.00001 0.00000 0.00007
|
|
218 9PZ -0.00020 0.00001 -0.00001 0.00002 0.00007
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00002 0.00000 0.00000 0.00000 -0.00001
|
|
228 11D-2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00001 0.00000 0.00000 0.00000 0.00001
|
|
230 12D+1 -0.00004 0.00000 0.00000 0.00000 0.00001
|
|
231 12D-1 -0.00005 0.00000 0.00000 0.00000 0.00001
|
|
232 12D+2 0.00005 0.00000 0.00000 0.00000 -0.00001
|
|
233 12D-2 -0.00009 0.00000 0.00000 0.00000 0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 157 158 159 160
|
|
156 7PY 0.00002
|
|
157 7PZ 0.00000 0.00002
|
|
158 8PX -0.00004 -0.00004 0.00028
|
|
159 8PY 0.00005 0.00002 -0.00011 0.00015
|
|
160 8PZ 0.00001 0.00006 -0.00013 0.00007 0.00027
|
|
161 9PX 0.00002 -0.00009 0.00015 -0.00002 -0.00041
|
|
162 9PY 0.00002 0.00005 -0.00002 0.00013 0.00023
|
|
163 9PZ -0.00003 0.00008 -0.00001 0.00000 0.00037
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00001 0.00000 -0.00001
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00001 -0.00001 0.00001
|
|
170 11D+1 0.00000 -0.00001 0.00003 -0.00001 -0.00003
|
|
171 11D-1 0.00000 0.00000 -0.00001 0.00001 0.00002
|
|
172 11D+2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
173 11D-2 -0.00001 0.00000 0.00002 -0.00002 0.00000
|
|
174 12D 0 -0.00001 0.00000 0.00002 -0.00001 0.00000
|
|
175 12D+1 0.00000 -0.00002 0.00003 -0.00001 -0.00009
|
|
176 12D-1 0.00000 0.00001 -0.00001 0.00001 0.00005
|
|
177 12D+2 -0.00001 0.00001 -0.00003 -0.00001 0.00005
|
|
178 12D-2 0.00000 -0.00002 0.00002 -0.00003 -0.00008
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00001 -0.00001 -0.00001
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
190 14F-2 0.00000 0.00000 0.00001 -0.00001 -0.00001
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 -0.00001 0.00000 0.00002
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00006 -0.00005 -0.00024 -0.00024 -0.00019
|
|
203 2S -0.00014 -0.00013 -0.00054 -0.00059 -0.00050
|
|
204 3S -0.00027 -0.00023 -0.00095 -0.00112 -0.00088
|
|
205 4S -0.00048 -0.00003 -0.00017 -0.00142 0.00017
|
|
206 5S -0.00008 -0.00005 0.00001 -0.00030 -0.00019
|
|
207 6PX 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
209 6PZ 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
210 7PX 0.00000 0.00000 -0.00006 -0.00001 -0.00002
|
|
211 7PY 0.00000 -0.00001 0.00000 -0.00001 -0.00003
|
|
212 7PZ -0.00001 0.00001 -0.00001 -0.00002 0.00003
|
|
213 8PX 0.00000 0.00001 -0.00020 -0.00001 0.00003
|
|
214 8PY -0.00001 -0.00002 0.00001 -0.00002 -0.00006
|
|
215 8PZ -0.00003 0.00003 -0.00003 -0.00006 0.00017
|
|
216 9PX -0.00005 0.00007 -0.00008 -0.00008 0.00033
|
|
217 9PY -0.00004 0.00001 0.00011 -0.00006 0.00009
|
|
218 9PZ -0.00005 0.00006 0.00004 -0.00006 0.00032
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
225 11D+1 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
226 11D-1 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
227 11D+2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 -0.00001 0.00000 -0.00001
|
|
229 12D 0 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
230 12D+1 -0.00001 0.00001 -0.00001 -0.00001 0.00007
|
|
231 12D-1 -0.00001 0.00001 0.00000 -0.00001 0.00003
|
|
232 12D+2 0.00000 0.00001 -0.00004 0.00000 0.00006
|
|
233 12D-2 -0.00001 0.00001 0.00001 -0.00001 0.00005
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 162 163 164 165
|
|
161 9PX 0.00066
|
|
162 9PY -0.00029 0.00032
|
|
163 9PZ -0.00060 0.00035 0.00065
|
|
164 10D 0 -0.00001 0.00000 0.00001 0.00000
|
|
165 10D+1 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 -0.00002 0.00001 0.00002 0.00000 0.00000
|
|
170 11D+1 0.00004 -0.00002 -0.00003 0.00000 0.00000
|
|
171 11D-1 -0.00002 0.00001 0.00002 0.00000 0.00000
|
|
172 11D+2 0.00000 -0.00001 -0.00001 0.00000 0.00000
|
|
173 11D-2 -0.00001 0.00000 0.00002 0.00000 0.00000
|
|
174 12D 0 -0.00001 0.00000 0.00002 0.00000 0.00000
|
|
175 12D+1 0.00014 -0.00008 -0.00014 0.00000 0.00000
|
|
176 12D-1 -0.00008 0.00005 0.00008 0.00000 0.00000
|
|
177 12D+2 -0.00009 0.00001 0.00007 0.00000 0.00000
|
|
178 12D-2 0.00012 -0.00009 -0.00013 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00002 -0.00001 -0.00001 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 -0.00001 0.00001 0.00001 0.00000 0.00000
|
|
190 14F-2 0.00002 -0.00001 -0.00002 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00003 0.00002 0.00003 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00010 -0.00055 -0.00032 0.00000 0.00000
|
|
203 2S 0.00031 -0.00133 -0.00083 -0.00001 0.00001
|
|
204 3S 0.00048 -0.00242 -0.00142 -0.00002 0.00002
|
|
205 4S -0.00136 -0.00117 0.00094 0.00002 0.00001
|
|
206 5S 0.00010 -0.00044 -0.00020 0.00000 0.00001
|
|
207 6PX 0.00000 -0.00002 -0.00001 0.00000 0.00000
|
|
208 6PY 0.00001 -0.00001 -0.00001 0.00000 0.00000
|
|
209 6PZ -0.00002 0.00000 0.00002 0.00000 0.00000
|
|
210 7PX 0.00002 -0.00007 -0.00007 0.00000 0.00000
|
|
211 7PY 0.00005 -0.00004 -0.00005 0.00000 0.00000
|
|
212 7PZ -0.00007 0.00001 0.00006 0.00000 0.00000
|
|
213 8PX -0.00008 -0.00011 -0.00004 0.00000 0.00000
|
|
214 8PY 0.00008 -0.00006 -0.00006 0.00000 0.00000
|
|
215 8PZ -0.00033 0.00009 0.00032 0.00001 0.00000
|
|
216 9PX -0.00060 0.00018 0.00057 0.00001 -0.00001
|
|
217 9PY -0.00018 0.00011 0.00028 0.00001 0.00000
|
|
218 9PZ -0.00057 0.00028 0.00062 0.00001 0.00000
|
|
219 10D 0 -0.00001 0.00001 0.00001 0.00000 0.00000
|
|
220 10D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00001 -0.00001 -0.00001 0.00000 0.00000
|
|
224 11D 0 -0.00002 0.00001 0.00002 0.00000 0.00000
|
|
225 11D+1 -0.00003 0.00000 0.00002 0.00000 0.00000
|
|
226 11D-1 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
227 11D+2 0.00000 -0.00001 -0.00001 0.00000 0.00000
|
|
228 11D-2 0.00002 -0.00002 -0.00002 0.00000 0.00000
|
|
229 12D 0 -0.00002 0.00002 0.00003 0.00000 0.00000
|
|
230 12D+1 -0.00012 0.00005 0.00013 0.00000 0.00000
|
|
231 12D-1 -0.00006 0.00003 0.00007 0.00000 0.00000
|
|
232 12D+2 -0.00010 0.00003 0.00008 0.00000 0.00000
|
|
233 12D-2 -0.00010 0.00005 0.00011 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
241 14F 0 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
245 14F-2 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00002 0.00001 0.00002 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 167 168 169 170
|
|
166 10D-1 0.00000
|
|
167 10D+2 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00001 0.00001 0.00001 -0.00002 0.00001
|
|
203 2S -0.00002 0.00003 0.00001 -0.00004 0.00002
|
|
204 3S -0.00004 0.00006 0.00003 -0.00007 0.00005
|
|
205 4S -0.00003 0.00003 0.00006 0.00004 0.00001
|
|
206 5S -0.00001 0.00001 0.00001 0.00000 0.00002
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00001 0.00000 -0.00001 -0.00001
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
216 9PX 0.00000 0.00000 0.00001 0.00002 -0.00003
|
|
217 9PY 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00001 0.00002 -0.00002
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 172 173 174 175
|
|
171 11D-1 0.00000
|
|
172 11D+2 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00003
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00003
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00001 0.00004 0.00001 0.00000 0.00005
|
|
203 2S -0.00003 0.00009 0.00001 -0.00001 0.00013
|
|
204 3S -0.00005 0.00016 0.00004 -0.00001 0.00022
|
|
205 4S -0.00002 0.00008 0.00016 0.00011 -0.00020
|
|
206 5S -0.00002 0.00002 0.00002 0.00001 0.00004
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00001 0.00000 -0.00001 0.00001
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
213 8PX 0.00001 0.00002 -0.00001 -0.00001 -0.00001
|
|
214 8PY 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
215 8PZ 0.00001 0.00000 0.00001 0.00001 -0.00007
|
|
216 9PX 0.00001 0.00000 0.00002 0.00002 -0.00012
|
|
217 9PY 0.00000 -0.00001 0.00002 0.00002 -0.00005
|
|
218 9PZ 0.00001 -0.00001 0.00002 0.00003 -0.00013
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 -0.00003
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00001 -0.00002
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 177 178 179 180
|
|
176 12D-1 0.00001
|
|
177 12D+2 0.00001 0.00002
|
|
178 12D-2 -0.00002 -0.00001 0.00003
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00006 0.00008 0.00009 0.00000 0.00000
|
|
203 2S -0.00014 0.00017 0.00024 0.00000 0.00001
|
|
204 3S -0.00025 0.00032 0.00043 0.00001 0.00001
|
|
205 4S 0.00000 0.00049 0.00004 0.00001 -0.00001
|
|
206 5S -0.00005 0.00005 0.00009 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX -0.00001 0.00001 0.00001 0.00000 0.00000
|
|
211 7PY -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
212 7PZ 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
213 8PX 0.00000 0.00004 0.00001 0.00000 0.00000
|
|
214 8PY -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
215 8PZ 0.00003 0.00006 -0.00005 0.00000 0.00000
|
|
216 9PX 0.00006 0.00010 -0.00010 0.00000 0.00000
|
|
217 9PY 0.00003 0.00003 -0.00005 0.00000 0.00000
|
|
218 9PZ 0.00007 0.00008 -0.00011 0.00000 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
230 12D+1 0.00001 0.00002 -0.00002 0.00000 0.00000
|
|
231 12D-1 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
232 12D+2 0.00001 0.00002 -0.00001 0.00000 0.00000
|
|
233 12D-2 0.00001 0.00001 -0.00002 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 182 183 184 185
|
|
181 13F-1 0.00000
|
|
182 13F+2 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
203 2S 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
204 3S -0.00001 0.00000 0.00002 -0.00002 0.00000
|
|
205 4S 0.00001 0.00000 0.00002 -0.00002 -0.00002
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 187 188 189 190
|
|
186 14F 0 0.00000
|
|
187 14F+1 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 0.00000 0.00001 0.00000 0.00001
|
|
203 2S 0.00002 0.00000 0.00001 -0.00001 0.00002
|
|
204 3S 0.00004 0.00001 0.00003 -0.00002 0.00004
|
|
205 4S 0.00001 -0.00001 0.00004 0.00000 0.00001
|
|
206 5S 0.00001 0.00000 0.00001 -0.00001 0.00001
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
216 9PX -0.00001 0.00000 0.00000 0.00001 -0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ -0.00001 -0.00001 0.00000 0.00001 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 192 193 194 195
|
|
191 14F+3 0.00000
|
|
192 14F-3 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
203 2S -0.00002 -0.00004 0.00000 0.00000 0.00000
|
|
204 3S -0.00004 -0.00007 0.00000 0.00000 0.00001
|
|
205 4S -0.00004 0.00002 0.00000 0.00000 0.00000
|
|
206 5S -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 197 198 199 200
|
|
196 15G+2 0.00000
|
|
197 15G-2 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 202 203 204 205
|
|
201 15G-4 0.00000
|
|
202 4 H 1S 0.00000 0.00212
|
|
203 2S 0.00000 0.00501 0.01181
|
|
204 3S 0.00000 0.00914 0.02155 0.03935
|
|
205 4S 0.00000 0.00647 0.01512 0.02809 0.02864
|
|
206 5S 0.00000 0.00131 0.00312 0.00574 0.00470
|
|
207 6PX 0.00000 0.00008 0.00018 0.00032 0.00021
|
|
208 6PY 0.00000 0.00004 0.00010 0.00019 0.00012
|
|
209 6PZ 0.00000 0.00004 0.00008 0.00015 0.00019
|
|
210 7PX 0.00000 0.00025 0.00058 0.00105 0.00055
|
|
211 7PY 0.00000 0.00014 0.00034 0.00061 0.00032
|
|
212 7PZ 0.00000 0.00011 0.00025 0.00046 0.00060
|
|
213 8PX 0.00000 0.00068 0.00159 0.00289 0.00195
|
|
214 8PY 0.00000 0.00039 0.00092 0.00167 0.00112
|
|
215 8PZ 0.00000 0.00031 0.00067 0.00129 0.00216
|
|
216 9PX 0.00000 0.00026 0.00055 0.00111 0.00281
|
|
217 9PY 0.00000 0.00015 0.00032 0.00064 0.00162
|
|
218 9PZ 0.00000 -0.00008 -0.00025 -0.00035 0.00192
|
|
219 10D 0 0.00000 -0.00001 -0.00003 -0.00005 0.00000
|
|
220 10D+1 0.00000 0.00002 0.00004 0.00008 0.00009
|
|
221 10D-1 0.00000 0.00001 0.00003 0.00005 0.00005
|
|
222 10D+2 0.00000 0.00001 0.00003 0.00006 0.00003
|
|
223 10D-2 0.00000 0.00002 0.00005 0.00010 0.00006
|
|
224 11D 0 0.00000 -0.00003 -0.00007 -0.00013 -0.00001
|
|
225 11D+1 0.00000 0.00007 0.00015 0.00028 0.00029
|
|
226 11D-1 0.00000 0.00004 0.00009 0.00016 0.00017
|
|
227 11D+2 0.00000 0.00004 0.00010 0.00018 0.00009
|
|
228 11D-2 0.00000 0.00007 0.00018 0.00032 0.00016
|
|
229 12D 0 0.00000 -0.00007 -0.00018 -0.00032 -0.00017
|
|
230 12D+1 0.00000 0.00005 0.00010 0.00020 0.00058
|
|
231 12D-1 0.00000 0.00003 0.00006 0.00012 0.00034
|
|
232 12D+2 0.00000 0.00003 0.00005 0.00011 0.00030
|
|
233 12D-2 0.00000 0.00005 0.00009 0.00019 0.00052
|
|
234 13F 0 0.00000 -0.00001 -0.00002 -0.00004 -0.00003
|
|
235 13F+1 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
237 13F+2 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
238 13F-2 0.00000 0.00001 0.00002 0.00004 0.00004
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00001 0.00003 0.00005 0.00002
|
|
241 14F 0 0.00000 -0.00002 -0.00006 -0.00010 -0.00012
|
|
242 14F+1 0.00000 -0.00001 -0.00002 -0.00004 -0.00002
|
|
243 14F-1 0.00000 -0.00001 -0.00001 -0.00002 -0.00001
|
|
244 14F+2 0.00000 0.00002 0.00003 0.00006 0.00008
|
|
245 14F-2 0.00000 0.00003 0.00006 0.00011 0.00013
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00002 0.00004 0.00008 0.00015
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
249 15G+1 0.00000 0.00000 -0.00001 -0.00002 -0.00002
|
|
250 15G-1 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
255 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
256 15G-4 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
206 207 208 209 210
|
|
206 5S 0.00100
|
|
207 6PX 0.00004 0.00000
|
|
208 6PY 0.00002 0.00000 0.00000
|
|
209 6PZ 0.00002 0.00000 0.00000 0.00000
|
|
210 7PX 0.00013 0.00001 0.00000 0.00000 0.00004
|
|
211 7PY 0.00007 0.00000 0.00000 0.00000 0.00002
|
|
212 7PZ 0.00007 0.00000 0.00000 0.00001 0.00001
|
|
213 8PX 0.00034 0.00003 0.00001 0.00001 0.00009
|
|
214 8PY 0.00020 0.00001 0.00001 0.00001 0.00004
|
|
215 8PZ 0.00019 0.00001 0.00001 0.00002 0.00001
|
|
216 9PX 0.00019 0.00001 0.00000 0.00003 0.00000
|
|
217 9PY 0.00011 0.00000 0.00001 0.00002 -0.00002
|
|
218 9PZ -0.00001 -0.00001 0.00000 0.00002 -0.00005
|
|
219 10D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
225 11D+1 0.00004 0.00000 0.00000 0.00000 0.00001
|
|
226 11D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00002 0.00000 0.00000 0.00000 0.00001
|
|
228 11D-2 0.00004 0.00000 0.00000 0.00000 0.00001
|
|
229 12D 0 -0.00004 0.00000 0.00000 0.00000 -0.00001
|
|
230 12D+1 0.00003 0.00000 0.00000 0.00001 0.00000
|
|
231 12D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00002 0.00000 0.00000 0.00001 0.00000
|
|
234 13F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 212 213 214 215
|
|
211 7PY 0.00002
|
|
212 7PZ 0.00000 0.00002
|
|
213 8PX 0.00004 0.00004 0.00028
|
|
214 8PY 0.00005 0.00002 0.00011 0.00015
|
|
215 8PZ 0.00001 0.00006 0.00013 0.00007 0.00027
|
|
216 9PX -0.00002 0.00009 0.00015 0.00002 0.00041
|
|
217 9PY 0.00002 0.00005 0.00002 0.00013 0.00023
|
|
218 9PZ -0.00003 0.00008 0.00001 0.00000 0.00037
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
224 11D 0 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
225 11D+1 0.00000 0.00001 0.00003 0.00001 0.00003
|
|
226 11D-1 0.00000 0.00000 0.00001 0.00001 0.00002
|
|
227 11D+2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
228 11D-2 0.00001 0.00000 0.00002 0.00002 0.00000
|
|
229 12D 0 -0.00001 0.00000 -0.00002 -0.00001 0.00000
|
|
230 12D+1 0.00000 0.00002 0.00003 0.00001 0.00009
|
|
231 12D-1 0.00000 0.00001 0.00001 0.00001 0.00005
|
|
232 12D+2 -0.00001 0.00001 0.00003 -0.00001 0.00005
|
|
233 12D-2 0.00000 0.00002 0.00002 0.00003 0.00008
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
245 14F-2 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00001 0.00000 0.00002
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 217 218 219 220
|
|
216 9PX 0.00066
|
|
217 9PY 0.00029 0.00032
|
|
218 9PZ 0.00060 0.00035 0.00065
|
|
219 10D 0 0.00001 0.00000 0.00001 0.00000
|
|
220 10D+1 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00002 0.00001 0.00002 0.00000 0.00000
|
|
225 11D+1 0.00004 0.00002 0.00003 0.00000 0.00000
|
|
226 11D-1 0.00002 0.00001 0.00002 0.00000 0.00000
|
|
227 11D+2 0.00000 -0.00001 -0.00001 0.00000 0.00000
|
|
228 11D-2 -0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
229 12D 0 0.00001 0.00000 0.00002 0.00000 0.00000
|
|
230 12D+1 0.00014 0.00008 0.00014 0.00000 0.00000
|
|
231 12D-1 0.00008 0.00005 0.00008 0.00000 0.00000
|
|
232 12D+2 0.00009 0.00001 0.00007 0.00000 0.00000
|
|
233 12D-2 0.00012 0.00009 0.00013 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00002 -0.00001 -0.00001 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00001 0.00001 0.00001 0.00000 0.00000
|
|
245 14F-2 0.00002 0.00001 0.00002 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00003 0.00002 0.00003 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 222 223 224 225
|
|
221 10D-1 0.00000
|
|
222 10D+2 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 227 228 229 230
|
|
226 11D-1 0.00000
|
|
227 11D+2 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00003
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00003
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 232 233 234 235
|
|
231 12D-1 0.00001
|
|
232 12D+2 0.00001 0.00002
|
|
233 12D-2 0.00002 0.00001 0.00003
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 237 238 239 240
|
|
236 13F-1 0.00000
|
|
237 13F+2 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 242 243 244 245
|
|
241 14F 0 0.00000
|
|
242 14F+1 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 247 248 249 250
|
|
246 14F+3 0.00000
|
|
247 14F-3 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 252 253 254 255
|
|
251 15G+2 0.00000
|
|
252 15G-2 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256
|
|
256 15G-4 0.00000
|
|
Beta Density Matrix:
|
|
1 2 3 4 5
|
|
1 1 N 1S 0.33459
|
|
2 2S -0.26274 0.21772
|
|
3 3S 0.04125 -0.03170 0.00514
|
|
4 4S -0.03421 0.05890 -0.00228 0.09352
|
|
5 5S -0.04362 0.07672 -0.00291 0.12384 0.16462
|
|
6 6S -0.01095 0.01920 -0.00099 0.03101 0.04292
|
|
7 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
8 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
9 7PZ -0.00315 0.00486 0.00018 0.00686 0.00628
|
|
10 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
11 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
12 8PZ -0.00360 0.00708 0.00056 0.01204 0.01105
|
|
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
14 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
15 9PZ -0.00614 0.01100 0.00077 0.01760 0.01575
|
|
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
17 10PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
18 10PZ -0.00884 0.01561 0.00060 0.02486 0.02524
|
|
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
20 11PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
21 11PZ -0.00773 0.01389 0.00034 0.02247 0.02437
|
|
22 12D 0 -0.00005 0.00001 -0.00001 -0.00007 -0.00008
|
|
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00034 -0.00050 0.00002 -0.00068 -0.00085
|
|
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00074 -0.00124 0.00003 -0.00193 -0.00241
|
|
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00036 -0.00071 -0.00002 -0.00121 -0.00135
|
|
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00001 0.00000 0.00002 0.00004
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00002 -0.00004 0.00000 -0.00008 -0.00012
|
|
49 17F 0 -0.00012 0.00027 -0.00002 0.00049 0.00073
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00022 -0.00043 0.00002 -0.00074 -0.00103
|
|
56 18F 0 -0.00010 0.00031 -0.00001 0.00066 0.00093
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00021 -0.00048 0.00001 -0.00092 -0.00127
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 -0.00001 0.00003 0.00000 0.00006 0.00008
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 -0.00001 -0.00003 0.00000 -0.00011 -0.00017
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 -0.00007 0.00020 0.00000 0.00042 0.00058
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00001 -0.00002 0.00000 -0.00003 -0.00004
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 -0.00001 0.00000 0.00000 -0.00002 -0.00004
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S -0.00191 0.00324 -0.00019 0.00512 0.00720
|
|
93 2S -0.00424 0.00711 -0.00045 0.01111 0.01575
|
|
94 3S -0.00793 0.01299 -0.00084 0.01991 0.02815
|
|
95 4S -0.00561 0.00946 -0.00025 0.01474 0.01862
|
|
96 5S 0.00005 -0.00011 -0.00002 -0.00019 -0.00012
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00011 -0.00019 0.00001 -0.00031 -0.00043
|
|
99 6PZ -0.00007 0.00013 0.00000 0.00021 0.00026
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00038 -0.00062 0.00004 -0.00095 -0.00137
|
|
102 7PZ -0.00026 0.00044 -0.00001 0.00068 0.00085
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00155 -0.00254 0.00014 -0.00386 -0.00528
|
|
105 8PZ -0.00096 0.00174 -0.00002 0.00285 0.00351
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00165 -0.00279 0.00003 -0.00434 -0.00519
|
|
108 9PZ -0.00097 0.00172 0.00003 0.00276 0.00307
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00003 -0.00005 0.00000 -0.00007 -0.00009
|
|
112 10D+2 0.00003 -0.00004 0.00000 -0.00006 -0.00009
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00005 -0.00007 0.00001 -0.00008 -0.00013
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00013 -0.00027 0.00000 -0.00049 -0.00063
|
|
117 11D+2 0.00010 -0.00018 0.00001 -0.00028 -0.00041
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00009 -0.00012 0.00001 -0.00015 -0.00023
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00031 -0.00060 0.00000 -0.00103 -0.00124
|
|
122 12D+2 0.00040 -0.00071 0.00001 -0.00115 -0.00141
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00001 -0.00001 0.00000 -0.00002 -0.00002
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
127 13F+2 0.00001 -0.00002 0.00000 -0.00004 -0.00005
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
131 14F 0 0.00003 -0.00007 0.00000 -0.00015 -0.00019
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 -0.00001 0.00000 0.00000 -0.00002 -0.00003
|
|
134 14F+2 0.00004 -0.00010 0.00000 -0.00020 -0.00026
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 -0.00005 0.00010 0.00000 0.00019 0.00023
|
|
138 15G 0 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00001 0.00000 0.00002 0.00003
|
|
141 15G+2 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00001 0.00000 0.00003 0.00003
|
|
145 15G+4 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00191 0.00324 -0.00019 0.00512 0.00720
|
|
148 2S -0.00424 0.00711 -0.00045 0.01111 0.01575
|
|
149 3S -0.00793 0.01299 -0.00084 0.01991 0.02815
|
|
150 4S -0.00561 0.00946 -0.00025 0.01474 0.01862
|
|
151 5S 0.00005 -0.00011 -0.00002 -0.00019 -0.00012
|
|
152 6PX 0.00009 -0.00017 0.00001 -0.00027 -0.00038
|
|
153 6PY -0.00005 0.00010 -0.00001 0.00016 0.00022
|
|
154 6PZ -0.00007 0.00013 0.00000 0.00021 0.00026
|
|
155 7PX 0.00033 -0.00054 0.00004 -0.00082 -0.00118
|
|
156 7PY -0.00019 0.00031 -0.00002 0.00047 0.00068
|
|
157 7PZ -0.00026 0.00044 -0.00001 0.00068 0.00085
|
|
158 8PX 0.00135 -0.00220 0.00012 -0.00335 -0.00457
|
|
159 8PY -0.00078 0.00127 -0.00007 0.00193 0.00264
|
|
160 8PZ -0.00096 0.00174 -0.00002 0.00285 0.00351
|
|
161 9PX 0.00143 -0.00242 0.00002 -0.00376 -0.00449
|
|
162 9PY -0.00082 0.00140 -0.00001 0.00217 0.00259
|
|
163 9PZ -0.00097 0.00172 0.00003 0.00276 0.00307
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
165 10D+1 0.00003 -0.00004 0.00000 -0.00006 -0.00008
|
|
166 10D-1 -0.00002 0.00003 0.00000 0.00003 0.00004
|
|
167 10D+2 -0.00001 0.00002 0.00000 0.00003 0.00005
|
|
168 10D-2 0.00003 -0.00004 0.00000 -0.00005 -0.00008
|
|
169 11D 0 0.00005 -0.00007 0.00001 -0.00008 -0.00013
|
|
170 11D+1 0.00011 -0.00023 0.00000 -0.00042 -0.00055
|
|
171 11D-1 -0.00006 0.00014 0.00000 0.00024 0.00032
|
|
172 11D+2 -0.00005 0.00009 -0.00001 0.00014 0.00021
|
|
173 11D-2 0.00009 -0.00015 0.00001 -0.00025 -0.00036
|
|
174 12D 0 0.00009 -0.00012 0.00001 -0.00015 -0.00023
|
|
175 12D+1 0.00027 -0.00052 0.00000 -0.00089 -0.00107
|
|
176 12D-1 -0.00016 0.00030 0.00000 0.00051 0.00062
|
|
177 12D+2 -0.00020 0.00036 0.00000 0.00058 0.00071
|
|
178 12D-2 0.00035 -0.00062 0.00001 -0.00100 -0.00122
|
|
179 13F 0 0.00001 -0.00001 0.00000 -0.00002 -0.00002
|
|
180 13F+1 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
182 13F+2 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
183 13F-2 0.00001 -0.00002 0.00000 -0.00003 -0.00004
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
186 14F 0 0.00003 -0.00007 0.00000 -0.00015 -0.00019
|
|
187 14F+1 -0.00001 0.00000 0.00000 -0.00002 -0.00002
|
|
188 14F-1 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
189 14F+2 -0.00002 0.00005 0.00000 0.00010 0.00013
|
|
190 14F-2 0.00003 -0.00009 0.00000 -0.00017 -0.00022
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00005 0.00010 0.00000 0.00019 0.00023
|
|
193 15G 0 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
194 15G+1 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
195 15G-1 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
197 15G-2 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00001 0.00000 0.00003 0.00003
|
|
200 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
201 15G-4 0.00000 -0.00001 0.00000 -0.00002 -0.00002
|
|
202 4 H 1S -0.00191 0.00324 -0.00019 0.00512 0.00720
|
|
203 2S -0.00424 0.00711 -0.00045 0.01111 0.01575
|
|
204 3S -0.00793 0.01299 -0.00084 0.01991 0.02815
|
|
205 4S -0.00561 0.00946 -0.00025 0.01474 0.01862
|
|
206 5S 0.00005 -0.00011 -0.00002 -0.00019 -0.00012
|
|
207 6PX -0.00009 0.00017 -0.00001 0.00027 0.00038
|
|
208 6PY -0.00005 0.00010 -0.00001 0.00016 0.00022
|
|
209 6PZ -0.00007 0.00013 0.00000 0.00021 0.00026
|
|
210 7PX -0.00033 0.00054 -0.00004 0.00082 0.00118
|
|
211 7PY -0.00019 0.00031 -0.00002 0.00047 0.00068
|
|
212 7PZ -0.00026 0.00044 -0.00001 0.00068 0.00085
|
|
213 8PX -0.00135 0.00220 -0.00012 0.00335 0.00457
|
|
214 8PY -0.00078 0.00127 -0.00007 0.00193 0.00264
|
|
215 8PZ -0.00096 0.00174 -0.00002 0.00285 0.00351
|
|
216 9PX -0.00143 0.00242 -0.00002 0.00376 0.00449
|
|
217 9PY -0.00082 0.00140 -0.00001 0.00217 0.00259
|
|
218 9PZ -0.00097 0.00172 0.00003 0.00276 0.00307
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
220 10D+1 -0.00003 0.00004 0.00000 0.00006 0.00008
|
|
221 10D-1 -0.00002 0.00003 0.00000 0.00003 0.00004
|
|
222 10D+2 -0.00001 0.00002 0.00000 0.00003 0.00005
|
|
223 10D-2 -0.00003 0.00004 0.00000 0.00005 0.00008
|
|
224 11D 0 0.00005 -0.00007 0.00001 -0.00008 -0.00013
|
|
225 11D+1 -0.00011 0.00023 0.00000 0.00042 0.00055
|
|
226 11D-1 -0.00006 0.00014 0.00000 0.00024 0.00032
|
|
227 11D+2 -0.00005 0.00009 -0.00001 0.00014 0.00021
|
|
228 11D-2 -0.00009 0.00015 -0.00001 0.00025 0.00036
|
|
229 12D 0 0.00009 -0.00012 0.00001 -0.00015 -0.00023
|
|
230 12D+1 -0.00027 0.00052 0.00000 0.00089 0.00107
|
|
231 12D-1 -0.00016 0.00030 0.00000 0.00051 0.00062
|
|
232 12D+2 -0.00020 0.00036 0.00000 0.00058 0.00071
|
|
233 12D-2 -0.00035 0.00062 -0.00001 0.00100 0.00122
|
|
234 13F 0 0.00001 -0.00001 0.00000 -0.00002 -0.00002
|
|
235 13F+1 0.00000 0.00001 0.00000 0.00001 0.00001
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
237 13F+2 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
238 13F-2 -0.00001 0.00002 0.00000 0.00003 0.00004
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
241 14F 0 0.00003 -0.00007 0.00000 -0.00015 -0.00019
|
|
242 14F+1 0.00001 0.00000 0.00000 0.00002 0.00002
|
|
243 14F-1 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
244 14F+2 -0.00002 0.00005 0.00000 0.00010 0.00013
|
|
245 14F-2 -0.00003 0.00009 0.00000 0.00017 0.00022
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00005 0.00010 0.00000 0.00019 0.00023
|
|
248 15G 0 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
249 15G+1 0.00000 -0.00001 0.00000 -0.00002 -0.00002
|
|
250 15G-1 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00001 0.00000 0.00003 0.00003
|
|
255 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
256 15G-4 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
6 7 8 9 10
|
|
6 6S 0.01573
|
|
7 7PX 0.00000 0.00910
|
|
8 7PY 0.00000 0.00000 0.00910
|
|
9 7PZ -0.00593 0.00000 0.00000 0.01288
|
|
10 8PX 0.00000 0.01562 0.00000 0.00000 0.02683
|
|
11 8PY 0.00000 0.00000 0.01562 0.00000 0.00000
|
|
12 8PZ -0.01033 0.00000 0.00000 0.02248 0.00000
|
|
13 9PX 0.00000 0.02417 0.00000 0.00000 0.04149
|
|
14 9PY 0.00000 0.00000 0.02417 0.00000 0.00000
|
|
15 9PZ -0.01626 0.00000 0.00000 0.03459 0.00000
|
|
16 10PX 0.00000 0.01900 0.00000 0.00000 0.03262
|
|
17 10PY 0.00000 0.00000 0.01900 0.00000 0.00000
|
|
18 10PZ -0.01420 0.00000 0.00000 0.03565 0.00000
|
|
19 11PX 0.00000 0.00499 0.00000 0.00000 0.00857
|
|
20 11PY 0.00000 0.00000 0.00499 0.00000 0.00000
|
|
21 11PZ -0.00827 0.00000 0.00000 0.02535 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 -0.00004 0.00000
|
|
23 12D+1 0.00000 -0.00013 0.00000 0.00000 -0.00023
|
|
24 12D-1 0.00000 0.00000 -0.00013 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 -0.00011 0.00000 0.00000
|
|
26 12D-2 0.00000 -0.00011 0.00000 0.00000 -0.00019
|
|
27 13D 0 -0.00010 0.00000 0.00000 -0.00024 0.00000
|
|
28 13D+1 0.00000 -0.00065 0.00000 0.00000 -0.00111
|
|
29 13D-1 0.00000 0.00000 -0.00065 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 -0.00049 0.00000 0.00000
|
|
31 13D-2 0.00000 -0.00049 0.00000 0.00000 -0.00085
|
|
32 14D 0 -0.00021 0.00000 0.00000 -0.00079 0.00000
|
|
33 14D+1 0.00000 -0.00212 0.00000 0.00000 -0.00364
|
|
34 14D-1 0.00000 0.00000 -0.00212 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 -0.00170 0.00000 0.00000
|
|
36 14D-2 0.00000 -0.00170 0.00000 0.00000 -0.00292
|
|
37 15D 0 0.00034 0.00000 0.00000 -0.00121 0.00000
|
|
38 15D+1 0.00000 -0.00135 0.00000 0.00000 -0.00231
|
|
39 15D-1 0.00000 0.00000 -0.00135 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 -0.00128 0.00000 0.00000
|
|
41 15D-2 0.00000 -0.00128 0.00000 0.00000 -0.00220
|
|
42 16F 0 0.00004 0.00000 0.00000 -0.00005 0.00000
|
|
43 16F+1 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
44 16F-1 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00003 0.00000 0.00000 0.00004
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 -0.00005 0.00000 0.00000 0.00002 0.00000
|
|
49 17F 0 0.00040 0.00000 0.00000 -0.00032 0.00000
|
|
50 17F+1 0.00000 -0.00014 0.00000 0.00000 -0.00024
|
|
51 17F-1 0.00000 0.00000 -0.00014 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00022 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00022 0.00000 0.00000 0.00037
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 -0.00037 0.00000 0.00000 0.00014 0.00000
|
|
56 18F 0 0.00040 0.00000 0.00000 -0.00023 0.00000
|
|
57 18F+1 0.00000 -0.00017 0.00000 0.00000 -0.00029
|
|
58 18F-1 0.00000 0.00000 -0.00017 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00036 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00036 0.00000 0.00000 0.00063
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 -0.00044 0.00000 0.00000 0.00014 0.00000
|
|
63 19G 0 -0.00001 0.00000 0.00000 0.00003 0.00000
|
|
64 19G+1 0.00000 0.00002 0.00000 0.00000 0.00004
|
|
65 19G-1 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00004 0.00000 0.00000 -0.00003 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
71 19G-4 0.00000 -0.00002 0.00000 0.00000 -0.00004
|
|
72 20G 0 -0.00011 0.00000 0.00000 0.00010 0.00000
|
|
73 20G+1 0.00000 0.00015 0.00000 0.00000 0.00025
|
|
74 20G-1 0.00000 0.00000 0.00015 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00022 0.00000 0.00000 -0.00009 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00017 0.00000 0.00000
|
|
80 20G-4 0.00000 -0.00017 0.00000 0.00000 -0.00030
|
|
81 21H 0 -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
82 21H+1 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
83 21H-1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
85 21H-2 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 -0.00003 0.00000 0.00000 0.00003 0.00000
|
|
88 21H+4 0.00000 0.00000 -0.00004 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00004 0.00000 0.00000 0.00008
|
|
90 21H+5 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
91 21H-5 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
92 2 H 1S 0.00293 0.00000 0.00377 -0.00149 0.00000
|
|
93 2S 0.00673 0.00000 0.00894 -0.00377 0.00000
|
|
94 3S 0.01182 0.00000 0.01655 -0.00641 0.00000
|
|
95 4S 0.00226 0.00000 0.01510 0.00504 0.00000
|
|
96 5S 0.00034 0.00000 0.00297 -0.00062 0.00000
|
|
97 6PX 0.00000 0.00007 0.00000 0.00000 0.00012
|
|
98 6PY -0.00017 0.00000 -0.00013 0.00008 0.00000
|
|
99 6PZ 0.00002 0.00000 0.00008 0.00008 0.00000
|
|
100 7PX 0.00000 0.00026 0.00000 0.00000 0.00044
|
|
101 7PY -0.00064 0.00000 -0.00039 0.00042 0.00000
|
|
102 7PZ 0.00008 0.00000 0.00025 0.00027 0.00000
|
|
103 8PX 0.00000 0.00091 0.00000 0.00000 0.00157
|
|
104 8PY -0.00176 0.00000 -0.00113 0.00044 0.00000
|
|
105 8PZ 0.00015 0.00000 0.00080 0.00141 0.00000
|
|
106 9PX 0.00000 0.00118 0.00000 0.00000 0.00202
|
|
107 9PY 0.00021 0.00000 -0.00107 -0.00281 0.00000
|
|
108 9PZ -0.00081 0.00000 0.00039 0.00280 0.00000
|
|
109 10D 0 -0.00003 0.00000 -0.00001 0.00005 0.00000
|
|
110 10D+1 0.00000 0.00002 0.00000 0.00000 0.00003
|
|
111 10D-1 -0.00001 0.00000 -0.00005 -0.00002 0.00000
|
|
112 10D+2 -0.00005 0.00000 -0.00004 0.00004 0.00000
|
|
113 10D-2 0.00000 -0.00004 0.00000 0.00000 -0.00007
|
|
114 11D 0 -0.00010 0.00000 -0.00002 0.00011 0.00000
|
|
115 11D+1 0.00000 0.00001 0.00000 0.00000 0.00002
|
|
116 11D-1 -0.00012 0.00000 -0.00014 -0.00010 0.00000
|
|
117 11D+2 -0.00019 0.00000 -0.00012 0.00013 0.00000
|
|
118 11D-2 0.00000 -0.00010 0.00000 0.00000 -0.00017
|
|
119 12D 0 -0.00014 0.00000 -0.00011 0.00012 0.00000
|
|
120 12D+1 0.00000 0.00007 0.00000 0.00000 0.00011
|
|
121 12D-1 0.00003 0.00000 -0.00020 -0.00063 0.00000
|
|
122 12D+2 -0.00005 0.00000 -0.00016 -0.00058 0.00000
|
|
123 12D-2 0.00000 -0.00031 0.00000 0.00000 -0.00054
|
|
124 13F 0 -0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00001 0.00000 0.00000 -0.00003 0.00000
|
|
127 13F+2 -0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
128 13F-2 0.00000 -0.00001 0.00000 0.00000 -0.00001
|
|
129 13F+3 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
130 13F-3 0.00002 0.00000 0.00002 -0.00003 0.00000
|
|
131 14F 0 -0.00002 0.00000 -0.00005 -0.00005 0.00000
|
|
132 14F+1 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
133 14F-1 0.00001 0.00000 0.00002 -0.00003 0.00000
|
|
134 14F+2 -0.00003 0.00000 -0.00006 -0.00006 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
136 14F+3 0.00000 -0.00003 0.00000 0.00000 -0.00004
|
|
137 14F-3 0.00000 0.00000 0.00005 0.00011 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00001 0.00000 0.00001 0.00001 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
147 3 H 1S 0.00293 0.00327 -0.00189 -0.00149 0.00561
|
|
148 2S 0.00673 0.00774 -0.00447 -0.00377 0.01329
|
|
149 3S 0.01182 0.01434 -0.00828 -0.00641 0.02461
|
|
150 4S 0.00226 0.01308 -0.00755 0.00504 0.02245
|
|
151 5S 0.00034 0.00257 -0.00148 -0.00062 0.00441
|
|
152 6PX -0.00015 -0.00008 0.00009 0.00007 -0.00014
|
|
153 6PY 0.00008 0.00009 0.00002 -0.00004 0.00015
|
|
154 6PZ 0.00002 0.00007 -0.00004 0.00008 0.00013
|
|
155 7PX -0.00055 -0.00023 0.00028 0.00036 -0.00039
|
|
156 7PY 0.00032 0.00028 0.00010 -0.00021 0.00048
|
|
157 7PZ 0.00008 0.00022 -0.00013 0.00027 0.00038
|
|
158 8PX -0.00153 -0.00062 0.00088 0.00038 -0.00106
|
|
159 8PY 0.00088 0.00088 0.00040 -0.00022 0.00152
|
|
160 8PZ 0.00015 0.00069 -0.00040 0.00141 0.00118
|
|
161 9PX 0.00018 -0.00050 0.00097 -0.00243 -0.00087
|
|
162 9PY -0.00011 0.00097 0.00062 0.00140 0.00167
|
|
163 9PZ -0.00081 0.00034 -0.00020 0.00280 0.00058
|
|
164 10D 0 -0.00003 -0.00001 0.00001 0.00005 -0.00002
|
|
165 10D+1 -0.00001 -0.00003 0.00003 -0.00002 -0.00006
|
|
166 10D-1 0.00001 0.00003 0.00000 0.00001 0.00005
|
|
167 10D+2 0.00002 0.00000 -0.00004 -0.00002 0.00000
|
|
168 10D-2 -0.00004 -0.00004 0.00000 0.00003 -0.00007
|
|
169 11D 0 -0.00010 -0.00002 0.00001 0.00011 -0.00003
|
|
170 11D+1 -0.00010 -0.00010 0.00007 -0.00008 -0.00018
|
|
171 11D-1 0.00006 0.00007 -0.00003 0.00005 0.00011
|
|
172 11D+2 0.00010 0.00001 -0.00010 -0.00006 0.00001
|
|
173 11D-2 -0.00017 -0.00011 0.00001 0.00011 -0.00019
|
|
174 12D 0 -0.00014 -0.00010 0.00006 0.00012 -0.00017
|
|
175 12D+1 0.00002 -0.00013 0.00012 -0.00055 -0.00023
|
|
176 12D-1 -0.00001 0.00012 0.00000 0.00032 0.00020
|
|
177 12D+2 0.00003 -0.00007 -0.00027 0.00029 -0.00012
|
|
178 12D-2 -0.00004 -0.00020 -0.00007 -0.00050 -0.00034
|
|
179 13F 0 -0.00001 -0.00001 0.00001 0.00000 -0.00002
|
|
180 13F+1 0.00001 0.00000 0.00000 -0.00002 0.00000
|
|
181 13F-1 -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
182 13F+2 0.00001 0.00001 -0.00001 0.00000 0.00001
|
|
183 13F-2 -0.00001 -0.00002 0.00001 0.00000 -0.00003
|
|
184 13F+3 0.00000 0.00001 0.00001 0.00000 0.00001
|
|
185 13F-3 0.00002 0.00002 -0.00001 -0.00003 0.00003
|
|
186 14F 0 -0.00002 -0.00005 0.00003 -0.00005 -0.00008
|
|
187 14F+1 0.00001 0.00001 -0.00002 -0.00002 0.00002
|
|
188 14F-1 0.00000 -0.00002 -0.00001 0.00001 -0.00003
|
|
189 14F+2 0.00002 0.00003 -0.00002 0.00003 0.00004
|
|
190 14F-2 -0.00003 -0.00005 0.00003 -0.00006 -0.00009
|
|
191 14F+3 0.00000 0.00001 0.00002 0.00000 0.00002
|
|
192 14F-3 0.00000 0.00005 -0.00003 0.00011 0.00008
|
|
193 15G 0 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
194 15G+1 0.00001 0.00001 -0.00001 0.00000 0.00001
|
|
195 15G-1 0.00000 -0.00001 0.00000 0.00000 -0.00001
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00001 0.00001 0.00000 0.00001 0.00001
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
202 4 H 1S 0.00293 -0.00327 -0.00189 -0.00149 -0.00561
|
|
203 2S 0.00673 -0.00774 -0.00447 -0.00377 -0.01329
|
|
204 3S 0.01182 -0.01434 -0.00828 -0.00641 -0.02461
|
|
205 4S 0.00226 -0.01308 -0.00755 0.00504 -0.02245
|
|
206 5S 0.00034 -0.00257 -0.00148 -0.00062 -0.00441
|
|
207 6PX 0.00015 -0.00008 -0.00009 -0.00007 -0.00014
|
|
208 6PY 0.00008 -0.00009 0.00002 -0.00004 -0.00015
|
|
209 6PZ 0.00002 -0.00007 -0.00004 0.00008 -0.00013
|
|
210 7PX 0.00055 -0.00023 -0.00028 -0.00036 -0.00039
|
|
211 7PY 0.00032 -0.00028 0.00010 -0.00021 -0.00048
|
|
212 7PZ 0.00008 -0.00022 -0.00013 0.00027 -0.00038
|
|
213 8PX 0.00153 -0.00062 -0.00088 -0.00038 -0.00106
|
|
214 8PY 0.00088 -0.00088 0.00040 -0.00022 -0.00152
|
|
215 8PZ 0.00015 -0.00069 -0.00040 0.00141 -0.00118
|
|
216 9PX -0.00018 -0.00050 -0.00097 0.00243 -0.00087
|
|
217 9PY -0.00011 -0.00097 0.00062 0.00140 -0.00167
|
|
218 9PZ -0.00081 -0.00034 -0.00020 0.00280 -0.00058
|
|
219 10D 0 -0.00003 0.00001 0.00001 0.00005 0.00002
|
|
220 10D+1 0.00001 -0.00003 -0.00003 0.00002 -0.00006
|
|
221 10D-1 0.00001 -0.00003 0.00000 0.00001 -0.00005
|
|
222 10D+2 0.00002 0.00000 -0.00004 -0.00002 0.00000
|
|
223 10D-2 0.00004 -0.00004 0.00000 -0.00003 -0.00007
|
|
224 11D 0 -0.00010 0.00002 0.00001 0.00011 0.00003
|
|
225 11D+1 0.00010 -0.00010 -0.00007 0.00008 -0.00018
|
|
226 11D-1 0.00006 -0.00007 -0.00003 0.00005 -0.00011
|
|
227 11D+2 0.00010 -0.00001 -0.00010 -0.00006 -0.00001
|
|
228 11D-2 0.00017 -0.00011 -0.00001 -0.00011 -0.00019
|
|
229 12D 0 -0.00014 0.00010 0.00006 0.00012 0.00017
|
|
230 12D+1 -0.00002 -0.00013 -0.00012 0.00055 -0.00023
|
|
231 12D-1 -0.00001 -0.00012 0.00000 0.00032 -0.00020
|
|
232 12D+2 0.00003 0.00007 -0.00027 0.00029 0.00012
|
|
233 12D-2 0.00004 -0.00020 0.00007 0.00050 -0.00034
|
|
234 13F 0 -0.00001 0.00001 0.00001 0.00000 0.00002
|
|
235 13F+1 -0.00001 0.00000 0.00000 0.00002 0.00000
|
|
236 13F-1 -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
237 13F+2 0.00001 -0.00001 -0.00001 0.00000 -0.00001
|
|
238 13F-2 0.00001 -0.00002 -0.00001 0.00000 -0.00003
|
|
239 13F+3 0.00000 0.00001 -0.00001 0.00000 0.00001
|
|
240 13F-3 0.00002 -0.00002 -0.00001 -0.00003 -0.00003
|
|
241 14F 0 -0.00002 0.00005 0.00003 -0.00005 0.00008
|
|
242 14F+1 -0.00001 0.00001 0.00002 0.00002 0.00002
|
|
243 14F-1 0.00000 0.00002 -0.00001 0.00001 0.00003
|
|
244 14F+2 0.00002 -0.00003 -0.00002 0.00003 -0.00004
|
|
245 14F-2 0.00003 -0.00005 -0.00003 0.00006 -0.00009
|
|
246 14F+3 0.00000 0.00001 -0.00002 0.00000 0.00002
|
|
247 14F-3 0.00000 -0.00005 -0.00003 0.00011 -0.00008
|
|
248 15G 0 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
249 15G+1 -0.00001 0.00001 0.00001 0.00000 0.00001
|
|
250 15G-1 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00001 -0.00001 0.00000 0.00001 -0.00001
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
11 12 13 14 15
|
|
11 8PY 0.02683
|
|
12 8PZ 0.00000 0.03925
|
|
13 9PX 0.00000 0.00000 0.06417
|
|
14 9PY 0.04149 0.00000 0.00000 0.06417
|
|
15 9PZ 0.00000 0.06039 0.00000 0.00000 0.09294
|
|
16 10PX 0.00000 0.00000 0.05045 0.00000 0.00000
|
|
17 10PY 0.03262 0.00000 0.00000 0.05045 0.00000
|
|
18 10PZ 0.00000 0.06223 0.00000 0.00000 0.09570
|
|
19 11PX 0.00000 0.00000 0.01326 0.00000 0.00000
|
|
20 11PY 0.00857 0.00000 0.00000 0.01326 0.00000
|
|
21 11PZ 0.00000 0.04426 0.00000 0.00000 0.06801
|
|
22 12D 0 0.00000 -0.00008 0.00000 0.00000 -0.00012
|
|
23 12D+1 0.00000 0.00000 -0.00035 0.00000 0.00000
|
|
24 12D-1 -0.00023 0.00000 0.00000 -0.00035 0.00000
|
|
25 12D+2 -0.00019 0.00000 0.00000 -0.00029 0.00000
|
|
26 12D-2 0.00000 0.00000 -0.00029 0.00000 0.00000
|
|
27 13D 0 0.00000 -0.00041 0.00000 0.00000 -0.00063
|
|
28 13D+1 0.00000 0.00000 -0.00171 0.00000 0.00000
|
|
29 13D-1 -0.00111 0.00000 0.00000 -0.00171 0.00000
|
|
30 13D+2 -0.00085 0.00000 0.00000 -0.00131 0.00000
|
|
31 13D-2 0.00000 0.00000 -0.00131 0.00000 0.00000
|
|
32 14D 0 0.00000 -0.00138 0.00000 0.00000 -0.00211
|
|
33 14D+1 0.00000 0.00000 -0.00563 0.00000 0.00000
|
|
34 14D-1 -0.00364 0.00000 0.00000 -0.00563 0.00000
|
|
35 14D+2 -0.00292 0.00000 0.00000 -0.00452 0.00000
|
|
36 14D-2 0.00000 0.00000 -0.00452 0.00000 0.00000
|
|
37 15D 0 0.00000 -0.00212 0.00000 0.00000 -0.00326
|
|
38 15D+1 0.00000 0.00000 -0.00357 0.00000 0.00000
|
|
39 15D-1 -0.00231 0.00000 0.00000 -0.00357 0.00000
|
|
40 15D+2 -0.00220 0.00000 0.00000 -0.00340 0.00000
|
|
41 15D-2 0.00000 0.00000 -0.00340 0.00000 0.00000
|
|
42 16F 0 0.00000 -0.00009 0.00000 0.00000 -0.00014
|
|
43 16F+1 0.00000 0.00000 -0.00005 0.00000 0.00000
|
|
44 16F-1 -0.00003 0.00000 0.00000 -0.00005 0.00000
|
|
45 16F+2 0.00004 0.00000 0.00000 0.00007 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00007 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00004 0.00000 0.00000 0.00007
|
|
49 17F 0 0.00000 -0.00055 0.00000 0.00000 -0.00086
|
|
50 17F+1 0.00000 0.00000 -0.00037 0.00000 0.00000
|
|
51 17F-1 -0.00024 0.00000 0.00000 -0.00037 0.00000
|
|
52 17F+2 0.00037 0.00000 0.00000 0.00057 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00057 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00024 0.00000 0.00000 0.00038
|
|
56 18F 0 0.00000 -0.00040 0.00000 0.00000 -0.00063
|
|
57 18F+1 0.00000 0.00000 -0.00046 0.00000 0.00000
|
|
58 18F-1 -0.00029 0.00000 0.00000 -0.00046 0.00000
|
|
59 18F+2 0.00063 0.00000 0.00000 0.00097 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00097 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00023 0.00000 0.00000 0.00037
|
|
63 19G 0 0.00000 0.00004 0.00000 0.00000 0.00007
|
|
64 19G+1 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
65 19G-1 0.00004 0.00000 0.00000 0.00006 0.00000
|
|
66 19G+2 0.00001 0.00000 0.00000 0.00001 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 -0.00005 0.00000 0.00000 -0.00008
|
|
70 19G+4 0.00004 0.00000 0.00000 0.00006 0.00000
|
|
71 19G-4 0.00000 0.00000 -0.00006 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00018 0.00000 0.00000 0.00028
|
|
73 20G+1 0.00000 0.00000 0.00039 0.00000 0.00000
|
|
74 20G-1 0.00025 0.00000 0.00000 0.00039 0.00000
|
|
75 20G+2 0.00001 0.00000 0.00000 0.00002 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 -0.00016 0.00000 0.00000 -0.00026
|
|
79 20G+4 0.00030 0.00000 0.00000 0.00046 0.00000
|
|
80 20G-4 0.00000 0.00000 -0.00046 0.00000 0.00000
|
|
81 21H 0 0.00000 -0.00002 0.00000 0.00000 -0.00003
|
|
82 21H+1 0.00000 0.00000 -0.00003 0.00000 0.00000
|
|
83 21H-1 -0.00002 0.00000 0.00000 -0.00003 0.00000
|
|
84 21H+2 -0.00003 0.00000 0.00000 -0.00005 0.00000
|
|
85 21H-2 0.00000 0.00000 -0.00005 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00006 0.00000 0.00000 0.00009
|
|
88 21H+4 -0.00008 0.00000 0.00000 -0.00012 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00012 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
91 21H-5 0.00002 0.00000 0.00000 0.00002 0.00000
|
|
92 2 H 1S 0.00648 -0.00259 0.00000 0.01002 -0.00405
|
|
93 2S 0.01535 -0.00658 0.00000 0.02374 -0.01026
|
|
94 3S 0.02842 -0.01117 0.00000 0.04396 -0.01743
|
|
95 4S 0.02593 0.00880 0.00000 0.04010 0.01341
|
|
96 5S 0.00509 -0.00108 0.00000 0.00788 -0.00167
|
|
97 6PX 0.00000 0.00000 0.00018 0.00000 0.00000
|
|
98 6PY -0.00023 0.00013 0.00000 -0.00036 0.00021
|
|
99 6PZ 0.00014 0.00015 0.00000 0.00022 0.00022
|
|
100 7PX 0.00000 0.00000 0.00068 0.00000 0.00000
|
|
101 7PY -0.00067 0.00073 0.00000 -0.00103 0.00113
|
|
102 7PZ 0.00043 0.00048 0.00000 0.00067 0.00073
|
|
103 8PX 0.00000 0.00000 0.00243 0.00000 0.00000
|
|
104 8PY -0.00194 0.00077 0.00000 -0.00299 0.00123
|
|
105 8PZ 0.00137 0.00247 0.00000 0.00211 0.00377
|
|
106 9PX 0.00000 0.00000 0.00313 0.00000 0.00000
|
|
107 9PY -0.00183 -0.00490 0.00000 -0.00283 -0.00752
|
|
108 9PZ 0.00067 0.00490 0.00000 0.00104 0.00752
|
|
109 10D 0 -0.00002 0.00008 0.00000 -0.00003 0.00013
|
|
110 10D+1 0.00000 0.00000 0.00004 0.00000 0.00000
|
|
111 10D-1 -0.00009 -0.00003 0.00000 -0.00013 -0.00005
|
|
112 10D+2 -0.00007 0.00006 0.00000 -0.00011 0.00010
|
|
113 10D-2 0.00000 0.00000 -0.00011 0.00000 0.00000
|
|
114 11D 0 -0.00003 0.00020 0.00000 -0.00005 0.00030
|
|
115 11D+1 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
116 11D-1 -0.00024 -0.00017 0.00000 -0.00037 -0.00026
|
|
117 11D+2 -0.00020 0.00023 0.00000 -0.00031 0.00035
|
|
118 11D-2 0.00000 0.00000 -0.00027 0.00000 0.00000
|
|
119 12D 0 -0.00019 0.00021 0.00000 -0.00030 0.00032
|
|
120 12D+1 0.00000 0.00000 0.00018 0.00000 0.00000
|
|
121 12D-1 -0.00034 -0.00110 0.00000 -0.00053 -0.00169
|
|
122 12D+2 -0.00027 -0.00102 0.00000 -0.00042 -0.00156
|
|
123 12D-2 0.00000 0.00000 -0.00083 0.00000 0.00000
|
|
124 13F 0 -0.00003 0.00001 0.00000 -0.00004 0.00001
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 -0.00005 0.00000 -0.00001 -0.00007
|
|
127 13F+2 -0.00004 -0.00001 0.00000 -0.00006 -0.00001
|
|
128 13F-2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 -0.00004 0.00000 0.00000
|
|
130 13F-3 0.00003 -0.00005 0.00000 0.00005 -0.00007
|
|
131 14F 0 -0.00009 -0.00008 0.00000 -0.00014 -0.00012
|
|
132 14F+1 0.00000 0.00000 -0.00004 0.00000 0.00000
|
|
133 14F-1 0.00003 -0.00005 0.00000 0.00005 -0.00007
|
|
134 14F+2 -0.00011 -0.00011 0.00000 -0.00017 -0.00017
|
|
135 14F-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 -0.00007 0.00000 0.00000
|
|
137 14F-3 0.00009 0.00019 0.00000 0.00014 0.00029
|
|
138 15G 0 -0.00001 -0.00001 0.00000 -0.00001 -0.00002
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00002 0.00000 0.00000 0.00003 0.00001
|
|
141 15G+2 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
144 15G-3 0.00002 0.00001 0.00000 0.00002 0.00002
|
|
145 15G+4 0.00001 0.00001 0.00000 0.00002 0.00001
|
|
146 15G-4 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
147 3 H 1S -0.00324 -0.00259 0.00868 -0.00501 -0.00405
|
|
148 2S -0.00768 -0.00658 0.02056 -0.01187 -0.01026
|
|
149 3S -0.01421 -0.01117 0.03807 -0.02198 -0.01743
|
|
150 4S -0.01296 0.00880 0.03473 -0.02005 0.01341
|
|
151 5S -0.00255 -0.00108 0.00682 -0.00394 -0.00167
|
|
152 6PX 0.00015 0.00012 -0.00022 0.00023 0.00018
|
|
153 6PY 0.00003 -0.00007 0.00023 0.00005 -0.00010
|
|
154 6PZ -0.00007 0.00015 0.00019 -0.00011 0.00022
|
|
155 7PX 0.00048 0.00063 -0.00060 0.00074 0.00098
|
|
156 7PY 0.00016 -0.00036 0.00074 0.00025 -0.00056
|
|
157 7PZ -0.00022 0.00048 0.00058 -0.00034 0.00073
|
|
158 8PX 0.00152 0.00067 -0.00164 0.00235 0.00107
|
|
159 8PY 0.00069 -0.00039 0.00235 0.00107 -0.00062
|
|
160 8PZ -0.00068 0.00247 0.00183 -0.00106 0.00377
|
|
161 9PX 0.00167 -0.00425 -0.00134 0.00258 -0.00651
|
|
162 9PY 0.00106 0.00245 0.00258 0.00164 0.00376
|
|
163 9PZ -0.00034 0.00490 0.00090 -0.00052 0.00752
|
|
164 10D 0 0.00001 0.00008 -0.00002 0.00001 0.00013
|
|
165 10D+1 0.00005 -0.00003 -0.00009 0.00008 -0.00005
|
|
166 10D-1 0.00000 0.00002 0.00008 0.00000 0.00003
|
|
167 10D+2 -0.00007 -0.00003 0.00000 -0.00011 -0.00005
|
|
168 10D-2 0.00000 0.00006 -0.00011 0.00000 0.00009
|
|
169 11D 0 0.00002 0.00020 -0.00004 0.00003 0.00030
|
|
170 11D+1 0.00011 -0.00015 -0.00027 0.00018 -0.00022
|
|
171 11D-1 -0.00005 0.00009 0.00018 -0.00007 0.00013
|
|
172 11D+2 -0.00018 -0.00011 0.00002 -0.00028 -0.00018
|
|
173 11D-2 0.00001 0.00020 -0.00030 0.00002 0.00031
|
|
174 12D 0 0.00010 0.00021 -0.00026 0.00015 0.00032
|
|
175 12D+1 0.00020 -0.00096 -0.00035 0.00031 -0.00146
|
|
176 12D-1 0.00000 0.00055 0.00031 0.00000 0.00085
|
|
177 12D+2 -0.00047 0.00051 -0.00018 -0.00073 0.00078
|
|
178 12D-2 -0.00012 -0.00088 -0.00052 -0.00018 -0.00135
|
|
179 13F 0 0.00001 0.00001 -0.00004 0.00002 0.00001
|
|
180 13F+1 0.00000 -0.00004 -0.00001 0.00000 -0.00006
|
|
181 13F-1 0.00000 0.00002 0.00000 0.00000 0.00004
|
|
182 13F+2 -0.00002 0.00000 0.00002 -0.00003 0.00001
|
|
183 13F-2 0.00001 -0.00001 -0.00005 0.00002 -0.00001
|
|
184 13F+3 0.00002 0.00000 0.00002 0.00004 0.00000
|
|
185 13F-3 -0.00002 -0.00005 0.00004 -0.00002 -0.00007
|
|
186 14F 0 0.00004 -0.00008 -0.00012 0.00007 -0.00012
|
|
187 14F+1 -0.00003 -0.00004 0.00003 -0.00004 -0.00006
|
|
188 14F-1 -0.00001 0.00002 -0.00004 -0.00002 0.00004
|
|
189 14F+2 -0.00003 0.00006 0.00007 -0.00005 0.00009
|
|
190 14F-2 0.00004 -0.00010 -0.00013 0.00007 -0.00015
|
|
191 14F+3 0.00004 0.00000 0.00003 0.00006 0.00000
|
|
192 14F-3 -0.00005 0.00019 0.00012 -0.00007 0.00029
|
|
193 15G 0 0.00000 -0.00001 -0.00001 0.00000 -0.00002
|
|
194 15G+1 -0.00001 0.00000 0.00002 -0.00001 0.00001
|
|
195 15G-1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
197 15G-2 0.00000 -0.00001 0.00000 0.00000 -0.00001
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 -0.00001 0.00001 0.00002 -0.00001 0.00002
|
|
200 15G+4 0.00000 0.00000 -0.00001 0.00000 -0.00001
|
|
201 15G-4 0.00001 -0.00001 -0.00001 0.00001 -0.00001
|
|
202 4 H 1S -0.00324 -0.00259 -0.00868 -0.00501 -0.00405
|
|
203 2S -0.00768 -0.00658 -0.02056 -0.01187 -0.01026
|
|
204 3S -0.01421 -0.01117 -0.03807 -0.02198 -0.01743
|
|
205 4S -0.01296 0.00880 -0.03473 -0.02005 0.01341
|
|
206 5S -0.00255 -0.00108 -0.00682 -0.00394 -0.00167
|
|
207 6PX -0.00015 -0.00012 -0.00022 -0.00023 -0.00018
|
|
208 6PY 0.00003 -0.00007 -0.00023 0.00005 -0.00010
|
|
209 6PZ -0.00007 0.00015 -0.00019 -0.00011 0.00022
|
|
210 7PX -0.00048 -0.00063 -0.00060 -0.00074 -0.00098
|
|
211 7PY 0.00016 -0.00036 -0.00074 0.00025 -0.00056
|
|
212 7PZ -0.00022 0.00048 -0.00058 -0.00034 0.00073
|
|
213 8PX -0.00152 -0.00067 -0.00164 -0.00235 -0.00107
|
|
214 8PY 0.00069 -0.00039 -0.00235 0.00107 -0.00062
|
|
215 8PZ -0.00068 0.00247 -0.00183 -0.00106 0.00377
|
|
216 9PX -0.00167 0.00425 -0.00134 -0.00258 0.00651
|
|
217 9PY 0.00106 0.00245 -0.00258 0.00164 0.00376
|
|
218 9PZ -0.00034 0.00490 -0.00090 -0.00052 0.00752
|
|
219 10D 0 0.00001 0.00008 0.00002 0.00001 0.00013
|
|
220 10D+1 -0.00005 0.00003 -0.00009 -0.00008 0.00005
|
|
221 10D-1 0.00000 0.00002 -0.00008 0.00000 0.00003
|
|
222 10D+2 -0.00007 -0.00003 0.00000 -0.00011 -0.00005
|
|
223 10D-2 0.00000 -0.00006 -0.00011 0.00000 -0.00009
|
|
224 11D 0 0.00002 0.00020 0.00004 0.00003 0.00030
|
|
225 11D+1 -0.00011 0.00015 -0.00027 -0.00018 0.00022
|
|
226 11D-1 -0.00005 0.00009 -0.00018 -0.00007 0.00013
|
|
227 11D+2 -0.00018 -0.00011 -0.00002 -0.00028 -0.00018
|
|
228 11D-2 -0.00001 -0.00020 -0.00030 -0.00002 -0.00031
|
|
229 12D 0 0.00010 0.00021 0.00026 0.00015 0.00032
|
|
230 12D+1 -0.00020 0.00096 -0.00035 -0.00031 0.00146
|
|
231 12D-1 0.00000 0.00055 -0.00031 0.00000 0.00085
|
|
232 12D+2 -0.00047 0.00051 0.00018 -0.00073 0.00078
|
|
233 12D-2 0.00012 0.00088 -0.00052 0.00018 0.00135
|
|
234 13F 0 0.00001 0.00001 0.00004 0.00002 0.00001
|
|
235 13F+1 0.00000 0.00004 -0.00001 0.00000 0.00006
|
|
236 13F-1 0.00000 0.00002 0.00000 0.00000 0.00004
|
|
237 13F+2 -0.00002 0.00000 -0.00002 -0.00003 0.00001
|
|
238 13F-2 -0.00001 0.00001 -0.00005 -0.00002 0.00001
|
|
239 13F+3 -0.00002 0.00000 0.00002 -0.00004 0.00000
|
|
240 13F-3 -0.00002 -0.00005 -0.00004 -0.00002 -0.00007
|
|
241 14F 0 0.00004 -0.00008 0.00012 0.00007 -0.00012
|
|
242 14F+1 0.00003 0.00004 0.00003 0.00004 0.00006
|
|
243 14F-1 -0.00001 0.00002 0.00004 -0.00002 0.00004
|
|
244 14F+2 -0.00003 0.00006 -0.00007 -0.00005 0.00009
|
|
245 14F-2 -0.00004 0.00010 -0.00013 -0.00007 0.00015
|
|
246 14F+3 -0.00004 0.00000 0.00003 -0.00006 0.00000
|
|
247 14F-3 -0.00005 0.00019 -0.00012 -0.00007 0.00029
|
|
248 15G 0 0.00000 -0.00001 0.00001 0.00000 -0.00002
|
|
249 15G+1 0.00001 0.00000 0.00002 0.00001 -0.00001
|
|
250 15G-1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
252 15G-2 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 -0.00001 0.00001 -0.00002 -0.00001 0.00002
|
|
255 15G+4 0.00000 0.00000 0.00001 0.00000 -0.00001
|
|
256 15G-4 -0.00001 0.00001 -0.00001 -0.00001 0.00001
|
|
16 17 18 19 20
|
|
16 10PX 0.03967
|
|
17 10PY 0.00000 0.03967
|
|
18 10PZ 0.00000 0.00000 0.09905
|
|
19 11PX 0.01043 0.00000 0.00000 0.00274
|
|
20 11PY 0.00000 0.01043 0.00000 0.00000 0.00274
|
|
21 11PZ 0.00000 0.00000 0.07075 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 -0.00013 0.00000 0.00000
|
|
23 12D+1 -0.00028 0.00000 0.00000 -0.00007 0.00000
|
|
24 12D-1 0.00000 -0.00028 0.00000 0.00000 -0.00007
|
|
25 12D+2 0.00000 -0.00023 0.00000 0.00000 -0.00006
|
|
26 12D-2 -0.00023 0.00000 0.00000 -0.00006 0.00000
|
|
27 13D 0 0.00000 0.00000 -0.00069 0.00000 0.00000
|
|
28 13D+1 -0.00135 0.00000 0.00000 -0.00035 0.00000
|
|
29 13D-1 0.00000 -0.00135 0.00000 0.00000 -0.00035
|
|
30 13D+2 0.00000 -0.00103 0.00000 0.00000 -0.00027
|
|
31 13D-2 -0.00103 0.00000 0.00000 -0.00027 0.00000
|
|
32 14D 0 0.00000 0.00000 -0.00229 0.00000 0.00000
|
|
33 14D+1 -0.00443 0.00000 0.00000 -0.00116 0.00000
|
|
34 14D-1 0.00000 -0.00443 0.00000 0.00000 -0.00116
|
|
35 14D+2 0.00000 -0.00355 0.00000 0.00000 -0.00093
|
|
36 14D-2 -0.00355 0.00000 0.00000 -0.00093 0.00000
|
|
37 15D 0 0.00000 0.00000 -0.00340 0.00000 0.00000
|
|
38 15D+1 -0.00281 0.00000 0.00000 -0.00074 0.00000
|
|
39 15D-1 0.00000 -0.00281 0.00000 0.00000 -0.00074
|
|
40 15D+2 0.00000 -0.00267 0.00000 0.00000 -0.00070
|
|
41 15D-2 -0.00267 0.00000 0.00000 -0.00070 0.00000
|
|
42 16F 0 0.00000 0.00000 -0.00014 0.00000 0.00000
|
|
43 16F+1 -0.00004 0.00000 0.00000 -0.00001 0.00000
|
|
44 16F-1 0.00000 -0.00004 0.00000 0.00000 -0.00001
|
|
45 16F+2 0.00000 0.00005 0.00000 0.00000 0.00001
|
|
46 16F-2 0.00005 0.00000 0.00000 0.00001 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 -0.00084 0.00000 0.00000
|
|
50 17F+1 -0.00029 0.00000 0.00000 -0.00008 0.00000
|
|
51 17F-1 0.00000 -0.00029 0.00000 0.00000 -0.00008
|
|
52 17F+2 0.00000 0.00045 0.00000 0.00000 0.00012
|
|
53 17F-2 0.00045 0.00000 0.00000 0.00012 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00033 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 -0.00059 0.00000 0.00000
|
|
57 18F+1 -0.00036 0.00000 0.00000 -0.00009 0.00000
|
|
58 18F-1 0.00000 -0.00036 0.00000 0.00000 -0.00009
|
|
59 18F+2 0.00000 0.00076 0.00000 0.00000 0.00020
|
|
60 18F-2 0.00076 0.00000 0.00000 0.00020 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00031 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00007 0.00000 0.00000
|
|
64 19G+1 0.00005 0.00000 0.00000 0.00001 0.00000
|
|
65 19G-1 0.00000 0.00005 0.00000 0.00000 0.00001
|
|
66 19G+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 -0.00007 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00005 0.00000 0.00000 0.00001
|
|
71 19G-4 -0.00005 0.00000 0.00000 -0.00001 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00027 0.00000 0.00000
|
|
73 20G+1 0.00031 0.00000 0.00000 0.00008 0.00000
|
|
74 20G-1 0.00000 0.00031 0.00000 0.00000 0.00008
|
|
75 20G+2 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 -0.00023 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00036 0.00000 0.00000 0.00010
|
|
80 20G-4 -0.00036 0.00000 0.00000 -0.00010 0.00000
|
|
81 21H 0 0.00000 0.00000 -0.00003 0.00000 0.00000
|
|
82 21H+1 -0.00002 0.00000 0.00000 -0.00001 0.00000
|
|
83 21H-1 0.00000 -0.00002 0.00000 0.00000 -0.00001
|
|
84 21H+2 0.00000 -0.00004 0.00000 0.00000 -0.00001
|
|
85 21H-2 -0.00004 0.00000 0.00000 -0.00001 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00009 0.00000 0.00000
|
|
88 21H+4 0.00000 -0.00009 0.00000 0.00000 -0.00002
|
|
89 21H-4 0.00009 0.00000 0.00000 0.00002 0.00000
|
|
90 21H+5 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00788 -0.00373 0.00000 0.00207
|
|
93 2S 0.00000 0.01867 -0.00959 0.00000 0.00491
|
|
94 3S 0.00000 0.03456 -0.01621 0.00000 0.00908
|
|
95 4S 0.00000 0.03153 0.01472 0.00000 0.00829
|
|
96 5S 0.00000 0.00620 -0.00171 0.00000 0.00163
|
|
97 6PX 0.00014 0.00000 0.00000 0.00004 0.00000
|
|
98 6PY 0.00000 -0.00028 0.00019 0.00000 -0.00007
|
|
99 6PZ 0.00000 0.00018 0.00024 0.00000 0.00005
|
|
100 7PX 0.00054 0.00000 0.00000 0.00014 0.00000
|
|
101 7PY 0.00000 -0.00081 0.00108 0.00000 -0.00021
|
|
102 7PZ 0.00000 0.00053 0.00079 0.00000 0.00014
|
|
103 8PX 0.00191 0.00000 0.00000 0.00050 0.00000
|
|
104 8PY 0.00000 -0.00235 0.00096 0.00000 -0.00062
|
|
105 8PZ 0.00000 0.00166 0.00405 0.00000 0.00044
|
|
106 9PX 0.00246 0.00000 0.00000 0.00065 0.00000
|
|
107 9PY 0.00000 -0.00223 -0.00796 0.00000 -0.00059
|
|
108 9PZ 0.00000 0.00082 0.00785 0.00000 0.00022
|
|
109 10D 0 0.00000 -0.00002 0.00013 0.00000 -0.00001
|
|
110 10D+1 0.00003 0.00000 0.00000 0.00001 0.00000
|
|
111 10D-1 0.00000 -0.00010 -0.00006 0.00000 -0.00003
|
|
112 10D+2 0.00000 -0.00009 0.00010 0.00000 -0.00002
|
|
113 10D-2 -0.00008 0.00000 0.00000 -0.00002 0.00000
|
|
114 11D 0 0.00000 -0.00004 0.00030 0.00000 -0.00001
|
|
115 11D+1 0.00002 0.00000 0.00000 0.00001 0.00000
|
|
116 11D-1 0.00000 -0.00029 -0.00030 0.00000 -0.00008
|
|
117 11D+2 0.00000 -0.00024 0.00034 0.00000 -0.00006
|
|
118 11D-2 -0.00021 0.00000 0.00000 -0.00006 0.00000
|
|
119 12D 0 0.00000 -0.00023 0.00031 0.00000 -0.00006
|
|
120 12D+1 0.00014 0.00000 0.00000 0.00004 0.00000
|
|
121 12D-1 0.00000 -0.00042 -0.00179 0.00000 -0.00011
|
|
122 12D+2 0.00000 -0.00033 -0.00167 0.00000 -0.00009
|
|
123 12D-2 -0.00065 0.00000 0.00000 -0.00017 0.00000
|
|
124 13F 0 0.00000 -0.00003 0.00001 0.00000 -0.00001
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 -0.00007 0.00000 0.00000
|
|
127 13F+2 0.00000 -0.00005 -0.00001 0.00000 -0.00001
|
|
128 13F-2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 -0.00003 0.00000 0.00000 -0.00001 0.00000
|
|
130 13F-3 0.00000 0.00004 -0.00007 0.00000 0.00001
|
|
131 14F 0 0.00000 -0.00011 -0.00014 0.00000 -0.00003
|
|
132 14F+1 -0.00004 0.00000 0.00000 -0.00001 0.00000
|
|
133 14F-1 0.00000 0.00004 -0.00007 0.00000 0.00001
|
|
134 14F+2 0.00000 -0.00014 -0.00019 0.00000 -0.00004
|
|
135 14F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 -0.00005 0.00000 0.00000 -0.00001 0.00000
|
|
137 14F-3 0.00000 0.00011 0.00031 0.00000 0.00003
|
|
138 15G 0 0.00000 -0.00001 -0.00002 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00002 0.00001 0.00000 0.00001
|
|
141 15G+2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00002 0.00002 0.00000 0.00001
|
|
145 15G+4 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
146 15G-4 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00682 -0.00394 -0.00373 0.00179 -0.00104
|
|
148 2S 0.01617 -0.00933 -0.00959 0.00425 -0.00245
|
|
149 3S 0.02993 -0.01728 -0.01621 0.00787 -0.00454
|
|
150 4S 0.02730 -0.01576 0.01472 0.00718 -0.00414
|
|
151 5S 0.00537 -0.00310 -0.00171 0.00141 -0.00081
|
|
152 6PX -0.00018 0.00018 0.00016 -0.00005 0.00005
|
|
153 6PY 0.00018 0.00004 -0.00010 0.00005 0.00001
|
|
154 6PZ 0.00015 -0.00009 0.00024 0.00004 -0.00002
|
|
155 7PX -0.00047 0.00058 0.00093 -0.00012 0.00015
|
|
156 7PY 0.00058 0.00020 -0.00054 0.00015 0.00005
|
|
157 7PZ 0.00046 -0.00026 0.00079 0.00012 -0.00007
|
|
158 8PX -0.00129 0.00185 0.00083 -0.00034 0.00049
|
|
159 8PY 0.00185 0.00084 -0.00048 0.00049 0.00022
|
|
160 8PZ 0.00144 -0.00083 0.00405 0.00038 -0.00022
|
|
161 9PX -0.00105 0.00203 -0.00689 -0.00028 0.00053
|
|
162 9PY 0.00203 0.00129 0.00398 0.00053 0.00034
|
|
163 9PZ 0.00071 -0.00041 0.00785 0.00019 -0.00011
|
|
164 10D 0 -0.00002 0.00001 0.00013 -0.00001 0.00000
|
|
165 10D+1 -0.00007 0.00006 -0.00005 -0.00002 0.00002
|
|
166 10D-1 0.00006 0.00000 0.00003 0.00002 0.00000
|
|
167 10D+2 0.00000 -0.00008 -0.00005 0.00000 -0.00002
|
|
168 10D-2 -0.00008 0.00000 0.00008 -0.00002 0.00000
|
|
169 11D 0 -0.00003 0.00002 0.00030 -0.00001 0.00001
|
|
170 11D+1 -0.00021 0.00014 -0.00026 -0.00006 0.00004
|
|
171 11D-1 0.00014 -0.00006 0.00015 0.00004 -0.00001
|
|
172 11D+2 0.00001 -0.00022 -0.00017 0.00000 -0.00006
|
|
173 11D-2 -0.00023 0.00001 0.00029 -0.00006 0.00000
|
|
174 12D 0 -0.00020 0.00012 0.00031 -0.00005 0.00003
|
|
175 12D+1 -0.00028 0.00024 -0.00155 -0.00007 0.00006
|
|
176 12D-1 0.00024 0.00000 0.00090 0.00006 0.00000
|
|
177 12D+2 -0.00014 -0.00057 0.00083 -0.00004 -0.00015
|
|
178 12D-2 -0.00041 -0.00014 -0.00145 -0.00011 -0.00004
|
|
179 13F 0 -0.00003 0.00002 0.00001 -0.00001 0.00000
|
|
180 13F+1 0.00000 0.00000 -0.00006 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00004 0.00000 0.00000
|
|
182 13F+2 0.00001 -0.00002 0.00001 0.00000 -0.00001
|
|
183 13F-2 -0.00004 0.00001 -0.00001 -0.00001 0.00000
|
|
184 13F+3 0.00002 0.00003 0.00000 0.00000 0.00001
|
|
185 13F-3 0.00003 -0.00002 -0.00007 0.00001 -0.00001
|
|
186 14F 0 -0.00009 0.00005 -0.00014 -0.00002 0.00001
|
|
187 14F+1 0.00002 -0.00003 -0.00006 0.00001 -0.00001
|
|
188 14F-1 -0.00003 -0.00002 0.00004 -0.00001 0.00000
|
|
189 14F+2 0.00005 -0.00004 0.00010 0.00001 -0.00001
|
|
190 14F-2 -0.00010 0.00005 -0.00016 -0.00003 0.00001
|
|
191 14F+3 0.00003 0.00005 0.00000 0.00001 0.00001
|
|
192 14F-3 0.00010 -0.00006 0.00031 0.00003 -0.00001
|
|
193 15G 0 -0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
194 15G+1 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
195 15G-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00002 -0.00001 0.00002 0.00000 0.00000
|
|
200 15G+4 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
201 15G-4 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
202 4 H 1S -0.00682 -0.00394 -0.00373 -0.00179 -0.00104
|
|
203 2S -0.01617 -0.00933 -0.00959 -0.00425 -0.00245
|
|
204 3S -0.02993 -0.01728 -0.01621 -0.00787 -0.00454
|
|
205 4S -0.02730 -0.01576 0.01472 -0.00718 -0.00414
|
|
206 5S -0.00537 -0.00310 -0.00171 -0.00141 -0.00081
|
|
207 6PX -0.00018 -0.00018 -0.00016 -0.00005 -0.00005
|
|
208 6PY -0.00018 0.00004 -0.00010 -0.00005 0.00001
|
|
209 6PZ -0.00015 -0.00009 0.00024 -0.00004 -0.00002
|
|
210 7PX -0.00047 -0.00058 -0.00093 -0.00012 -0.00015
|
|
211 7PY -0.00058 0.00020 -0.00054 -0.00015 0.00005
|
|
212 7PZ -0.00046 -0.00026 0.00079 -0.00012 -0.00007
|
|
213 8PX -0.00129 -0.00185 -0.00083 -0.00034 -0.00049
|
|
214 8PY -0.00185 0.00084 -0.00048 -0.00049 0.00022
|
|
215 8PZ -0.00144 -0.00083 0.00405 -0.00038 -0.00022
|
|
216 9PX -0.00105 -0.00203 0.00689 -0.00028 -0.00053
|
|
217 9PY -0.00203 0.00129 0.00398 -0.00053 0.00034
|
|
218 9PZ -0.00071 -0.00041 0.00785 -0.00019 -0.00011
|
|
219 10D 0 0.00002 0.00001 0.00013 0.00001 0.00000
|
|
220 10D+1 -0.00007 -0.00006 0.00005 -0.00002 -0.00002
|
|
221 10D-1 -0.00006 0.00000 0.00003 -0.00002 0.00000
|
|
222 10D+2 0.00000 -0.00008 -0.00005 0.00000 -0.00002
|
|
223 10D-2 -0.00008 0.00000 -0.00008 -0.00002 0.00000
|
|
224 11D 0 0.00003 0.00002 0.00030 0.00001 0.00001
|
|
225 11D+1 -0.00021 -0.00014 0.00026 -0.00006 -0.00004
|
|
226 11D-1 -0.00014 -0.00006 0.00015 -0.00004 -0.00001
|
|
227 11D+2 -0.00001 -0.00022 -0.00017 0.00000 -0.00006
|
|
228 11D-2 -0.00023 -0.00001 -0.00029 -0.00006 0.00000
|
|
229 12D 0 0.00020 0.00012 0.00031 0.00005 0.00003
|
|
230 12D+1 -0.00028 -0.00024 0.00155 -0.00007 -0.00006
|
|
231 12D-1 -0.00024 0.00000 0.00090 -0.00006 0.00000
|
|
232 12D+2 0.00014 -0.00057 0.00083 0.00004 -0.00015
|
|
233 12D-2 -0.00041 0.00014 0.00145 -0.00011 0.00004
|
|
234 13F 0 0.00003 0.00002 0.00001 0.00001 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00004 0.00000 0.00000
|
|
237 13F+2 -0.00001 -0.00002 0.00001 0.00000 -0.00001
|
|
238 13F-2 -0.00004 -0.00001 0.00001 -0.00001 0.00000
|
|
239 13F+3 0.00002 -0.00003 0.00000 0.00000 -0.00001
|
|
240 13F-3 -0.00003 -0.00002 -0.00007 -0.00001 -0.00001
|
|
241 14F 0 0.00009 0.00005 -0.00014 0.00002 0.00001
|
|
242 14F+1 0.00002 0.00003 0.00006 0.00001 0.00001
|
|
243 14F-1 0.00003 -0.00002 0.00004 0.00001 0.00000
|
|
244 14F+2 -0.00005 -0.00004 0.00010 -0.00001 -0.00001
|
|
245 14F-2 -0.00010 -0.00005 0.00016 -0.00003 -0.00001
|
|
246 14F+3 0.00003 -0.00005 0.00000 0.00001 -0.00001
|
|
247 14F-3 -0.00010 -0.00006 0.00031 -0.00003 -0.00001
|
|
248 15G 0 0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
249 15G+1 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
250 15G-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 -0.00002 -0.00001 0.00002 0.00000 0.00000
|
|
255 15G+4 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
256 15G-4 -0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
21 22 23 24 25
|
|
21 11PZ 0.05079
|
|
22 12D 0 -0.00009 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 -0.00052 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
31 13D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
32 14D 0 -0.00171 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00003 0.00003
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
36 14D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
37 15D 0 -0.00245 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
41 15D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
42 16F 0 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 -0.00056 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00019 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 -0.00038 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
60 18F-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00017 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00005 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00018 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 -0.00014 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00006 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S -0.00234 0.00000 0.00000 -0.00005 -0.00005
|
|
93 2S -0.00612 0.00001 0.00000 -0.00013 -0.00011
|
|
94 3S -0.01029 0.00001 0.00000 -0.00024 -0.00020
|
|
95 4S 0.01111 -0.00002 0.00000 -0.00022 -0.00018
|
|
96 5S -0.00121 0.00000 0.00000 -0.00004 -0.00004
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00018 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00070 0.00000 0.00000 0.00001 0.00000
|
|
102 7PZ 0.00059 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
104 8PY 0.00047 0.00000 0.00000 0.00002 0.00001
|
|
105 8PZ 0.00299 -0.00001 0.00000 -0.00001 -0.00001
|
|
106 9PX 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
107 9PY -0.00581 0.00001 0.00000 0.00002 0.00001
|
|
108 9PZ 0.00565 -0.00001 0.00000 -0.00001 0.00000
|
|
109 10D 0 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00006 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 -0.00024 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00022 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 -0.00131 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 -0.00123 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 -0.00014 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00022 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00234 0.00000 -0.00005 0.00003 0.00002
|
|
148 2S -0.00612 0.00001 -0.00011 0.00006 0.00005
|
|
149 3S -0.01029 0.00001 -0.00021 0.00012 0.00010
|
|
150 4S 0.01111 -0.00002 -0.00019 0.00011 0.00009
|
|
151 5S -0.00121 0.00000 -0.00004 0.00002 0.00002
|
|
152 6PX 0.00010 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY -0.00006 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00018 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00061 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY -0.00035 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00059 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00040 0.00000 0.00001 -0.00001 -0.00001
|
|
159 8PY -0.00023 0.00000 -0.00001 -0.00001 0.00000
|
|
160 8PZ 0.00299 -0.00001 -0.00001 0.00001 0.00000
|
|
161 9PX -0.00503 0.00001 0.00001 -0.00001 -0.00001
|
|
162 9PY 0.00291 -0.00001 -0.00001 -0.00001 -0.00001
|
|
163 9PZ 0.00565 -0.00001 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00006 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 -0.00021 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 -0.00011 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00019 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 -0.00114 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00066 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00062 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 -0.00107 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00007 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 -0.00012 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00022 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00234 0.00000 0.00005 0.00003 0.00002
|
|
203 2S -0.00612 0.00001 0.00011 0.00006 0.00005
|
|
204 3S -0.01029 0.00001 0.00021 0.00012 0.00010
|
|
205 4S 0.01111 -0.00002 0.00019 0.00011 0.00009
|
|
206 5S -0.00121 0.00000 0.00004 0.00002 0.00002
|
|
207 6PX -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY -0.00006 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00018 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX -0.00061 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY -0.00035 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00059 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX -0.00040 0.00000 0.00001 0.00001 0.00001
|
|
214 8PY -0.00023 0.00000 0.00001 -0.00001 0.00000
|
|
215 8PZ 0.00299 -0.00001 0.00001 0.00001 0.00000
|
|
216 9PX 0.00503 -0.00001 0.00001 0.00001 0.00001
|
|
217 9PY 0.00291 -0.00001 0.00001 -0.00001 -0.00001
|
|
218 9PZ 0.00565 -0.00001 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 -0.00006 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 -0.00011 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 -0.00019 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00021 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00114 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00066 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00062 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00107 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00005 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00005 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00007 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00022 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
26 27 28 29 30
|
|
26 12D-2 0.00000
|
|
27 13D 0 0.00000 0.00001
|
|
28 13D+1 0.00001 0.00000 0.00005
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00005
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00003 0.00003
|
|
31 13D-2 0.00001 0.00000 0.00003 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00003 0.00000 0.00015 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00015 0.00011
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00012 0.00009
|
|
36 14D-2 0.00002 0.00000 0.00012 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00002 0.00000 0.00010 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00010 0.00007
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00009 0.00007
|
|
41 15D-2 0.00002 0.00000 0.00009 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
52 17F+2 0.00000 0.00000 0.00000 -0.00002 -0.00001
|
|
53 17F-2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.00003 -0.00002
|
|
60 18F-2 0.00000 0.00000 -0.00003 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
80 20G-4 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00001 0.00000 -0.00027 -0.00020
|
|
93 2S 0.00000 -0.00001 0.00000 -0.00063 -0.00048
|
|
94 3S 0.00000 -0.00003 0.00000 -0.00117 -0.00090
|
|
95 4S 0.00000 -0.00017 0.00000 -0.00107 -0.00082
|
|
96 5S 0.00000 0.00001 0.00000 -0.00021 -0.00016
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
99 6PZ 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
100 7PX 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
102 7PZ 0.00000 -0.00001 0.00000 -0.00002 -0.00001
|
|
103 8PX -0.00001 0.00000 -0.00006 0.00000 0.00000
|
|
104 8PY 0.00000 0.00002 0.00000 0.00008 0.00006
|
|
105 8PZ 0.00000 -0.00004 0.00000 -0.00006 -0.00004
|
|
106 9PX -0.00001 0.00000 -0.00008 0.00000 0.00000
|
|
107 9PY 0.00000 0.00007 0.00000 0.00008 0.00006
|
|
108 9PZ 0.00000 -0.00006 0.00000 -0.00003 -0.00002
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
118 11D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00002 0.00000 0.00001 0.00001
|
|
122 12D+2 0.00000 0.00002 0.00000 0.00001 0.00001
|
|
123 12D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00004 -0.00001 -0.00023 0.00013 0.00010
|
|
148 2S -0.00009 -0.00001 -0.00055 0.00032 0.00024
|
|
149 3S -0.00017 -0.00003 -0.00102 0.00059 0.00045
|
|
150 4S -0.00016 -0.00017 -0.00093 0.00054 0.00041
|
|
151 5S -0.00003 0.00001 -0.00018 0.00011 0.00008
|
|
152 6PX 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
153 6PY 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00002 -0.00002 -0.00002
|
|
156 7PY 0.00000 0.00000 -0.00002 -0.00001 -0.00001
|
|
157 7PZ 0.00000 -0.00001 -0.00002 0.00001 0.00001
|
|
158 8PX 0.00001 0.00001 0.00004 -0.00006 -0.00005
|
|
159 8PY -0.00001 -0.00001 -0.00006 -0.00003 -0.00002
|
|
160 8PZ -0.00001 -0.00004 -0.00005 0.00003 0.00002
|
|
161 9PX 0.00001 0.00006 0.00004 -0.00007 -0.00005
|
|
162 9PY -0.00001 -0.00003 -0.00007 -0.00004 -0.00003
|
|
163 9PZ 0.00000 -0.00006 -0.00002 0.00001 0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
173 11D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00001 0.00001 -0.00001 -0.00001
|
|
176 12D-1 0.00000 -0.00001 -0.00001 0.00000 0.00000
|
|
177 12D+2 0.00000 -0.00001 0.00000 0.00002 0.00001
|
|
178 12D-2 0.00000 0.00001 0.00001 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00004 -0.00001 0.00023 0.00013 0.00010
|
|
203 2S 0.00009 -0.00001 0.00055 0.00032 0.00024
|
|
204 3S 0.00017 -0.00003 0.00102 0.00059 0.00045
|
|
205 4S 0.00016 -0.00017 0.00093 0.00054 0.00041
|
|
206 5S 0.00003 0.00001 0.00018 0.00011 0.00008
|
|
207 6PX 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
208 6PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00002 0.00002 0.00002
|
|
211 7PY 0.00000 0.00000 0.00002 -0.00001 -0.00001
|
|
212 7PZ 0.00000 -0.00001 0.00002 0.00001 0.00001
|
|
213 8PX 0.00001 -0.00001 0.00004 0.00006 0.00005
|
|
214 8PY 0.00001 -0.00001 0.00006 -0.00003 -0.00002
|
|
215 8PZ 0.00001 -0.00004 0.00005 0.00003 0.00002
|
|
216 9PX 0.00001 -0.00006 0.00004 0.00007 0.00005
|
|
217 9PY 0.00001 -0.00003 0.00007 -0.00004 -0.00003
|
|
218 9PZ 0.00000 -0.00006 0.00002 0.00001 0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
228 11D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
230 12D+1 0.00000 -0.00001 0.00001 0.00001 0.00001
|
|
231 12D-1 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
232 12D+2 0.00000 -0.00001 0.00000 0.00002 0.00001
|
|
233 12D-2 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
31 32 33 34 35
|
|
31 13D-2 0.00003
|
|
32 14D 0 0.00000 0.00007
|
|
33 14D+1 0.00011 0.00000 0.00049
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00049
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00040 0.00032
|
|
36 14D-2 0.00009 0.00000 0.00040 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00008 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00007 0.00000 0.00031 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00031 0.00025
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00030 0.00024
|
|
41 15D-2 0.00007 0.00000 0.00030 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
46 16F-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00001 0.00000 0.00003 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00003 0.00003
|
|
52 17F+2 0.00000 0.00000 0.00000 -0.00005 -0.00004
|
|
53 17F-2 -0.00001 0.00000 -0.00005 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00001 0.00000 0.00004 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00004 0.00003
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.00008 -0.00007
|
|
60 18F-2 -0.00002 0.00000 -0.00008 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 -0.00001 0.00000 -0.00003 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 -0.00003 -0.00003
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 -0.00004 -0.00003
|
|
80 20G-4 0.00001 0.00000 0.00004 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
89 21H-4 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00001 0.00000 -0.00088 -0.00071
|
|
93 2S 0.00000 0.00001 0.00000 -0.00208 -0.00167
|
|
94 3S 0.00000 0.00000 0.00000 -0.00386 -0.00309
|
|
95 4S 0.00000 -0.00051 0.00000 -0.00352 -0.00282
|
|
96 5S 0.00000 0.00004 0.00000 -0.00069 -0.00055
|
|
97 6PX 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00003 0.00003
|
|
99 6PZ 0.00000 -0.00001 0.00000 -0.00002 -0.00002
|
|
100 7PX -0.00001 0.00000 -0.00006 0.00000 0.00000
|
|
101 7PY 0.00000 -0.00001 0.00000 0.00009 0.00007
|
|
102 7PZ 0.00000 -0.00003 0.00000 -0.00006 -0.00005
|
|
103 8PX -0.00005 0.00000 -0.00021 0.00000 0.00000
|
|
104 8PY 0.00000 0.00004 0.00000 0.00026 0.00021
|
|
105 8PZ 0.00000 -0.00012 0.00000 -0.00019 -0.00015
|
|
106 9PX -0.00006 0.00000 -0.00027 0.00000 0.00000
|
|
107 9PY 0.00000 0.00022 0.00000 0.00025 0.00020
|
|
108 9PZ 0.00000 -0.00019 0.00000 -0.00009 -0.00007
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
113 10D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00001 0.00000 0.00003 0.00003
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
118 11D-2 0.00001 0.00000 0.00002 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
120 12D+1 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00005 0.00000 0.00005 0.00004
|
|
122 12D+2 0.00000 0.00005 0.00000 0.00004 0.00003
|
|
123 12D-2 0.00002 0.00000 0.00007 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00001 0.00000 0.00002 0.00001
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
137 14F-3 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00018 -0.00001 -0.00076 0.00044 0.00035
|
|
148 2S -0.00042 0.00001 -0.00180 0.00104 0.00084
|
|
149 3S -0.00078 0.00000 -0.00334 0.00193 0.00155
|
|
150 4S -0.00071 -0.00051 -0.00305 0.00176 0.00141
|
|
151 5S -0.00014 0.00004 -0.00060 0.00035 0.00028
|
|
152 6PX 0.00000 0.00000 0.00002 -0.00002 -0.00002
|
|
153 6PY 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
154 6PZ 0.00000 -0.00001 -0.00002 0.00001 0.00001
|
|
155 7PX 0.00001 -0.00001 0.00005 -0.00007 -0.00005
|
|
156 7PY -0.00002 0.00000 -0.00007 -0.00002 -0.00002
|
|
157 7PZ -0.00001 -0.00003 -0.00005 0.00003 0.00002
|
|
158 8PX 0.00003 0.00004 0.00014 -0.00021 -0.00017
|
|
159 8PY -0.00005 -0.00002 -0.00021 -0.00009 -0.00008
|
|
160 8PZ -0.00004 -0.00012 -0.00016 0.00009 0.00007
|
|
161 9PX 0.00003 0.00019 0.00012 -0.00023 -0.00018
|
|
162 9PY -0.00005 -0.00011 -0.00023 -0.00014 -0.00012
|
|
163 9PZ -0.00002 -0.00019 -0.00008 0.00005 0.00004
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00001 -0.00001 -0.00001
|
|
166 10D-1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
168 10D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00001 0.00001 0.00002 -0.00002 -0.00001
|
|
171 11D-1 0.00000 -0.00001 -0.00002 0.00001 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
173 11D-2 0.00001 0.00000 0.00003 0.00000 0.00000
|
|
174 12D 0 0.00001 0.00000 0.00002 -0.00001 -0.00001
|
|
175 12D+1 0.00001 0.00004 0.00003 -0.00003 -0.00002
|
|
176 12D-1 -0.00001 -0.00003 -0.00003 0.00000 0.00000
|
|
177 12D+2 0.00000 -0.00002 0.00002 0.00006 0.00005
|
|
178 12D-2 0.00001 0.00004 0.00005 0.00002 0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00001 0.00001 -0.00001 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
192 14F-3 0.00000 -0.00001 -0.00001 0.00001 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00018 -0.00001 0.00076 0.00044 0.00035
|
|
203 2S 0.00042 0.00001 0.00180 0.00104 0.00084
|
|
204 3S 0.00078 0.00000 0.00334 0.00193 0.00155
|
|
205 4S 0.00071 -0.00051 0.00305 0.00176 0.00141
|
|
206 5S 0.00014 0.00004 0.00060 0.00035 0.00028
|
|
207 6PX 0.00000 0.00000 0.00002 0.00002 0.00002
|
|
208 6PY 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
209 6PZ 0.00000 -0.00001 0.00002 0.00001 0.00001
|
|
210 7PX 0.00001 0.00001 0.00005 0.00007 0.00005
|
|
211 7PY 0.00002 0.00000 0.00007 -0.00002 -0.00002
|
|
212 7PZ 0.00001 -0.00003 0.00005 0.00003 0.00002
|
|
213 8PX 0.00003 -0.00004 0.00014 0.00021 0.00017
|
|
214 8PY 0.00005 -0.00002 0.00021 -0.00009 -0.00008
|
|
215 8PZ 0.00004 -0.00012 0.00016 0.00009 0.00007
|
|
216 9PX 0.00003 -0.00019 0.00012 0.00023 0.00018
|
|
217 9PY 0.00005 -0.00011 0.00023 -0.00014 -0.00012
|
|
218 9PZ 0.00002 -0.00019 0.00008 0.00005 0.00004
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
221 10D-1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
223 10D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00001 -0.00001 0.00002 0.00002 0.00001
|
|
226 11D-1 0.00000 -0.00001 0.00002 0.00001 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
228 11D-2 0.00001 0.00000 0.00003 0.00000 0.00000
|
|
229 12D 0 -0.00001 0.00000 -0.00002 -0.00001 -0.00001
|
|
230 12D+1 0.00001 -0.00004 0.00003 0.00003 0.00002
|
|
231 12D-1 0.00001 -0.00003 0.00003 0.00000 0.00000
|
|
232 12D+2 0.00000 -0.00002 -0.00002 0.00006 0.00005
|
|
233 12D-2 0.00001 -0.00004 0.00005 -0.00002 -0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
245 14F-2 0.00000 -0.00001 0.00001 0.00001 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
247 14F-3 0.00000 -0.00001 0.00001 0.00001 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
36 37 38 39 40
|
|
36 14D-2 0.00032
|
|
37 15D 0 0.00000 0.00012
|
|
38 15D+1 0.00025 0.00000 0.00020
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00020
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00019 0.00018
|
|
41 15D-2 0.00024 0.00000 0.00019 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00003 0.00000 0.00002 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
52 17F+2 0.00000 0.00000 0.00000 -0.00003 -0.00003
|
|
53 17F-2 -0.00004 0.00000 -0.00003 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00003 0.00000 0.00003 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
59 18F+2 0.00000 0.00000 0.00000 -0.00005 -0.00005
|
|
60 18F-2 -0.00007 0.00000 -0.00005 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
73 20G+1 -0.00003 0.00000 -0.00002 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 -0.00002 -0.00002
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 -0.00003 -0.00002
|
|
80 20G-4 0.00003 0.00000 0.00003 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
89 21H-4 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00010 0.00000 -0.00056 -0.00053
|
|
93 2S 0.00000 0.00027 0.00000 -0.00132 -0.00126
|
|
94 3S 0.00000 0.00046 0.00000 -0.00245 -0.00233
|
|
95 4S 0.00000 -0.00055 0.00000 -0.00223 -0.00212
|
|
96 5S 0.00000 0.00006 0.00000 -0.00044 -0.00042
|
|
97 6PX -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
98 6PY 0.00000 -0.00001 0.00000 0.00002 0.00002
|
|
99 6PZ 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
100 7PX -0.00005 0.00000 -0.00004 0.00000 0.00000
|
|
101 7PY 0.00000 -0.00003 0.00000 0.00006 0.00005
|
|
102 7PZ 0.00000 -0.00003 0.00000 -0.00004 -0.00004
|
|
103 8PX -0.00017 0.00000 -0.00014 0.00000 0.00000
|
|
104 8PY 0.00000 -0.00002 0.00000 0.00017 0.00016
|
|
105 8PZ 0.00000 -0.00015 0.00000 -0.00012 -0.00011
|
|
106 9PX -0.00022 0.00000 -0.00017 0.00000 0.00000
|
|
107 9PY 0.00000 0.00028 0.00000 0.00016 0.00015
|
|
108 9PZ 0.00000 -0.00027 0.00000 -0.00006 -0.00006
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
113 10D-2 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
114 11D 0 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00001 0.00000 0.00002 0.00002
|
|
117 11D+2 0.00000 -0.00001 0.00000 0.00002 0.00002
|
|
118 11D-2 0.00002 0.00000 0.00001 0.00000 0.00000
|
|
119 12D 0 0.00000 -0.00001 0.00000 0.00002 0.00002
|
|
120 12D+1 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00006 0.00000 0.00003 0.00003
|
|
122 12D+2 0.00000 0.00006 0.00000 0.00002 0.00002
|
|
123 12D-2 0.00006 0.00000 0.00005 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00001 0.00000 0.00001 0.00001
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00001 0.00000 0.00001 0.00001
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 -0.00001 0.00000 -0.00001 -0.00001
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00061 0.00010 -0.00048 0.00028 0.00027
|
|
148 2S -0.00145 0.00027 -0.00114 0.00066 0.00063
|
|
149 3S -0.00268 0.00046 -0.00212 0.00122 0.00116
|
|
150 4S -0.00245 -0.00055 -0.00193 0.00112 0.00106
|
|
151 5S -0.00048 0.00006 -0.00038 0.00022 0.00021
|
|
152 6PX 0.00002 0.00000 0.00001 -0.00001 -0.00001
|
|
153 6PY -0.00002 0.00000 -0.00001 0.00000 0.00000
|
|
154 6PZ -0.00001 -0.00001 -0.00001 0.00001 0.00001
|
|
155 7PX 0.00004 -0.00003 0.00003 -0.00004 -0.00004
|
|
156 7PY -0.00005 0.00002 -0.00004 -0.00001 -0.00001
|
|
157 7PZ -0.00004 -0.00003 -0.00003 0.00002 0.00002
|
|
158 8PX 0.00012 -0.00001 0.00009 -0.00013 -0.00012
|
|
159 8PY -0.00017 0.00001 -0.00013 -0.00006 -0.00006
|
|
160 8PZ -0.00013 -0.00015 -0.00010 0.00006 0.00006
|
|
161 9PX 0.00009 0.00024 0.00007 -0.00014 -0.00014
|
|
162 9PY -0.00018 -0.00014 -0.00014 -0.00009 -0.00009
|
|
163 9PZ -0.00006 -0.00027 -0.00005 0.00003 0.00003
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
168 10D-2 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
169 11D 0 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00002 0.00001 0.00002 -0.00001 -0.00001
|
|
171 11D-1 -0.00001 -0.00001 -0.00001 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00001 0.00000 0.00002 0.00001
|
|
173 11D-2 0.00002 -0.00001 0.00002 0.00000 0.00000
|
|
174 12D 0 0.00002 -0.00001 0.00001 -0.00001 -0.00001
|
|
175 12D+1 0.00002 0.00006 0.00002 -0.00002 -0.00002
|
|
176 12D-1 -0.00002 -0.00003 -0.00002 0.00000 0.00000
|
|
177 12D+2 0.00001 -0.00003 0.00001 0.00004 0.00004
|
|
178 12D-2 0.00004 0.00005 0.00003 0.00001 0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00001 0.00001 0.00001 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00001 0.00001 0.00001 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 -0.00001 -0.00001 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00061 0.00010 0.00048 0.00028 0.00027
|
|
203 2S 0.00145 0.00027 0.00114 0.00066 0.00063
|
|
204 3S 0.00268 0.00046 0.00212 0.00122 0.00116
|
|
205 4S 0.00245 -0.00055 0.00193 0.00112 0.00106
|
|
206 5S 0.00048 0.00006 0.00038 0.00022 0.00021
|
|
207 6PX 0.00002 0.00000 0.00001 0.00001 0.00001
|
|
208 6PY 0.00002 0.00000 0.00001 0.00000 0.00000
|
|
209 6PZ 0.00001 -0.00001 0.00001 0.00001 0.00001
|
|
210 7PX 0.00004 0.00003 0.00003 0.00004 0.00004
|
|
211 7PY 0.00005 0.00002 0.00004 -0.00001 -0.00001
|
|
212 7PZ 0.00004 -0.00003 0.00003 0.00002 0.00002
|
|
213 8PX 0.00012 0.00001 0.00009 0.00013 0.00012
|
|
214 8PY 0.00017 0.00001 0.00013 -0.00006 -0.00006
|
|
215 8PZ 0.00013 -0.00015 0.00010 0.00006 0.00006
|
|
216 9PX 0.00009 -0.00024 0.00007 0.00014 0.00014
|
|
217 9PY 0.00018 -0.00014 0.00014 -0.00009 -0.00009
|
|
218 9PZ 0.00006 -0.00027 0.00005 0.00003 0.00003
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
223 10D-2 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
224 11D 0 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00002 -0.00001 0.00002 0.00001 0.00001
|
|
226 11D-1 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00001 0.00000 0.00002 0.00001
|
|
228 11D-2 0.00002 0.00001 0.00002 0.00000 0.00000
|
|
229 12D 0 -0.00002 -0.00001 -0.00001 -0.00001 -0.00001
|
|
230 12D+1 0.00002 -0.00006 0.00002 0.00002 0.00002
|
|
231 12D-1 0.00002 -0.00003 0.00002 0.00000 0.00000
|
|
232 12D+2 -0.00001 -0.00003 -0.00001 0.00004 0.00004
|
|
233 12D-2 0.00004 -0.00005 0.00003 -0.00001 -0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 42 43 44 45
|
|
41 15D-2 0.00018
|
|
42 16F 0 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00001 0.00000 -0.00001 0.00001
|
|
93 2S 0.00000 0.00002 0.00000 -0.00002 0.00002
|
|
94 3S 0.00000 0.00004 0.00000 -0.00003 0.00005
|
|
95 4S 0.00000 -0.00001 0.00000 -0.00003 0.00004
|
|
96 5S 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
97 6PX -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX -0.00013 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX -0.00017 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00046 0.00001 -0.00001 0.00000 -0.00001
|
|
148 2S -0.00109 0.00002 -0.00002 0.00001 -0.00001
|
|
149 3S -0.00201 0.00004 -0.00003 0.00002 -0.00002
|
|
150 4S -0.00184 -0.00001 -0.00003 0.00002 -0.00002
|
|
151 5S -0.00036 0.00000 -0.00001 0.00000 0.00000
|
|
152 6PX 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY -0.00012 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00007 0.00001 0.00000 0.00000 0.00000
|
|
162 9PY -0.00014 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ -0.00005 -0.00001 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00046 0.00001 0.00001 0.00000 -0.00001
|
|
203 2S 0.00109 0.00002 0.00002 0.00001 -0.00001
|
|
204 3S 0.00201 0.00004 0.00003 0.00002 -0.00002
|
|
205 4S 0.00184 -0.00001 0.00003 0.00002 -0.00002
|
|
206 5S 0.00036 0.00000 0.00001 0.00000 0.00000
|
|
207 6PX 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00009 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00012 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00010 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00007 -0.00001 0.00000 0.00000 0.00000
|
|
217 9PY 0.00014 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00005 -0.00001 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 47 48 49 50
|
|
46 16F-2 0.00000
|
|
47 16F+3 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00001
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 -0.00001 0.00008 0.00000
|
|
93 2S 0.00000 0.00000 -0.00002 0.00019 0.00000
|
|
94 3S 0.00000 0.00000 -0.00004 0.00033 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 -0.00004 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
104 8PY 0.00000 0.00000 0.00001 -0.00004 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
107 9PY 0.00000 0.00000 0.00000 0.00005 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 -0.00006 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00001 0.00000 -0.00001 0.00008 -0.00005
|
|
148 2S 0.00002 0.00000 -0.00002 0.00019 -0.00012
|
|
149 3S 0.00004 0.00000 -0.00004 0.00033 -0.00022
|
|
150 4S 0.00004 0.00000 0.00000 -0.00004 -0.00020
|
|
151 5S 0.00001 0.00000 0.00000 0.00002 -0.00004
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 -0.00004 0.00001
|
|
159 8PY 0.00000 0.00000 0.00000 0.00002 -0.00001
|
|
160 8PZ 0.00000 0.00000 0.00000 -0.00002 -0.00001
|
|
161 9PX 0.00000 0.00000 0.00000 0.00004 0.00001
|
|
162 9PY 0.00000 0.00000 0.00000 -0.00002 -0.00001
|
|
163 9PZ 0.00000 0.00000 0.00000 -0.00006 -0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00001 0.00000 -0.00001 0.00008 0.00005
|
|
203 2S -0.00002 0.00000 -0.00002 0.00019 0.00012
|
|
204 3S -0.00004 0.00000 -0.00004 0.00033 0.00022
|
|
205 4S -0.00004 0.00000 0.00000 -0.00004 0.00020
|
|
206 5S -0.00001 0.00000 0.00000 0.00002 0.00004
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00004 0.00001
|
|
214 8PY 0.00000 0.00000 0.00000 0.00002 0.00001
|
|
215 8PZ 0.00000 0.00000 0.00000 -0.00002 0.00001
|
|
216 9PX 0.00000 0.00000 0.00000 -0.00004 0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 -0.00002 0.00001
|
|
218 9PZ 0.00000 0.00000 0.00000 -0.00006 0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 52 53 54 55
|
|
51 17F-1 0.00000
|
|
52 17F+2 0.00000 0.00001
|
|
53 17F-2 0.00000 0.00000 0.00001
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 -0.00001 0.00001 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S -0.00006 0.00009 0.00000 0.00000 -0.00007
|
|
93 2S -0.00014 0.00021 0.00000 0.00000 -0.00016
|
|
94 3S -0.00025 0.00039 0.00000 0.00000 -0.00028
|
|
95 4S -0.00023 0.00036 0.00000 0.00000 -0.00006
|
|
96 5S -0.00005 0.00007 0.00000 0.00000 -0.00001
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
101 7PY 0.00001 -0.00001 0.00000 0.00000 0.00002
|
|
102 7PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
104 8PY 0.00002 -0.00003 0.00000 0.00000 0.00004
|
|
105 8PZ -0.00001 0.00002 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
107 9PY 0.00002 -0.00003 0.00000 0.00000 0.00000
|
|
108 9PZ -0.00001 0.00001 0.00000 0.00000 0.00002
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00003 -0.00004 0.00008 0.00000 -0.00007
|
|
148 2S 0.00007 -0.00011 0.00018 0.00000 -0.00016
|
|
149 3S 0.00013 -0.00020 0.00034 0.00000 -0.00028
|
|
150 4S 0.00012 -0.00018 0.00031 0.00000 -0.00006
|
|
151 5S 0.00002 -0.00004 0.00006 0.00000 -0.00001
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00001 -0.00001 0.00000 0.00001
|
|
156 7PY 0.00000 0.00000 0.00001 0.00000 -0.00001
|
|
157 7PZ 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
158 8PX -0.00001 0.00002 -0.00001 0.00000 0.00004
|
|
159 8PY -0.00001 0.00001 0.00002 0.00000 -0.00002
|
|
160 8PZ 0.00001 -0.00001 0.00002 0.00000 0.00000
|
|
161 9PX -0.00001 0.00002 -0.00001 0.00000 0.00000
|
|
162 9PY -0.00001 0.00001 0.00002 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00001 0.00000 0.00002
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00003 -0.00004 -0.00008 0.00000 -0.00007
|
|
203 2S 0.00007 -0.00011 -0.00018 0.00000 -0.00016
|
|
204 3S 0.00013 -0.00020 -0.00034 0.00000 -0.00028
|
|
205 4S 0.00012 -0.00018 -0.00031 0.00000 -0.00006
|
|
206 5S 0.00002 -0.00004 -0.00006 0.00000 -0.00001
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 -0.00001 -0.00001 0.00000 -0.00001
|
|
211 7PY 0.00000 0.00000 -0.00001 0.00000 -0.00001
|
|
212 7PZ 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
213 8PX 0.00001 -0.00002 -0.00001 0.00000 -0.00004
|
|
214 8PY -0.00001 0.00001 -0.00002 0.00000 -0.00002
|
|
215 8PZ 0.00001 -0.00001 -0.00002 0.00000 0.00000
|
|
216 9PX 0.00001 -0.00002 -0.00001 0.00000 0.00000
|
|
217 9PY -0.00001 0.00001 -0.00002 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 -0.00001 0.00000 0.00002
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 57 58 59 60
|
|
56 18F 0 0.00001
|
|
57 18F+1 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 -0.00001 0.00001
|
|
60 18F-2 0.00000 -0.00001 0.00000 0.00000 0.00001
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00008 0.00000 -0.00007 0.00015 0.00000
|
|
93 2S 0.00018 0.00000 -0.00017 0.00036 0.00000
|
|
94 3S 0.00032 0.00000 -0.00031 0.00066 0.00000
|
|
95 4S 0.00001 0.00000 -0.00028 0.00060 0.00000
|
|
96 5S 0.00001 0.00000 -0.00006 0.00012 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
101 7PY -0.00002 0.00000 0.00001 -0.00002 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
103 8PX 0.00000 -0.00002 0.00000 0.00000 0.00004
|
|
104 8PY -0.00004 0.00000 0.00002 -0.00005 0.00000
|
|
105 8PZ -0.00001 0.00000 -0.00001 0.00003 0.00000
|
|
106 9PX 0.00000 -0.00002 0.00000 0.00000 0.00005
|
|
107 9PY 0.00003 0.00000 0.00002 -0.00004 0.00000
|
|
108 9PZ -0.00004 0.00000 -0.00001 0.00002 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
117 11D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
123 12D-2 0.00000 0.00001 0.00000 0.00000 -0.00001
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00008 -0.00006 0.00004 -0.00008 0.00013
|
|
148 2S 0.00018 -0.00015 0.00008 -0.00018 0.00031
|
|
149 3S 0.00032 -0.00027 0.00016 -0.00033 0.00057
|
|
150 4S 0.00001 -0.00025 0.00014 -0.00030 0.00052
|
|
151 5S 0.00001 -0.00005 0.00003 -0.00006 0.00010
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX -0.00002 0.00000 -0.00001 0.00001 -0.00001
|
|
156 7PY 0.00001 -0.00001 0.00000 0.00000 0.00001
|
|
157 7PZ 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
158 8PX -0.00004 0.00001 -0.00002 0.00004 -0.00002
|
|
159 8PY 0.00002 -0.00002 -0.00001 0.00002 0.00004
|
|
160 8PZ -0.00001 -0.00001 0.00001 -0.00002 0.00003
|
|
161 9PX 0.00002 0.00001 -0.00002 0.00004 -0.00002
|
|
162 9PY -0.00001 -0.00002 -0.00001 0.00002 0.00004
|
|
163 9PZ -0.00004 -0.00001 0.00000 -0.00001 0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00008 0.00006 0.00004 -0.00008 -0.00013
|
|
203 2S 0.00018 0.00015 0.00008 -0.00018 -0.00031
|
|
204 3S 0.00032 0.00027 0.00016 -0.00033 -0.00057
|
|
205 4S 0.00001 0.00025 0.00014 -0.00030 -0.00052
|
|
206 5S 0.00001 0.00005 0.00003 -0.00006 -0.00010
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00002 0.00000 0.00001 -0.00001 -0.00001
|
|
211 7PY 0.00001 0.00001 0.00000 0.00000 -0.00001
|
|
212 7PZ 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
213 8PX 0.00004 0.00001 0.00002 -0.00004 -0.00002
|
|
214 8PY 0.00002 0.00002 -0.00001 0.00002 -0.00004
|
|
215 8PZ -0.00001 0.00001 0.00001 -0.00002 -0.00003
|
|
216 9PX -0.00002 0.00001 0.00002 -0.00004 -0.00002
|
|
217 9PY -0.00001 0.00002 -0.00001 0.00002 -0.00004
|
|
218 9PZ -0.00004 0.00001 0.00000 -0.00001 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 62 63 64 65
|
|
61 18F+3 0.00000
|
|
62 18F-3 0.00000 0.00001
|
|
63 19G 0 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00008 0.00000 0.00000 0.00001
|
|
93 2S 0.00000 -0.00018 -0.00001 0.00000 0.00002
|
|
94 3S 0.00000 -0.00033 -0.00001 0.00000 0.00004
|
|
95 4S 0.00000 -0.00008 0.00001 0.00000 0.00004
|
|
96 5S 0.00000 -0.00001 0.00000 0.00000 0.00001
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00005 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 -0.00008 0.00000 0.00001 0.00000
|
|
148 2S 0.00000 -0.00018 -0.00001 0.00002 -0.00001
|
|
149 3S 0.00000 -0.00033 -0.00001 0.00003 -0.00002
|
|
150 4S 0.00000 -0.00008 0.00001 0.00003 -0.00002
|
|
151 5S 0.00000 -0.00001 0.00000 0.00001 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00004 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 -0.00003 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 -0.00008 0.00000 -0.00001 0.00000
|
|
203 2S 0.00000 -0.00018 -0.00001 -0.00002 -0.00001
|
|
204 3S 0.00000 -0.00033 -0.00001 -0.00003 -0.00002
|
|
205 4S 0.00000 -0.00008 0.00001 -0.00003 -0.00002
|
|
206 5S 0.00000 -0.00001 0.00000 -0.00001 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 -0.00004 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 -0.00003 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 67 68 69 70
|
|
66 19G+2 0.00000
|
|
67 19G-2 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
93 2S 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
94 3S 0.00001 0.00000 0.00000 0.00003 0.00004
|
|
95 4S 0.00001 0.00000 0.00000 0.00000 0.00004
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00002 -0.00001
|
|
149 3S 0.00000 0.00001 0.00000 0.00003 -0.00002
|
|
150 4S 0.00000 0.00001 0.00000 0.00000 -0.00002
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00002 -0.00001
|
|
204 3S 0.00000 -0.00001 0.00000 0.00003 -0.00002
|
|
205 4S 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 72 73 74 75
|
|
71 19G-4 0.00000
|
|
72 20G 0 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00002 0.00000 0.00006 0.00000
|
|
93 2S 0.00000 -0.00005 0.00000 0.00014 0.00001
|
|
94 3S 0.00000 -0.00009 0.00000 0.00027 0.00001
|
|
95 4S 0.00000 0.00002 0.00000 0.00024 0.00001
|
|
96 5S 0.00000 -0.00001 0.00000 0.00005 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00001 0.00000 -0.00001 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
104 8PY 0.00000 0.00001 0.00000 -0.00002 0.00000
|
|
105 8PZ 0.00000 0.00001 0.00000 0.00001 0.00000
|
|
106 9PX 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
107 9PY 0.00000 -0.00002 0.00000 -0.00002 0.00000
|
|
108 9PZ 0.00000 0.00002 0.00000 0.00001 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00001 -0.00002 0.00005 -0.00003 0.00000
|
|
148 2S -0.00002 -0.00005 0.00012 -0.00007 0.00000
|
|
149 3S -0.00004 -0.00009 0.00023 -0.00013 -0.00001
|
|
150 4S -0.00003 0.00002 0.00021 -0.00012 -0.00001
|
|
151 5S -0.00001 -0.00001 0.00004 -0.00002 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00001 -0.00001 0.00001 0.00000
|
|
159 8PY 0.00000 -0.00001 0.00001 0.00001 0.00000
|
|
160 8PZ 0.00000 0.00001 0.00001 -0.00001 0.00000
|
|
161 9PX 0.00000 -0.00001 -0.00001 0.00002 0.00000
|
|
162 9PY 0.00000 0.00001 0.00002 0.00001 0.00000
|
|
163 9PZ 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 -0.00002 -0.00005 -0.00003 0.00000
|
|
203 2S 0.00002 -0.00005 -0.00012 -0.00007 0.00000
|
|
204 3S 0.00004 -0.00009 -0.00023 -0.00013 -0.00001
|
|
205 4S 0.00003 0.00002 -0.00021 -0.00012 -0.00001
|
|
206 5S 0.00001 -0.00001 -0.00004 -0.00002 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 -0.00001 -0.00001 -0.00001 0.00000
|
|
214 8PY 0.00000 -0.00001 -0.00001 0.00001 0.00000
|
|
215 8PZ 0.00000 0.00001 -0.00001 -0.00001 0.00000
|
|
216 9PX 0.00000 0.00001 -0.00001 -0.00002 0.00000
|
|
217 9PY 0.00000 0.00001 -0.00002 0.00001 0.00000
|
|
218 9PZ 0.00000 0.00002 -0.00001 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 77 78 79 80
|
|
76 20G-2 0.00000
|
|
77 20G+3 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00004 0.00007 0.00000
|
|
93 2S 0.00000 0.00000 0.00010 0.00017 0.00000
|
|
94 3S 0.00000 0.00000 0.00017 0.00032 0.00000
|
|
95 4S 0.00000 0.00000 0.00003 0.00029 0.00000
|
|
96 5S 0.00000 0.00000 0.00001 0.00006 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
104 8PY 0.00000 0.00000 -0.00002 -0.00002 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
107 9PY 0.00000 0.00000 0.00001 -0.00002 0.00000
|
|
108 9PZ 0.00000 0.00000 -0.00001 0.00001 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00004 -0.00004 -0.00006
|
|
148 2S 0.00001 0.00000 0.00010 -0.00009 -0.00015
|
|
149 3S 0.00001 0.00000 0.00017 -0.00016 -0.00027
|
|
150 4S 0.00001 0.00000 0.00003 -0.00014 -0.00025
|
|
151 5S 0.00000 0.00000 0.00001 -0.00003 -0.00005
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 -0.00001 0.00001 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 -0.00002 0.00002 0.00001
|
|
159 8PY 0.00000 0.00000 0.00001 0.00001 -0.00002
|
|
160 8PZ 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
161 9PX 0.00000 0.00000 0.00000 0.00002 0.00001
|
|
162 9PY 0.00000 0.00000 0.00000 0.00001 -0.00002
|
|
163 9PZ 0.00000 0.00000 -0.00001 0.00000 -0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00004 -0.00004 0.00006
|
|
203 2S -0.00001 0.00000 0.00010 -0.00009 0.00015
|
|
204 3S -0.00001 0.00000 0.00017 -0.00016 0.00027
|
|
205 4S -0.00001 0.00000 0.00003 -0.00014 0.00025
|
|
206 5S 0.00000 0.00000 0.00001 -0.00003 0.00005
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00002 -0.00002 0.00001
|
|
214 8PY 0.00000 0.00000 0.00001 0.00001 0.00002
|
|
215 8PZ 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
216 9PX 0.00000 0.00000 0.00000 -0.00002 0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 0.00001 0.00002
|
|
218 9PZ 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 82 83 84 85
|
|
81 21H 0 0.00000
|
|
82 21H+1 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
93 2S 0.00000 0.00000 -0.00001 -0.00002 0.00000
|
|
94 3S 0.00000 0.00000 -0.00002 -0.00003 0.00000
|
|
95 4S -0.00001 0.00000 -0.00002 -0.00003 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
148 2S 0.00000 -0.00001 0.00001 0.00001 -0.00002
|
|
149 3S 0.00000 -0.00002 0.00001 0.00002 -0.00003
|
|
150 4S -0.00001 -0.00002 0.00001 0.00001 -0.00003
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
203 2S 0.00000 0.00001 0.00001 0.00001 0.00002
|
|
204 3S 0.00000 0.00002 0.00001 0.00002 0.00003
|
|
205 4S -0.00001 0.00002 0.00001 0.00001 0.00003
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 87 88 89 90
|
|
86 21H+3 0.00000
|
|
87 21H-3 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00001 -0.00002 0.00000 0.00000
|
|
93 2S 0.00000 -0.00002 -0.00004 0.00000 0.00000
|
|
94 3S 0.00000 -0.00003 -0.00008 0.00000 0.00000
|
|
95 4S 0.00000 0.00001 -0.00007 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
107 9PY 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 -0.00001 0.00001 0.00002 0.00000
|
|
148 2S 0.00000 -0.00002 0.00002 0.00004 -0.00001
|
|
149 3S 0.00000 -0.00003 0.00004 0.00007 -0.00001
|
|
150 4S 0.00000 0.00001 0.00004 0.00006 -0.00001
|
|
151 5S 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 -0.00001 0.00001 -0.00002 0.00000
|
|
203 2S 0.00000 -0.00002 0.00002 -0.00004 0.00001
|
|
204 3S 0.00000 -0.00003 0.00004 -0.00007 0.00001
|
|
205 4S 0.00000 0.00001 0.00004 -0.00006 0.00001
|
|
206 5S 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 92 93 94 95
|
|
91 21H-5 0.00000
|
|
92 2 H 1S 0.00000 0.00212
|
|
93 2S 0.00001 0.00501 0.01181
|
|
94 3S 0.00002 0.00914 0.02155 0.03935
|
|
95 4S 0.00001 0.00647 0.01512 0.02809 0.02864
|
|
96 5S 0.00000 0.00131 0.00312 0.00574 0.00470
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 -0.00009 -0.00021 -0.00037 -0.00024
|
|
99 6PZ 0.00000 0.00004 0.00008 0.00015 0.00019
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 -0.00029 -0.00067 -0.00122 -0.00064
|
|
102 7PZ 0.00000 0.00011 0.00025 0.00046 0.00060
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 -0.00079 -0.00184 -0.00334 -0.00225
|
|
105 8PZ 0.00000 0.00031 0.00067 0.00129 0.00216
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 -0.00031 -0.00064 -0.00128 -0.00325
|
|
108 9PZ 0.00000 -0.00008 -0.00025 -0.00035 0.00192
|
|
109 10D 0 0.00000 -0.00001 -0.00003 -0.00005 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 -0.00002 -0.00005 -0.00010 -0.00010
|
|
112 10D+2 0.00000 -0.00003 -0.00006 -0.00011 -0.00006
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 -0.00003 -0.00007 -0.00013 -0.00001
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 -0.00008 -0.00017 -0.00032 -0.00033
|
|
117 11D+2 0.00000 -0.00009 -0.00020 -0.00037 -0.00019
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 -0.00007 -0.00018 -0.00032 -0.00017
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 -0.00006 -0.00011 -0.00023 -0.00067
|
|
122 12D+2 0.00000 -0.00005 -0.00011 -0.00021 -0.00060
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 -0.00001 -0.00002 -0.00004 -0.00003
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00001 0.00001 -0.00001
|
|
127 13F+2 0.00000 -0.00001 -0.00003 -0.00005 -0.00005
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00001 0.00003 0.00005 0.00002
|
|
131 14F 0 0.00000 -0.00002 -0.00006 -0.00010 -0.00012
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00001 0.00003 0.00005 0.00002
|
|
134 14F+2 0.00000 -0.00003 -0.00007 -0.00013 -0.00016
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00002 0.00004 0.00008 0.00015
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
145 15G+4 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 -0.00022 -0.00055 -0.00116 -0.00292
|
|
148 2S 0.00000 -0.00055 -0.00137 -0.00285 -0.00713
|
|
149 3S -0.00001 -0.00116 -0.00285 -0.00581 -0.01311
|
|
150 4S -0.00001 -0.00292 -0.00713 -0.01311 -0.00894
|
|
151 5S 0.00000 -0.00053 -0.00126 -0.00236 -0.00269
|
|
152 6PX 0.00000 0.00001 0.00002 0.00005 0.00013
|
|
153 6PY 0.00000 0.00002 0.00005 0.00010 0.00004
|
|
154 6PZ 0.00000 -0.00002 -0.00004 -0.00008 -0.00002
|
|
155 7PX 0.00000 0.00001 0.00002 0.00007 0.00047
|
|
156 7PY 0.00000 0.00010 0.00024 0.00043 0.00016
|
|
157 7PZ 0.00000 -0.00005 -0.00013 -0.00023 -0.00003
|
|
158 8PX 0.00000 0.00009 0.00024 0.00049 0.00114
|
|
159 8PY 0.00000 0.00033 0.00076 0.00138 0.00086
|
|
160 8PZ 0.00000 -0.00019 -0.00050 -0.00088 0.00017
|
|
161 9PX 0.00000 0.00052 0.00131 0.00234 0.00033
|
|
162 9PY 0.00000 0.00019 0.00040 0.00079 0.00177
|
|
163 9PZ 0.00000 -0.00032 -0.00083 -0.00142 0.00094
|
|
164 10D 0 0.00000 0.00000 -0.00001 -0.00002 0.00002
|
|
165 10D+1 0.00000 0.00001 0.00003 0.00005 0.00003
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
167 10D+2 0.00000 -0.00001 -0.00003 -0.00005 -0.00007
|
|
168 10D-2 0.00000 -0.00001 -0.00002 -0.00003 0.00000
|
|
169 11D 0 0.00000 -0.00002 -0.00004 -0.00007 0.00004
|
|
170 11D+1 0.00000 0.00001 0.00003 0.00006 0.00003
|
|
171 11D-1 0.00000 0.00000 -0.00001 -0.00002 0.00000
|
|
172 11D+2 0.00000 -0.00002 -0.00006 -0.00011 -0.00017
|
|
173 11D-2 0.00000 -0.00003 -0.00007 -0.00012 0.00001
|
|
174 12D 0 0.00000 0.00000 -0.00001 -0.00001 0.00011
|
|
175 12D+1 0.00000 0.00007 0.00019 0.00033 -0.00010
|
|
176 12D-1 0.00000 -0.00001 -0.00004 -0.00007 0.00017
|
|
177 12D+2 0.00000 -0.00012 -0.00029 -0.00053 -0.00028
|
|
178 12D-2 0.00000 -0.00002 -0.00002 -0.00006 -0.00041
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
180 13F+1 0.00000 0.00000 0.00001 0.00001 -0.00001
|
|
181 13F-1 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
182 13F+2 0.00000 0.00000 -0.00001 -0.00002 -0.00002
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
184 13F+3 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
186 14F 0 0.00000 0.00001 0.00002 0.00004 0.00001
|
|
187 14F+1 0.00000 0.00000 -0.00001 -0.00002 -0.00004
|
|
188 14F-1 0.00000 0.00000 -0.00001 -0.00002 -0.00001
|
|
189 14F+2 0.00000 -0.00001 -0.00002 -0.00003 -0.00001
|
|
190 14F-2 0.00000 0.00001 0.00002 0.00004 0.00000
|
|
191 14F+3 0.00000 0.00001 0.00002 0.00004 0.00004
|
|
192 14F-3 0.00000 -0.00001 -0.00004 -0.00007 0.00002
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
202 4 H 1S 0.00000 -0.00022 -0.00055 -0.00116 -0.00292
|
|
203 2S 0.00000 -0.00055 -0.00137 -0.00285 -0.00713
|
|
204 3S -0.00001 -0.00116 -0.00285 -0.00581 -0.01311
|
|
205 4S -0.00001 -0.00292 -0.00713 -0.01311 -0.00894
|
|
206 5S 0.00000 -0.00053 -0.00126 -0.00236 -0.00269
|
|
207 6PX 0.00000 -0.00001 -0.00002 -0.00005 -0.00013
|
|
208 6PY 0.00000 0.00002 0.00005 0.00010 0.00004
|
|
209 6PZ 0.00000 -0.00002 -0.00004 -0.00008 -0.00002
|
|
210 7PX 0.00000 -0.00001 -0.00002 -0.00007 -0.00047
|
|
211 7PY 0.00000 0.00010 0.00024 0.00043 0.00016
|
|
212 7PZ 0.00000 -0.00005 -0.00013 -0.00023 -0.00003
|
|
213 8PX 0.00000 -0.00009 -0.00024 -0.00049 -0.00114
|
|
214 8PY 0.00000 0.00033 0.00076 0.00138 0.00086
|
|
215 8PZ 0.00000 -0.00019 -0.00050 -0.00088 0.00017
|
|
216 9PX 0.00000 -0.00052 -0.00131 -0.00234 -0.00033
|
|
217 9PY 0.00000 0.00019 0.00040 0.00079 0.00177
|
|
218 9PZ 0.00000 -0.00032 -0.00083 -0.00142 0.00094
|
|
219 10D 0 0.00000 0.00000 -0.00001 -0.00002 0.00002
|
|
220 10D+1 0.00000 -0.00001 -0.00003 -0.00005 -0.00003
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
222 10D+2 0.00000 -0.00001 -0.00003 -0.00005 -0.00007
|
|
223 10D-2 0.00000 0.00001 0.00002 0.00003 0.00000
|
|
224 11D 0 0.00000 -0.00002 -0.00004 -0.00007 0.00004
|
|
225 11D+1 0.00000 -0.00001 -0.00003 -0.00006 -0.00003
|
|
226 11D-1 0.00000 0.00000 -0.00001 -0.00002 0.00000
|
|
227 11D+2 0.00000 -0.00002 -0.00006 -0.00011 -0.00017
|
|
228 11D-2 0.00000 0.00003 0.00007 0.00012 -0.00001
|
|
229 12D 0 0.00000 0.00000 -0.00001 -0.00001 0.00011
|
|
230 12D+1 0.00000 -0.00007 -0.00019 -0.00033 0.00010
|
|
231 12D-1 0.00000 -0.00001 -0.00004 -0.00007 0.00017
|
|
232 12D+2 0.00000 -0.00012 -0.00029 -0.00053 -0.00028
|
|
233 12D-2 0.00000 0.00002 0.00002 0.00006 0.00041
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
235 13F+1 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
236 13F-1 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
237 13F+2 0.00000 0.00000 -0.00001 -0.00002 -0.00002
|
|
238 13F-2 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
239 13F+3 0.00000 -0.00001 -0.00001 -0.00002 -0.00002
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
241 14F 0 0.00000 0.00001 0.00002 0.00004 0.00001
|
|
242 14F+1 0.00000 0.00000 0.00001 0.00002 0.00004
|
|
243 14F-1 0.00000 0.00000 -0.00001 -0.00002 -0.00001
|
|
244 14F+2 0.00000 -0.00001 -0.00002 -0.00003 -0.00001
|
|
245 14F-2 0.00000 -0.00001 -0.00002 -0.00004 0.00000
|
|
246 14F+3 0.00000 -0.00001 -0.00002 -0.00004 -0.00004
|
|
247 14F-3 0.00000 -0.00001 -0.00004 -0.00007 0.00002
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
96 97 98 99 100
|
|
96 5S 0.00100
|
|
97 6PX 0.00000 0.00000
|
|
98 6PY -0.00005 0.00000 0.00000
|
|
99 6PZ 0.00002 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
101 7PY -0.00015 0.00000 0.00001 0.00000 0.00000
|
|
102 7PZ 0.00007 0.00000 0.00000 0.00001 0.00000
|
|
103 8PX 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
104 8PY -0.00040 0.00000 0.00004 -0.00002 0.00000
|
|
105 8PZ 0.00019 0.00000 -0.00001 0.00002 0.00000
|
|
106 9PX 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
107 9PY -0.00022 0.00000 0.00001 -0.00003 0.00000
|
|
108 9PZ -0.00001 0.00000 0.00001 0.00002 0.00000
|
|
109 10D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 -0.00004 0.00000 0.00000 -0.00001 0.00000
|
|
122 12D+2 -0.00002 0.00000 0.00000 -0.00001 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
124 13F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00053 0.00002 0.00000 -0.00002 0.00009
|
|
148 2S -0.00126 0.00006 -0.00001 -0.00004 0.00022
|
|
149 3S -0.00236 0.00011 -0.00001 -0.00008 0.00041
|
|
150 4S -0.00269 0.00010 0.00009 -0.00002 0.00037
|
|
151 5S -0.00045 0.00002 0.00002 -0.00002 0.00007
|
|
152 6PX 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00007 0.00000 0.00000 0.00000 -0.00001
|
|
156 7PY 0.00004 0.00000 0.00000 0.00000 0.00001
|
|
157 7PZ -0.00005 0.00000 0.00000 0.00000 0.00001
|
|
158 8PX 0.00026 0.00000 0.00000 0.00000 -0.00002
|
|
159 8PY 0.00015 0.00001 -0.00002 0.00001 0.00002
|
|
160 8PZ -0.00019 0.00001 0.00001 0.00001 0.00002
|
|
161 9PX 0.00043 0.00000 -0.00002 -0.00001 -0.00001
|
|
162 9PY 0.00014 0.00001 -0.00001 0.00002 0.00003
|
|
163 9PZ -0.00020 0.00000 0.00001 0.00002 0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00006 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00053 -0.00002 0.00000 -0.00002 -0.00009
|
|
203 2S -0.00126 -0.00006 -0.00001 -0.00004 -0.00022
|
|
204 3S -0.00236 -0.00011 -0.00001 -0.00008 -0.00041
|
|
205 4S -0.00269 -0.00010 0.00009 -0.00002 -0.00037
|
|
206 5S -0.00045 -0.00002 0.00002 -0.00002 -0.00007
|
|
207 6PX -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX -0.00007 0.00000 0.00000 0.00000 -0.00001
|
|
211 7PY 0.00004 0.00000 0.00000 0.00000 -0.00001
|
|
212 7PZ -0.00005 0.00000 0.00000 0.00000 -0.00001
|
|
213 8PX -0.00026 0.00000 0.00000 0.00000 -0.00002
|
|
214 8PY 0.00015 -0.00001 -0.00002 0.00001 -0.00002
|
|
215 8PZ -0.00019 -0.00001 0.00001 0.00001 -0.00002
|
|
216 9PX -0.00043 0.00000 0.00002 0.00001 -0.00001
|
|
217 9PY 0.00014 -0.00001 -0.00001 0.00002 -0.00003
|
|
218 9PZ -0.00020 0.00000 0.00001 0.00002 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 -0.00006 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 102 103 104 105
|
|
101 7PY 0.00005
|
|
102 7PZ -0.00001 0.00002
|
|
103 8PX 0.00000 0.00000 0.00009
|
|
104 8PY 0.00012 -0.00005 0.00000 0.00034
|
|
105 8PZ -0.00002 0.00006 0.00000 -0.00015 0.00027
|
|
106 9PX 0.00000 0.00000 0.00012 0.00000 0.00000
|
|
107 9PY -0.00001 -0.00011 0.00000 0.00016 -0.00047
|
|
108 9PZ 0.00006 0.00008 0.00000 -0.00001 0.00037
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00001 -0.00001 0.00000 0.00003 -0.00003
|
|
117 11D+2 0.00001 0.00000 0.00000 0.00003 0.00000
|
|
118 11D-2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
119 12D 0 0.00001 0.00000 0.00000 0.00003 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
121 12D-1 0.00000 -0.00002 0.00000 0.00003 -0.00010
|
|
122 12D+2 0.00000 -0.00002 0.00000 0.00004 -0.00010
|
|
123 12D-2 0.00000 0.00000 -0.00003 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00001 -0.00002
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 -0.00001 0.00002
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00004 -0.00005 0.00033 -0.00009 -0.00019
|
|
148 2S -0.00010 -0.00013 0.00078 -0.00018 -0.00050
|
|
149 3S -0.00016 -0.00023 0.00144 -0.00026 -0.00088
|
|
150 4S 0.00033 -0.00003 0.00131 0.00056 0.00017
|
|
151 5S 0.00004 -0.00005 0.00026 0.00016 -0.00019
|
|
152 6PX 0.00000 0.00000 -0.00001 0.00001 0.00001
|
|
153 6PY 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
155 7PX 0.00001 0.00001 -0.00002 0.00002 0.00004
|
|
156 7PY -0.00002 0.00000 0.00003 -0.00005 0.00000
|
|
157 7PZ 0.00001 0.00001 0.00002 0.00000 0.00003
|
|
158 8PX 0.00002 0.00001 -0.00006 0.00007 0.00004
|
|
159 8PY -0.00005 0.00002 0.00009 -0.00015 0.00006
|
|
160 8PZ 0.00004 0.00003 0.00007 0.00000 0.00017
|
|
161 9PX -0.00009 -0.00004 -0.00005 -0.00009 -0.00024
|
|
162 9PY 0.00000 0.00006 0.00010 -0.00009 0.00024
|
|
163 9PZ 0.00008 0.00006 0.00003 0.00006 0.00032
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
170 11D+1 0.00000 0.00000 -0.00001 0.00001 -0.00001
|
|
171 11D-1 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
173 11D-2 0.00001 0.00000 -0.00001 0.00002 0.00001
|
|
174 12D 0 0.00000 0.00000 -0.00001 0.00001 0.00001
|
|
175 12D+1 -0.00001 -0.00001 -0.00001 -0.00001 -0.00006
|
|
176 12D-1 0.00001 0.00001 0.00001 0.00000 0.00004
|
|
177 12D+2 0.00002 0.00000 -0.00001 0.00002 0.00002
|
|
178 12D-2 0.00000 -0.00002 -0.00002 0.00002 -0.00008
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00004 -0.00005 -0.00033 -0.00009 -0.00019
|
|
203 2S -0.00010 -0.00013 -0.00078 -0.00018 -0.00050
|
|
204 3S -0.00016 -0.00023 -0.00144 -0.00026 -0.00088
|
|
205 4S 0.00033 -0.00003 -0.00131 0.00056 0.00017
|
|
206 5S 0.00004 -0.00005 -0.00026 0.00016 -0.00019
|
|
207 6PX 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
208 6PY 0.00000 0.00000 -0.00001 -0.00001 0.00000
|
|
209 6PZ 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
210 7PX -0.00001 -0.00001 -0.00002 -0.00002 -0.00004
|
|
211 7PY -0.00002 0.00000 -0.00003 -0.00005 0.00000
|
|
212 7PZ 0.00001 0.00001 -0.00002 0.00000 0.00003
|
|
213 8PX -0.00002 -0.00001 -0.00006 -0.00007 -0.00004
|
|
214 8PY -0.00005 0.00002 -0.00009 -0.00015 0.00006
|
|
215 8PZ 0.00004 0.00003 -0.00007 0.00000 0.00017
|
|
216 9PX 0.00009 0.00004 -0.00005 0.00009 0.00024
|
|
217 9PY 0.00000 0.00006 -0.00010 -0.00009 0.00024
|
|
218 9PZ 0.00008 0.00006 -0.00003 0.00006 0.00032
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00001 0.00000 0.00000 0.00001 0.00001
|
|
225 11D+1 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
226 11D-1 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
228 11D-2 -0.00001 0.00000 -0.00001 -0.00002 -0.00001
|
|
229 12D 0 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
230 12D+1 0.00001 0.00001 -0.00001 0.00001 0.00006
|
|
231 12D-1 0.00001 0.00001 -0.00001 0.00000 0.00004
|
|
232 12D+2 0.00002 0.00000 0.00001 0.00002 0.00002
|
|
233 12D-2 0.00000 0.00002 -0.00002 -0.00002 0.00008
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 107 108 109 110
|
|
106 9PX 0.00015
|
|
107 9PY 0.00000 0.00083
|
|
108 9PZ 0.00000 -0.00070 0.00065
|
|
109 10D 0 0.00000 -0.00001 0.00001 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
113 10D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 -0.00002 0.00002 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00005 -0.00003 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
118 11D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 -0.00001 0.00002 0.00000 0.00000
|
|
120 12D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00018 -0.00016 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00017 -0.00015 0.00000 0.00000
|
|
123 12D-2 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00002 -0.00001 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00003 -0.00002 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 -0.00003 0.00003 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00042 0.00036 -0.00032 0.00000 0.00001
|
|
148 2S 0.00100 0.00093 -0.00083 -0.00001 0.00001
|
|
149 3S 0.00186 0.00163 -0.00142 -0.00002 0.00002
|
|
150 4S 0.00169 -0.00060 0.00094 0.00002 0.00002
|
|
151 5S 0.00033 0.00030 -0.00020 0.00000 0.00000
|
|
152 6PX -0.00001 -0.00002 0.00001 0.00000 0.00000
|
|
153 6PY 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
154 6PZ 0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
155 7PX -0.00003 -0.00008 0.00008 0.00000 0.00000
|
|
156 7PY 0.00004 0.00002 -0.00003 0.00000 0.00000
|
|
157 7PZ 0.00003 -0.00006 0.00006 0.00000 0.00000
|
|
158 8PX -0.00008 -0.00008 0.00007 0.00000 0.00000
|
|
159 8PY 0.00011 -0.00006 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00009 -0.00033 0.00032 0.00001 0.00000
|
|
161 9PX -0.00007 0.00049 -0.00052 -0.00001 0.00000
|
|
162 9PY 0.00013 -0.00042 0.00035 0.00000 0.00000
|
|
163 9PZ 0.00004 -0.00063 0.00062 0.00001 0.00000
|
|
164 10D 0 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
168 10D-2 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
169 11D 0 0.00000 -0.00002 0.00002 0.00000 0.00000
|
|
170 11D+1 -0.00001 0.00002 -0.00002 0.00000 0.00000
|
|
171 11D-1 0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00002 -0.00002 0.00000 0.00000
|
|
173 11D-2 -0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
174 12D 0 -0.00001 -0.00003 0.00003 0.00000 0.00000
|
|
175 12D+1 -0.00002 0.00012 -0.00012 0.00000 0.00000
|
|
176 12D-1 0.00001 -0.00008 0.00007 0.00000 0.00000
|
|
177 12D+2 -0.00001 -0.00004 0.00006 0.00000 0.00000
|
|
178 12D-2 -0.00003 0.00014 -0.00012 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
186 14F 0 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
190 14F-2 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00042 0.00036 -0.00032 0.00000 -0.00001
|
|
203 2S -0.00100 0.00093 -0.00083 -0.00001 -0.00001
|
|
204 3S -0.00186 0.00163 -0.00142 -0.00002 -0.00002
|
|
205 4S -0.00169 -0.00060 0.00094 0.00002 -0.00002
|
|
206 5S -0.00033 0.00030 -0.00020 0.00000 0.00000
|
|
207 6PX -0.00001 0.00002 -0.00001 0.00000 0.00000
|
|
208 6PY -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
209 6PZ -0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
210 7PX -0.00003 0.00008 -0.00008 0.00000 0.00000
|
|
211 7PY -0.00004 0.00002 -0.00003 0.00000 0.00000
|
|
212 7PZ -0.00003 -0.00006 0.00006 0.00000 0.00000
|
|
213 8PX -0.00008 0.00008 -0.00007 0.00000 0.00000
|
|
214 8PY -0.00011 -0.00006 0.00000 0.00000 0.00000
|
|
215 8PZ -0.00009 -0.00033 0.00032 0.00001 0.00000
|
|
216 9PX -0.00007 -0.00049 0.00052 0.00001 0.00000
|
|
217 9PY -0.00013 -0.00042 0.00035 0.00000 0.00000
|
|
218 9PZ -0.00004 -0.00063 0.00062 0.00001 0.00000
|
|
219 10D 0 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
223 10D-2 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
224 11D 0 0.00000 -0.00002 0.00002 0.00000 0.00000
|
|
225 11D+1 -0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
226 11D-1 -0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00002 -0.00002 0.00000 0.00000
|
|
228 11D-2 -0.00001 0.00002 -0.00002 0.00000 0.00000
|
|
229 12D 0 0.00001 -0.00003 0.00003 0.00000 0.00000
|
|
230 12D+1 -0.00002 -0.00012 0.00012 0.00000 0.00000
|
|
231 12D-1 -0.00001 -0.00008 0.00007 0.00000 0.00000
|
|
232 12D+2 0.00001 -0.00004 0.00006 0.00000 0.00000
|
|
233 12D-2 -0.00003 -0.00014 0.00012 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
241 14F 0 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
242 14F+1 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
245 14F-2 -0.00001 -0.00001 0.00001 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 -0.00002 0.00002 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 112 113 114 115
|
|
111 10D-1 0.00000
|
|
112 10D+2 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00001 0.00000 -0.00001 -0.00002 0.00000
|
|
148 2S 0.00002 0.00000 -0.00003 -0.00004 0.00001
|
|
149 3S 0.00004 0.00000 -0.00006 -0.00007 0.00002
|
|
150 4S 0.00003 0.00004 -0.00006 0.00004 0.00002
|
|
151 5S 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
161 9PX 0.00000 -0.00001 0.00000 -0.00002 0.00000
|
|
162 9PY -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
163 9PZ 0.00000 0.00001 0.00000 0.00002 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 0.00000 0.00001 -0.00002 0.00000
|
|
203 2S 0.00002 0.00000 0.00003 -0.00004 -0.00001
|
|
204 3S 0.00004 0.00000 0.00006 -0.00007 -0.00002
|
|
205 4S 0.00003 0.00004 0.00006 0.00004 -0.00002
|
|
206 5S 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
216 9PX 0.00000 0.00001 0.00000 0.00002 0.00000
|
|
217 9PY -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
218 9PZ 0.00000 0.00001 0.00000 0.00002 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 117 118 119 120
|
|
116 11D-1 0.00001
|
|
117 11D+2 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00001 -0.00001 -0.00004 0.00000 0.00002
|
|
148 2S 0.00003 -0.00003 -0.00009 -0.00001 0.00006
|
|
149 3S 0.00006 -0.00005 -0.00016 -0.00001 0.00011
|
|
150 4S 0.00002 0.00010 -0.00014 0.00011 0.00010
|
|
151 5S 0.00003 0.00001 -0.00003 0.00001 0.00002
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00001 0.00001 0.00000 0.00000
|
|
159 8PY -0.00001 -0.00002 -0.00001 -0.00001 0.00001
|
|
160 8PZ -0.00001 0.00001 -0.00001 0.00001 0.00001
|
|
161 9PX 0.00002 -0.00003 0.00001 -0.00003 0.00000
|
|
162 9PY -0.00003 0.00000 -0.00001 0.00000 0.00001
|
|
163 9PZ -0.00002 0.00003 0.00000 0.00003 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
178 12D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 -0.00001 0.00004 0.00000 -0.00002
|
|
203 2S 0.00003 -0.00003 0.00009 -0.00001 -0.00006
|
|
204 3S 0.00006 -0.00005 0.00016 -0.00001 -0.00011
|
|
205 4S 0.00002 0.00010 0.00014 0.00011 -0.00010
|
|
206 5S 0.00003 0.00001 0.00003 0.00001 -0.00002
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
214 8PY -0.00001 -0.00002 0.00001 -0.00001 -0.00001
|
|
215 8PZ -0.00001 0.00001 0.00001 0.00001 -0.00001
|
|
216 9PX -0.00002 0.00003 0.00001 0.00003 0.00000
|
|
217 9PY -0.00003 0.00000 0.00001 0.00000 -0.00001
|
|
218 9PZ -0.00002 0.00003 0.00000 0.00003 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 -0.00001 0.00000 0.00000 0.00001 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
233 12D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 122 123 124 125
|
|
121 12D-1 0.00004
|
|
122 12D+2 0.00004 0.00004
|
|
123 12D-2 0.00000 0.00000 0.00001
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00001 0.00001 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00007 0.00004 -0.00011 0.00000 0.00000
|
|
148 2S 0.00018 0.00013 -0.00027 0.00000 0.00000
|
|
149 3S 0.00032 0.00021 -0.00049 0.00001 0.00000
|
|
150 4S -0.00017 -0.00021 -0.00045 0.00001 0.00000
|
|
151 5S 0.00006 0.00005 -0.00009 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX -0.00002 -0.00001 0.00001 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
157 7PZ -0.00001 -0.00002 -0.00001 0.00000 0.00000
|
|
158 8PX -0.00001 0.00000 0.00002 0.00000 0.00000
|
|
159 8PY -0.00001 -0.00002 -0.00003 0.00000 0.00000
|
|
160 8PZ -0.00008 -0.00008 -0.00002 0.00000 0.00000
|
|
161 9PX 0.00012 0.00012 0.00002 0.00000 0.00000
|
|
162 9PY -0.00009 -0.00009 -0.00003 0.00000 0.00000
|
|
163 9PZ -0.00014 -0.00014 -0.00001 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00001 0.00001 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00003 0.00003 0.00000 0.00000 0.00000
|
|
176 12D-1 -0.00002 -0.00002 0.00000 0.00000 0.00000
|
|
177 12D+2 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00003 0.00003 0.00001 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00007 0.00004 0.00011 0.00000 0.00000
|
|
203 2S 0.00018 0.00013 0.00027 0.00000 0.00000
|
|
204 3S 0.00032 0.00021 0.00049 0.00001 0.00000
|
|
205 4S -0.00017 -0.00021 0.00045 0.00001 0.00000
|
|
206 5S 0.00006 0.00005 0.00009 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00002 0.00001 0.00001 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
212 7PZ -0.00001 -0.00002 0.00001 0.00000 0.00000
|
|
213 8PX 0.00001 0.00000 0.00002 0.00000 0.00000
|
|
214 8PY -0.00001 -0.00002 0.00003 0.00000 0.00000
|
|
215 8PZ -0.00008 -0.00008 0.00002 0.00000 0.00000
|
|
216 9PX -0.00012 -0.00012 0.00002 0.00000 0.00000
|
|
217 9PY -0.00009 -0.00009 0.00003 0.00000 0.00000
|
|
218 9PZ -0.00014 -0.00014 0.00001 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 -0.00003 -0.00003 0.00000 0.00000 0.00000
|
|
231 12D-1 -0.00002 -0.00002 0.00000 0.00000 0.00000
|
|
232 12D+2 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
233 12D-2 -0.00003 -0.00003 0.00001 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 127 128 129 130
|
|
126 13F-1 0.00000
|
|
127 13F+2 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
148 2S 0.00001 0.00001 -0.00001 -0.00001 0.00000
|
|
149 3S 0.00002 0.00002 -0.00001 -0.00002 0.00000
|
|
150 4S -0.00001 0.00001 -0.00001 -0.00002 -0.00002
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
203 2S 0.00001 0.00001 0.00001 0.00001 0.00000
|
|
204 3S 0.00002 0.00002 0.00001 0.00002 0.00000
|
|
205 4S -0.00001 0.00001 0.00001 0.00002 -0.00002
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 132 133 134 135
|
|
131 14F 0 0.00000
|
|
132 14F+1 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00001 -0.00001 0.00000 0.00001 0.00000
|
|
148 2S 0.00002 -0.00001 0.00000 0.00003 0.00000
|
|
149 3S 0.00004 -0.00003 -0.00001 0.00005 -0.00001
|
|
150 4S 0.00001 -0.00002 -0.00003 0.00001 -0.00001
|
|
151 5S 0.00001 0.00000 0.00000 0.00001 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
160 8PZ -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
161 9PX 0.00001 0.00000 0.00001 0.00001 0.00000
|
|
162 9PY -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
163 9PZ -0.00001 0.00000 -0.00001 -0.00002 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 0.00001 0.00000 0.00001 0.00000
|
|
203 2S 0.00002 0.00001 0.00000 0.00003 0.00000
|
|
204 3S 0.00004 0.00003 -0.00001 0.00005 0.00001
|
|
205 4S 0.00001 0.00002 -0.00003 0.00001 0.00001
|
|
206 5S 0.00001 0.00000 0.00000 0.00001 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
215 8PZ -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
216 9PX -0.00001 0.00000 -0.00001 -0.00001 0.00000
|
|
217 9PY -0.00001 0.00000 0.00000 -0.00001 0.00000
|
|
218 9PZ -0.00001 0.00000 -0.00001 -0.00002 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 137 138 139 140
|
|
136 14F+3 0.00000
|
|
137 14F-3 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
148 2S -0.00002 -0.00004 0.00000 0.00000 0.00000
|
|
149 3S -0.00004 -0.00007 0.00000 0.00000 -0.00001
|
|
150 4S -0.00004 0.00002 0.00000 0.00000 0.00000
|
|
151 5S -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
203 2S 0.00002 -0.00004 0.00000 0.00000 0.00000
|
|
204 3S 0.00004 -0.00007 0.00000 0.00000 -0.00001
|
|
205 4S 0.00004 0.00002 0.00000 0.00000 0.00000
|
|
206 5S 0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 142 143 144 145
|
|
141 15G+2 0.00000
|
|
142 15G-2 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 147 148 149 150
|
|
146 15G-4 0.00000
|
|
147 3 H 1S 0.00000 0.00212
|
|
148 2S 0.00000 0.00501 0.01181
|
|
149 3S 0.00001 0.00914 0.02155 0.03935
|
|
150 4S 0.00001 0.00647 0.01512 0.02809 0.02864
|
|
151 5S 0.00000 0.00131 0.00312 0.00574 0.00470
|
|
152 6PX 0.00000 -0.00008 -0.00018 -0.00032 -0.00021
|
|
153 6PY 0.00000 0.00004 0.00010 0.00019 0.00012
|
|
154 6PZ 0.00000 0.00004 0.00008 0.00015 0.00019
|
|
155 7PX 0.00000 -0.00025 -0.00058 -0.00105 -0.00055
|
|
156 7PY 0.00000 0.00014 0.00034 0.00061 0.00032
|
|
157 7PZ 0.00000 0.00011 0.00025 0.00046 0.00060
|
|
158 8PX 0.00000 -0.00068 -0.00159 -0.00289 -0.00195
|
|
159 8PY 0.00000 0.00039 0.00092 0.00167 0.00112
|
|
160 8PZ 0.00000 0.00031 0.00067 0.00129 0.00216
|
|
161 9PX 0.00000 -0.00026 -0.00055 -0.00111 -0.00281
|
|
162 9PY 0.00000 0.00015 0.00032 0.00064 0.00162
|
|
163 9PZ 0.00000 -0.00008 -0.00025 -0.00035 0.00192
|
|
164 10D 0 0.00000 -0.00001 -0.00003 -0.00005 0.00000
|
|
165 10D+1 0.00000 -0.00002 -0.00004 -0.00008 -0.00009
|
|
166 10D-1 0.00000 0.00001 0.00003 0.00005 0.00005
|
|
167 10D+2 0.00000 0.00001 0.00003 0.00006 0.00003
|
|
168 10D-2 0.00000 -0.00002 -0.00005 -0.00010 -0.00006
|
|
169 11D 0 0.00000 -0.00003 -0.00007 -0.00013 -0.00001
|
|
170 11D+1 0.00000 -0.00007 -0.00015 -0.00028 -0.00029
|
|
171 11D-1 0.00000 0.00004 0.00009 0.00016 0.00017
|
|
172 11D+2 0.00000 0.00004 0.00010 0.00018 0.00009
|
|
173 11D-2 0.00000 -0.00007 -0.00018 -0.00032 -0.00016
|
|
174 12D 0 0.00000 -0.00007 -0.00018 -0.00032 -0.00017
|
|
175 12D+1 0.00000 -0.00005 -0.00010 -0.00020 -0.00058
|
|
176 12D-1 0.00000 0.00003 0.00006 0.00012 0.00034
|
|
177 12D+2 0.00000 0.00003 0.00005 0.00011 0.00030
|
|
178 12D-2 0.00000 -0.00005 -0.00009 -0.00019 -0.00052
|
|
179 13F 0 0.00000 -0.00001 -0.00002 -0.00004 -0.00003
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
182 13F+2 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
183 13F-2 0.00000 -0.00001 -0.00002 -0.00004 -0.00004
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00001 0.00003 0.00005 0.00002
|
|
186 14F 0 0.00000 -0.00002 -0.00006 -0.00010 -0.00012
|
|
187 14F+1 0.00000 0.00001 0.00002 0.00004 0.00002
|
|
188 14F-1 0.00000 -0.00001 -0.00001 -0.00002 -0.00001
|
|
189 14F+2 0.00000 0.00002 0.00003 0.00006 0.00008
|
|
190 14F-2 0.00000 -0.00003 -0.00006 -0.00011 -0.00013
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00002 0.00004 0.00008 0.00015
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
194 15G+1 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
195 15G-1 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
200 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
201 15G-4 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
202 4 H 1S 0.00000 -0.00022 -0.00055 -0.00116 -0.00292
|
|
203 2S 0.00000 -0.00055 -0.00137 -0.00285 -0.00713
|
|
204 3S -0.00001 -0.00116 -0.00285 -0.00581 -0.01311
|
|
205 4S -0.00001 -0.00292 -0.00713 -0.01311 -0.00894
|
|
206 5S 0.00000 -0.00053 -0.00126 -0.00236 -0.00269
|
|
207 6PX 0.00000 0.00002 0.00004 0.00006 -0.00003
|
|
208 6PY 0.00000 -0.00002 -0.00005 -0.00009 -0.00013
|
|
209 6PZ 0.00000 -0.00002 -0.00004 -0.00008 -0.00002
|
|
210 7PX 0.00000 0.00008 0.00020 0.00034 -0.00010
|
|
211 7PY 0.00000 -0.00006 -0.00014 -0.00027 -0.00048
|
|
212 7PZ 0.00000 -0.00005 -0.00013 -0.00023 -0.00003
|
|
213 8PX 0.00000 0.00024 0.00054 0.00095 0.00017
|
|
214 8PY 0.00000 -0.00024 -0.00059 -0.00112 -0.00142
|
|
215 8PZ 0.00000 -0.00019 -0.00050 -0.00088 0.00017
|
|
216 9PX 0.00000 -0.00010 -0.00031 -0.00048 0.00136
|
|
217 9PY 0.00000 -0.00055 -0.00133 -0.00242 -0.00117
|
|
218 9PZ 0.00000 -0.00032 -0.00083 -0.00142 0.00094
|
|
219 10D 0 0.00000 0.00000 -0.00001 -0.00002 0.00002
|
|
220 10D+1 0.00000 0.00000 -0.00001 -0.00002 -0.00001
|
|
221 10D-1 0.00000 -0.00001 -0.00002 -0.00004 -0.00003
|
|
222 10D+2 0.00000 0.00001 0.00003 0.00006 0.00003
|
|
223 10D-2 0.00000 -0.00001 -0.00001 -0.00003 -0.00006
|
|
224 11D 0 0.00000 -0.00002 -0.00004 -0.00007 0.00004
|
|
225 11D+1 0.00000 -0.00001 -0.00002 -0.00005 -0.00001
|
|
226 11D-1 0.00000 -0.00001 -0.00003 -0.00005 -0.00002
|
|
227 11D+2 0.00000 0.00004 0.00009 0.00016 0.00008
|
|
228 11D-2 0.00000 -0.00001 -0.00001 -0.00004 -0.00016
|
|
229 12D 0 0.00000 0.00000 -0.00001 -0.00001 0.00011
|
|
230 12D+1 0.00000 -0.00005 -0.00013 -0.00022 0.00020
|
|
231 12D-1 0.00000 -0.00006 -0.00014 -0.00025 0.00000
|
|
232 12D+2 0.00000 0.00008 0.00017 0.00032 0.00049
|
|
233 12D-2 0.00000 -0.00009 -0.00024 -0.00043 -0.00004
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
235 13F+1 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
236 13F-1 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 -0.00001 -0.00002 -0.00002
|
|
239 13F+3 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
241 14F 0 0.00000 0.00001 0.00002 0.00004 0.00001
|
|
242 14F+1 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
243 14F-1 0.00000 0.00001 0.00001 0.00003 0.00004
|
|
244 14F+2 0.00000 0.00000 -0.00001 -0.00002 0.00000
|
|
245 14F-2 0.00000 -0.00001 -0.00002 -0.00004 -0.00001
|
|
246 14F+3 0.00000 0.00001 0.00002 0.00004 0.00004
|
|
247 14F-3 0.00000 -0.00001 -0.00004 -0.00007 0.00002
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 152 153 154 155
|
|
151 5S 0.00100
|
|
152 6PX -0.00004 0.00000
|
|
153 6PY 0.00002 0.00000 0.00000
|
|
154 6PZ 0.00002 0.00000 0.00000 0.00000
|
|
155 7PX -0.00013 0.00001 0.00000 0.00000 0.00004
|
|
156 7PY 0.00007 0.00000 0.00000 0.00000 -0.00002
|
|
157 7PZ 0.00007 0.00000 0.00000 0.00001 -0.00001
|
|
158 8PX -0.00034 0.00003 -0.00001 -0.00001 0.00009
|
|
159 8PY 0.00020 -0.00001 0.00001 0.00001 -0.00004
|
|
160 8PZ 0.00019 -0.00001 0.00001 0.00002 -0.00001
|
|
161 9PX -0.00019 0.00001 0.00000 -0.00003 0.00000
|
|
162 9PY 0.00011 0.00000 0.00001 0.00002 0.00002
|
|
163 9PZ -0.00001 0.00001 0.00000 0.00002 0.00005
|
|
164 10D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 -0.00001 0.00000 0.00000 0.00000 0.00001
|
|
170 11D+1 -0.00004 0.00000 0.00000 0.00000 0.00001
|
|
171 11D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00002 0.00000 0.00000 0.00000 -0.00001
|
|
173 11D-2 -0.00004 0.00000 0.00000 0.00000 0.00001
|
|
174 12D 0 -0.00004 0.00000 0.00000 0.00000 0.00001
|
|
175 12D+1 -0.00003 0.00000 0.00000 -0.00001 0.00000
|
|
176 12D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 -0.00002 0.00000 0.00000 -0.00001 0.00000
|
|
179 13F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00053 -0.00002 -0.00002 -0.00002 -0.00008
|
|
203 2S -0.00126 -0.00004 -0.00005 -0.00004 -0.00020
|
|
204 3S -0.00236 -0.00006 -0.00009 -0.00008 -0.00034
|
|
205 4S -0.00269 0.00003 -0.00013 -0.00002 0.00010
|
|
206 5S -0.00045 0.00001 -0.00003 -0.00002 0.00000
|
|
207 6PX -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
208 6PY -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 -0.00001 0.00000 0.00000 -0.00002
|
|
211 7PY -0.00008 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX -0.00001 -0.00002 0.00000 0.00000 -0.00006
|
|
214 8PY -0.00030 0.00000 0.00000 -0.00001 0.00001
|
|
215 8PZ -0.00019 0.00000 -0.00001 0.00001 0.00002
|
|
216 9PX -0.00010 0.00000 -0.00001 0.00002 0.00002
|
|
217 9PY -0.00044 0.00002 -0.00001 0.00000 0.00007
|
|
218 9PZ -0.00020 0.00001 -0.00001 0.00002 0.00007
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00002 0.00000 0.00000 0.00000 -0.00001
|
|
228 11D-2 -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00001 0.00000 0.00000 0.00000 0.00001
|
|
230 12D+1 -0.00004 0.00000 0.00000 0.00000 0.00001
|
|
231 12D-1 -0.00005 0.00000 0.00000 0.00000 0.00001
|
|
232 12D+2 0.00005 0.00000 0.00000 0.00000 -0.00001
|
|
233 12D-2 -0.00009 0.00000 0.00000 0.00000 0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 157 158 159 160
|
|
156 7PY 0.00002
|
|
157 7PZ 0.00000 0.00002
|
|
158 8PX -0.00004 -0.00004 0.00028
|
|
159 8PY 0.00005 0.00002 -0.00011 0.00015
|
|
160 8PZ 0.00001 0.00006 -0.00013 0.00007 0.00027
|
|
161 9PX 0.00002 -0.00009 0.00015 -0.00002 -0.00041
|
|
162 9PY 0.00002 0.00005 -0.00002 0.00013 0.00023
|
|
163 9PZ -0.00003 0.00008 -0.00001 0.00000 0.00037
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00001 0.00000 -0.00001
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00001 -0.00001 0.00001
|
|
170 11D+1 0.00000 -0.00001 0.00003 -0.00001 -0.00003
|
|
171 11D-1 0.00000 0.00000 -0.00001 0.00001 0.00002
|
|
172 11D+2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
173 11D-2 -0.00001 0.00000 0.00002 -0.00002 0.00000
|
|
174 12D 0 -0.00001 0.00000 0.00002 -0.00001 0.00000
|
|
175 12D+1 0.00000 -0.00002 0.00003 -0.00001 -0.00009
|
|
176 12D-1 0.00000 0.00001 -0.00001 0.00001 0.00005
|
|
177 12D+2 -0.00001 0.00001 -0.00003 -0.00001 0.00005
|
|
178 12D-2 0.00000 -0.00002 0.00002 -0.00003 -0.00008
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00001 -0.00001 -0.00001
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
190 14F-2 0.00000 0.00000 0.00001 -0.00001 -0.00001
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 -0.00001 0.00000 0.00002
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00006 -0.00005 -0.00024 -0.00024 -0.00019
|
|
203 2S -0.00014 -0.00013 -0.00054 -0.00059 -0.00050
|
|
204 3S -0.00027 -0.00023 -0.00095 -0.00112 -0.00088
|
|
205 4S -0.00048 -0.00003 -0.00017 -0.00142 0.00017
|
|
206 5S -0.00008 -0.00005 0.00001 -0.00030 -0.00019
|
|
207 6PX 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
209 6PZ 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
210 7PX 0.00000 0.00000 -0.00006 -0.00001 -0.00002
|
|
211 7PY 0.00000 -0.00001 0.00000 -0.00001 -0.00003
|
|
212 7PZ -0.00001 0.00001 -0.00001 -0.00002 0.00003
|
|
213 8PX 0.00000 0.00001 -0.00020 -0.00001 0.00003
|
|
214 8PY -0.00001 -0.00002 0.00001 -0.00002 -0.00006
|
|
215 8PZ -0.00003 0.00003 -0.00003 -0.00006 0.00017
|
|
216 9PX -0.00005 0.00007 -0.00008 -0.00008 0.00033
|
|
217 9PY -0.00004 0.00001 0.00011 -0.00006 0.00009
|
|
218 9PZ -0.00005 0.00006 0.00004 -0.00006 0.00032
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
225 11D+1 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
226 11D-1 0.00000 0.00000 -0.00001 0.00000 0.00001
|
|
227 11D+2 0.00000 0.00000 -0.00002 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 -0.00001 0.00000 -0.00001
|
|
229 12D 0 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
230 12D+1 -0.00001 0.00001 -0.00001 -0.00001 0.00007
|
|
231 12D-1 -0.00001 0.00001 0.00000 -0.00001 0.00003
|
|
232 12D+2 0.00000 0.00001 -0.00004 0.00000 0.00006
|
|
233 12D-2 -0.00001 0.00001 0.00001 -0.00001 0.00005
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 162 163 164 165
|
|
161 9PX 0.00066
|
|
162 9PY -0.00029 0.00032
|
|
163 9PZ -0.00060 0.00035 0.00065
|
|
164 10D 0 -0.00001 0.00000 0.00001 0.00000
|
|
165 10D+1 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 -0.00002 0.00001 0.00002 0.00000 0.00000
|
|
170 11D+1 0.00004 -0.00002 -0.00003 0.00000 0.00000
|
|
171 11D-1 -0.00002 0.00001 0.00002 0.00000 0.00000
|
|
172 11D+2 0.00000 -0.00001 -0.00001 0.00000 0.00000
|
|
173 11D-2 -0.00001 0.00000 0.00002 0.00000 0.00000
|
|
174 12D 0 -0.00001 0.00000 0.00002 0.00000 0.00000
|
|
175 12D+1 0.00014 -0.00008 -0.00014 0.00000 0.00000
|
|
176 12D-1 -0.00008 0.00005 0.00008 0.00000 0.00000
|
|
177 12D+2 -0.00009 0.00001 0.00007 0.00000 0.00000
|
|
178 12D-2 0.00012 -0.00009 -0.00013 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00002 -0.00001 -0.00001 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 -0.00001 0.00001 0.00001 0.00000 0.00000
|
|
190 14F-2 0.00002 -0.00001 -0.00002 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00003 0.00002 0.00003 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00010 -0.00055 -0.00032 0.00000 0.00000
|
|
203 2S 0.00031 -0.00133 -0.00083 -0.00001 0.00001
|
|
204 3S 0.00048 -0.00242 -0.00142 -0.00002 0.00002
|
|
205 4S -0.00136 -0.00117 0.00094 0.00002 0.00001
|
|
206 5S 0.00010 -0.00044 -0.00020 0.00000 0.00001
|
|
207 6PX 0.00000 -0.00002 -0.00001 0.00000 0.00000
|
|
208 6PY 0.00001 -0.00001 -0.00001 0.00000 0.00000
|
|
209 6PZ -0.00002 0.00000 0.00002 0.00000 0.00000
|
|
210 7PX 0.00002 -0.00007 -0.00007 0.00000 0.00000
|
|
211 7PY 0.00005 -0.00004 -0.00005 0.00000 0.00000
|
|
212 7PZ -0.00007 0.00001 0.00006 0.00000 0.00000
|
|
213 8PX -0.00008 -0.00011 -0.00004 0.00000 0.00000
|
|
214 8PY 0.00008 -0.00006 -0.00006 0.00000 0.00000
|
|
215 8PZ -0.00033 0.00009 0.00032 0.00001 0.00000
|
|
216 9PX -0.00060 0.00018 0.00057 0.00001 -0.00001
|
|
217 9PY -0.00018 0.00011 0.00028 0.00001 0.00000
|
|
218 9PZ -0.00057 0.00028 0.00062 0.00001 0.00000
|
|
219 10D 0 -0.00001 0.00001 0.00001 0.00000 0.00000
|
|
220 10D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00001 -0.00001 -0.00001 0.00000 0.00000
|
|
224 11D 0 -0.00002 0.00001 0.00002 0.00000 0.00000
|
|
225 11D+1 -0.00003 0.00000 0.00002 0.00000 0.00000
|
|
226 11D-1 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
227 11D+2 0.00000 -0.00001 -0.00001 0.00000 0.00000
|
|
228 11D-2 0.00002 -0.00002 -0.00002 0.00000 0.00000
|
|
229 12D 0 -0.00002 0.00002 0.00003 0.00000 0.00000
|
|
230 12D+1 -0.00012 0.00005 0.00013 0.00000 0.00000
|
|
231 12D-1 -0.00006 0.00003 0.00007 0.00000 0.00000
|
|
232 12D+2 -0.00010 0.00003 0.00008 0.00000 0.00000
|
|
233 12D-2 -0.00010 0.00005 0.00011 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
241 14F 0 0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
245 14F-2 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00002 0.00001 0.00002 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 167 168 169 170
|
|
166 10D-1 0.00000
|
|
167 10D+2 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00001 0.00001 0.00001 -0.00002 0.00001
|
|
203 2S -0.00002 0.00003 0.00001 -0.00004 0.00002
|
|
204 3S -0.00004 0.00006 0.00003 -0.00007 0.00005
|
|
205 4S -0.00003 0.00003 0.00006 0.00004 0.00001
|
|
206 5S -0.00001 0.00001 0.00001 0.00000 0.00002
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00001 0.00000 -0.00001 -0.00001
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
216 9PX 0.00000 0.00000 0.00001 0.00002 -0.00003
|
|
217 9PY 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00001 0.00002 -0.00002
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 172 173 174 175
|
|
171 11D-1 0.00000
|
|
172 11D+2 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00003
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00003
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00001 0.00004 0.00001 0.00000 0.00005
|
|
203 2S -0.00003 0.00009 0.00001 -0.00001 0.00013
|
|
204 3S -0.00005 0.00016 0.00004 -0.00001 0.00022
|
|
205 4S -0.00002 0.00008 0.00016 0.00011 -0.00020
|
|
206 5S -0.00002 0.00002 0.00002 0.00001 0.00004
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00001 0.00000 -0.00001 0.00001
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
213 8PX 0.00001 0.00002 -0.00001 -0.00001 -0.00001
|
|
214 8PY 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
215 8PZ 0.00001 0.00000 0.00001 0.00001 -0.00007
|
|
216 9PX 0.00001 0.00000 0.00002 0.00002 -0.00012
|
|
217 9PY 0.00000 -0.00001 0.00002 0.00002 -0.00005
|
|
218 9PZ 0.00001 -0.00001 0.00002 0.00003 -0.00013
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 -0.00003
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00001 -0.00002
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 177 178 179 180
|
|
176 12D-1 0.00001
|
|
177 12D+2 0.00001 0.00002
|
|
178 12D-2 -0.00002 -0.00001 0.00003
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00006 0.00008 0.00009 0.00000 0.00000
|
|
203 2S -0.00014 0.00017 0.00024 0.00000 0.00001
|
|
204 3S -0.00025 0.00032 0.00043 0.00001 0.00001
|
|
205 4S 0.00000 0.00049 0.00004 0.00001 -0.00001
|
|
206 5S -0.00005 0.00005 0.00009 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX -0.00001 0.00001 0.00001 0.00000 0.00000
|
|
211 7PY -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
212 7PZ 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
213 8PX 0.00000 0.00004 0.00001 0.00000 0.00000
|
|
214 8PY -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
215 8PZ 0.00003 0.00006 -0.00005 0.00000 0.00000
|
|
216 9PX 0.00006 0.00010 -0.00010 0.00000 0.00000
|
|
217 9PY 0.00003 0.00003 -0.00005 0.00000 0.00000
|
|
218 9PZ 0.00007 0.00008 -0.00011 0.00000 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
230 12D+1 0.00001 0.00002 -0.00002 0.00000 0.00000
|
|
231 12D-1 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
232 12D+2 0.00001 0.00002 -0.00001 0.00000 0.00000
|
|
233 12D-2 0.00001 0.00001 -0.00002 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 182 183 184 185
|
|
181 13F-1 0.00000
|
|
182 13F+2 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
203 2S 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
204 3S -0.00001 0.00000 0.00002 -0.00002 0.00000
|
|
205 4S 0.00001 0.00000 0.00002 -0.00002 -0.00002
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 187 188 189 190
|
|
186 14F 0 0.00000
|
|
187 14F+1 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 0.00000 0.00001 0.00000 0.00001
|
|
203 2S 0.00002 0.00000 0.00001 -0.00001 0.00002
|
|
204 3S 0.00004 0.00001 0.00003 -0.00002 0.00004
|
|
205 4S 0.00001 -0.00001 0.00004 0.00000 0.00001
|
|
206 5S 0.00001 0.00000 0.00001 -0.00001 0.00001
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
216 9PX -0.00001 0.00000 0.00000 0.00001 -0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ -0.00001 -0.00001 0.00000 0.00001 -0.00001
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 192 193 194 195
|
|
191 14F+3 0.00000
|
|
192 14F-3 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
203 2S -0.00002 -0.00004 0.00000 0.00000 0.00000
|
|
204 3S -0.00004 -0.00007 0.00000 0.00000 0.00001
|
|
205 4S -0.00004 0.00002 0.00000 0.00000 0.00000
|
|
206 5S -0.00001 -0.00001 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 197 198 199 200
|
|
196 15G+2 0.00000
|
|
197 15G-2 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 202 203 204 205
|
|
201 15G-4 0.00000
|
|
202 4 H 1S 0.00000 0.00212
|
|
203 2S 0.00000 0.00501 0.01181
|
|
204 3S 0.00000 0.00914 0.02155 0.03935
|
|
205 4S 0.00000 0.00647 0.01512 0.02809 0.02864
|
|
206 5S 0.00000 0.00131 0.00312 0.00574 0.00470
|
|
207 6PX 0.00000 0.00008 0.00018 0.00032 0.00021
|
|
208 6PY 0.00000 0.00004 0.00010 0.00019 0.00012
|
|
209 6PZ 0.00000 0.00004 0.00008 0.00015 0.00019
|
|
210 7PX 0.00000 0.00025 0.00058 0.00105 0.00055
|
|
211 7PY 0.00000 0.00014 0.00034 0.00061 0.00032
|
|
212 7PZ 0.00000 0.00011 0.00025 0.00046 0.00060
|
|
213 8PX 0.00000 0.00068 0.00159 0.00289 0.00195
|
|
214 8PY 0.00000 0.00039 0.00092 0.00167 0.00112
|
|
215 8PZ 0.00000 0.00031 0.00067 0.00129 0.00216
|
|
216 9PX 0.00000 0.00026 0.00055 0.00111 0.00281
|
|
217 9PY 0.00000 0.00015 0.00032 0.00064 0.00162
|
|
218 9PZ 0.00000 -0.00008 -0.00025 -0.00035 0.00192
|
|
219 10D 0 0.00000 -0.00001 -0.00003 -0.00005 0.00000
|
|
220 10D+1 0.00000 0.00002 0.00004 0.00008 0.00009
|
|
221 10D-1 0.00000 0.00001 0.00003 0.00005 0.00005
|
|
222 10D+2 0.00000 0.00001 0.00003 0.00006 0.00003
|
|
223 10D-2 0.00000 0.00002 0.00005 0.00010 0.00006
|
|
224 11D 0 0.00000 -0.00003 -0.00007 -0.00013 -0.00001
|
|
225 11D+1 0.00000 0.00007 0.00015 0.00028 0.00029
|
|
226 11D-1 0.00000 0.00004 0.00009 0.00016 0.00017
|
|
227 11D+2 0.00000 0.00004 0.00010 0.00018 0.00009
|
|
228 11D-2 0.00000 0.00007 0.00018 0.00032 0.00016
|
|
229 12D 0 0.00000 -0.00007 -0.00018 -0.00032 -0.00017
|
|
230 12D+1 0.00000 0.00005 0.00010 0.00020 0.00058
|
|
231 12D-1 0.00000 0.00003 0.00006 0.00012 0.00034
|
|
232 12D+2 0.00000 0.00003 0.00005 0.00011 0.00030
|
|
233 12D-2 0.00000 0.00005 0.00009 0.00019 0.00052
|
|
234 13F 0 0.00000 -0.00001 -0.00002 -0.00004 -0.00003
|
|
235 13F+1 0.00000 0.00000 0.00000 -0.00001 0.00001
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
237 13F+2 0.00000 0.00001 0.00001 0.00002 0.00002
|
|
238 13F-2 0.00000 0.00001 0.00002 0.00004 0.00004
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00001 0.00003 0.00005 0.00002
|
|
241 14F 0 0.00000 -0.00002 -0.00006 -0.00010 -0.00012
|
|
242 14F+1 0.00000 -0.00001 -0.00002 -0.00004 -0.00002
|
|
243 14F-1 0.00000 -0.00001 -0.00001 -0.00002 -0.00001
|
|
244 14F+2 0.00000 0.00002 0.00003 0.00006 0.00008
|
|
245 14F-2 0.00000 0.00003 0.00006 0.00011 0.00013
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00002 0.00004 0.00008 0.00015
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
249 15G+1 0.00000 0.00000 -0.00001 -0.00002 -0.00002
|
|
250 15G-1 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00001 0.00002 0.00002
|
|
255 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
256 15G-4 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
206 207 208 209 210
|
|
206 5S 0.00100
|
|
207 6PX 0.00004 0.00000
|
|
208 6PY 0.00002 0.00000 0.00000
|
|
209 6PZ 0.00002 0.00000 0.00000 0.00000
|
|
210 7PX 0.00013 0.00001 0.00000 0.00000 0.00004
|
|
211 7PY 0.00007 0.00000 0.00000 0.00000 0.00002
|
|
212 7PZ 0.00007 0.00000 0.00000 0.00001 0.00001
|
|
213 8PX 0.00034 0.00003 0.00001 0.00001 0.00009
|
|
214 8PY 0.00020 0.00001 0.00001 0.00001 0.00004
|
|
215 8PZ 0.00019 0.00001 0.00001 0.00002 0.00001
|
|
216 9PX 0.00019 0.00001 0.00000 0.00003 0.00000
|
|
217 9PY 0.00011 0.00000 0.00001 0.00002 -0.00002
|
|
218 9PZ -0.00001 -0.00001 0.00000 0.00002 -0.00005
|
|
219 10D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 -0.00001 0.00000 0.00000 0.00000 -0.00001
|
|
225 11D+1 0.00004 0.00000 0.00000 0.00000 0.00001
|
|
226 11D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00002 0.00000 0.00000 0.00000 0.00001
|
|
228 11D-2 0.00004 0.00000 0.00000 0.00000 0.00001
|
|
229 12D 0 -0.00004 0.00000 0.00000 0.00000 -0.00001
|
|
230 12D+1 0.00003 0.00000 0.00000 0.00001 0.00000
|
|
231 12D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00002 0.00000 0.00000 0.00001 0.00000
|
|
234 13F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 212 213 214 215
|
|
211 7PY 0.00002
|
|
212 7PZ 0.00000 0.00002
|
|
213 8PX 0.00004 0.00004 0.00028
|
|
214 8PY 0.00005 0.00002 0.00011 0.00015
|
|
215 8PZ 0.00001 0.00006 0.00013 0.00007 0.00027
|
|
216 9PX -0.00002 0.00009 0.00015 0.00002 0.00041
|
|
217 9PY 0.00002 0.00005 0.00002 0.00013 0.00023
|
|
218 9PZ -0.00003 0.00008 0.00001 0.00000 0.00037
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
224 11D 0 0.00000 0.00000 -0.00001 -0.00001 0.00001
|
|
225 11D+1 0.00000 0.00001 0.00003 0.00001 0.00003
|
|
226 11D-1 0.00000 0.00000 0.00001 0.00001 0.00002
|
|
227 11D+2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
228 11D-2 0.00001 0.00000 0.00002 0.00002 0.00000
|
|
229 12D 0 -0.00001 0.00000 -0.00002 -0.00001 0.00000
|
|
230 12D+1 0.00000 0.00002 0.00003 0.00001 0.00009
|
|
231 12D-1 0.00000 0.00001 0.00001 0.00001 0.00005
|
|
232 12D+2 -0.00001 0.00001 0.00003 -0.00001 0.00005
|
|
233 12D-2 0.00000 0.00002 0.00002 0.00003 0.00008
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 -0.00001 -0.00001 -0.00001
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
245 14F-2 0.00000 0.00000 0.00001 0.00001 0.00001
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00001 0.00000 0.00002
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 217 218 219 220
|
|
216 9PX 0.00066
|
|
217 9PY 0.00029 0.00032
|
|
218 9PZ 0.00060 0.00035 0.00065
|
|
219 10D 0 0.00001 0.00000 0.00001 0.00000
|
|
220 10D+1 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00002 0.00001 0.00002 0.00000 0.00000
|
|
225 11D+1 0.00004 0.00002 0.00003 0.00000 0.00000
|
|
226 11D-1 0.00002 0.00001 0.00002 0.00000 0.00000
|
|
227 11D+2 0.00000 -0.00001 -0.00001 0.00000 0.00000
|
|
228 11D-2 -0.00001 0.00000 -0.00002 0.00000 0.00000
|
|
229 12D 0 0.00001 0.00000 0.00002 0.00000 0.00000
|
|
230 12D+1 0.00014 0.00008 0.00014 0.00000 0.00000
|
|
231 12D-1 0.00008 0.00005 0.00008 0.00000 0.00000
|
|
232 12D+2 0.00009 0.00001 0.00007 0.00000 0.00000
|
|
233 12D-2 0.00012 0.00009 0.00013 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 -0.00002 -0.00001 -0.00001 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00001 0.00001 0.00001 0.00000 0.00000
|
|
245 14F-2 0.00002 0.00001 0.00002 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00003 0.00002 0.00003 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 222 223 224 225
|
|
221 10D-1 0.00000
|
|
222 10D+2 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 227 228 229 230
|
|
226 11D-1 0.00000
|
|
227 11D+2 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00003
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00003
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 232 233 234 235
|
|
231 12D-1 0.00001
|
|
232 12D+2 0.00001 0.00002
|
|
233 12D-2 0.00002 0.00001 0.00003
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 237 238 239 240
|
|
236 13F-1 0.00000
|
|
237 13F+2 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 242 243 244 245
|
|
241 14F 0 0.00000
|
|
242 14F+1 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 247 248 249 250
|
|
246 14F+3 0.00000
|
|
247 14F-3 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 252 253 254 255
|
|
251 15G+2 0.00000
|
|
252 15G-2 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256
|
|
256 15G-4 0.00000
|
|
Full Mulliken population analysis:
|
|
1 2 3 4 5
|
|
1 1 N 1S 0.66918
|
|
2 2S 0.43831 0.43543
|
|
3 3S 0.04012 0.05182 0.01028
|
|
4 4S -0.01877 -0.06307 -0.00391 0.18705
|
|
5 5S -0.01272 -0.04697 -0.00333 0.21306 0.32925
|
|
6 6S -0.00164 -0.00622 -0.00065 0.03555 0.07364
|
|
7 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
8 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
10 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
11 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
14 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
17 10PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
20 11PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00044 0.00162
|
|
93 2S -0.00004 -0.00020 -0.00004 0.00317 0.00847
|
|
94 3S -0.00053 -0.00195 -0.00027 0.01207 0.02649
|
|
95 4S -0.00052 -0.00193 -0.00010 0.01111 0.02211
|
|
96 5S 0.00000 0.00002 -0.00001 -0.00012 -0.00013
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00003 0.00005
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 -0.00003 -0.00001 0.00032 0.00048
|
|
102 7PZ 0.00000 -0.00001 0.00000 0.00010 0.00013
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY -0.00019 -0.00068 -0.00007 0.00314 0.00424
|
|
105 8PZ -0.00005 -0.00020 0.00000 0.00100 0.00121
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY -0.00026 -0.00095 -0.00002 0.00441 0.00611
|
|
108 9PZ -0.00007 -0.00025 0.00001 0.00121 0.00156
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 -0.00001 -0.00004 0.00000 0.00017 0.00012
|
|
117 11D+2 -0.00001 -0.00003 0.00000 0.00011 0.00009
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 -0.00001 -0.00002 0.00000 0.00004 0.00004
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 -0.00005 -0.00019 0.00000 0.00065 0.00052
|
|
122 12D+2 -0.00007 -0.00027 -0.00001 0.00085 0.00069
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 -0.00002 0.00000 0.00004 0.00002
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 -0.00001 -0.00003 0.00000 0.00008 0.00003
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 -0.00001 -0.00003 0.00000 0.00007 0.00003
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00044 0.00162
|
|
148 2S -0.00004 -0.00020 -0.00004 0.00317 0.00847
|
|
149 3S -0.00053 -0.00195 -0.00027 0.01207 0.02649
|
|
150 4S -0.00052 -0.00193 -0.00010 0.01111 0.02211
|
|
151 5S 0.00000 0.00002 -0.00001 -0.00012 -0.00013
|
|
152 6PX 0.00000 0.00000 0.00000 0.00002 0.00004
|
|
153 6PY 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
155 7PX 0.00000 -0.00002 0.00000 0.00024 0.00036
|
|
156 7PY 0.00000 -0.00001 0.00000 0.00008 0.00012
|
|
157 7PZ 0.00000 -0.00001 0.00000 0.00010 0.00013
|
|
158 8PX -0.00014 -0.00051 -0.00005 0.00235 0.00318
|
|
159 8PY -0.00005 -0.00017 -0.00002 0.00078 0.00106
|
|
160 8PZ -0.00005 -0.00020 0.00000 0.00100 0.00121
|
|
161 9PX -0.00020 -0.00071 -0.00001 0.00330 0.00458
|
|
162 9PY -0.00007 -0.00024 0.00000 0.00110 0.00153
|
|
163 9PZ -0.00007 -0.00025 0.00001 0.00121 0.00156
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
170 11D+1 -0.00001 -0.00003 0.00000 0.00013 0.00009
|
|
171 11D-1 0.00000 -0.00001 0.00000 0.00004 0.00003
|
|
172 11D+2 0.00000 -0.00001 0.00000 0.00003 0.00002
|
|
173 11D-2 -0.00001 -0.00002 0.00000 0.00009 0.00007
|
|
174 12D 0 -0.00001 -0.00002 0.00000 0.00004 0.00004
|
|
175 12D+1 -0.00004 -0.00014 0.00000 0.00049 0.00039
|
|
176 12D-1 -0.00001 -0.00005 0.00000 0.00016 0.00013
|
|
177 12D+2 -0.00002 -0.00007 0.00000 0.00021 0.00017
|
|
178 12D-2 -0.00006 -0.00020 0.00000 0.00064 0.00052
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 -0.00002 0.00000 0.00004 0.00002
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 -0.00001 0.00000 0.00002 0.00001
|
|
190 14F-2 0.00000 -0.00002 0.00000 0.00006 0.00002
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 -0.00003 0.00000 0.00007 0.00003
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00044 0.00162
|
|
203 2S -0.00004 -0.00020 -0.00004 0.00317 0.00847
|
|
204 3S -0.00053 -0.00195 -0.00027 0.01207 0.02649
|
|
205 4S -0.00052 -0.00193 -0.00010 0.01111 0.02211
|
|
206 5S 0.00000 0.00002 -0.00001 -0.00012 -0.00013
|
|
207 6PX 0.00000 0.00000 0.00000 0.00002 0.00004
|
|
208 6PY 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
210 7PX 0.00000 -0.00002 0.00000 0.00024 0.00036
|
|
211 7PY 0.00000 -0.00001 0.00000 0.00008 0.00012
|
|
212 7PZ 0.00000 -0.00001 0.00000 0.00010 0.00013
|
|
213 8PX -0.00014 -0.00051 -0.00005 0.00235 0.00318
|
|
214 8PY -0.00005 -0.00017 -0.00002 0.00078 0.00106
|
|
215 8PZ -0.00005 -0.00020 0.00000 0.00100 0.00121
|
|
216 9PX -0.00020 -0.00071 -0.00001 0.00330 0.00458
|
|
217 9PY -0.00007 -0.00024 0.00000 0.00110 0.00153
|
|
218 9PZ -0.00007 -0.00025 0.00001 0.00121 0.00156
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
225 11D+1 -0.00001 -0.00003 0.00000 0.00013 0.00009
|
|
226 11D-1 0.00000 -0.00001 0.00000 0.00004 0.00003
|
|
227 11D+2 0.00000 -0.00001 0.00000 0.00003 0.00002
|
|
228 11D-2 -0.00001 -0.00002 0.00000 0.00009 0.00007
|
|
229 12D 0 -0.00001 -0.00002 0.00000 0.00004 0.00004
|
|
230 12D+1 -0.00004 -0.00014 0.00000 0.00049 0.00039
|
|
231 12D-1 -0.00001 -0.00005 0.00000 0.00016 0.00013
|
|
232 12D+2 -0.00002 -0.00007 0.00000 0.00021 0.00017
|
|
233 12D-2 -0.00006 -0.00020 0.00000 0.00064 0.00052
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 -0.00002 0.00000 0.00004 0.00002
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 -0.00001 0.00000 0.00002 0.00001
|
|
245 14F-2 0.00000 -0.00002 0.00000 0.00006 0.00002
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 -0.00003 0.00000 0.00007 0.00003
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
6 7 8 9 10
|
|
6 6S 0.03145
|
|
7 7PX 0.00000 0.01820
|
|
8 7PY 0.00000 0.00000 0.01820
|
|
9 7PZ 0.00000 0.00000 0.00000 0.02576
|
|
10 8PX 0.00000 0.02190 0.00000 0.00000 0.05365
|
|
11 8PY 0.00000 0.00000 0.02190 0.00000 0.00000
|
|
12 8PZ 0.00000 0.00000 0.00000 0.03151 0.00000
|
|
13 9PX 0.00000 0.01710 0.00000 0.00000 0.06537
|
|
14 9PY 0.00000 0.00000 0.01710 0.00000 0.00000
|
|
15 9PZ 0.00000 0.00000 0.00000 0.02448 0.00000
|
|
16 10PX 0.00000 0.00542 0.00000 0.00000 0.02710
|
|
17 10PY 0.00000 0.00000 0.00542 0.00000 0.00000
|
|
18 10PZ 0.00000 0.00000 0.00000 0.01017 0.00000
|
|
19 11PX 0.00000 0.00049 0.00000 0.00000 0.00282
|
|
20 11PY 0.00000 0.00000 0.00049 0.00000 0.00000
|
|
21 11PZ 0.00000 0.00000 0.00000 0.00250 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00071 0.00000 0.00001 0.00000 0.00000
|
|
93 2S 0.00388 0.00000 0.00057 0.00010 0.00000
|
|
94 3S 0.01230 0.00000 0.00216 0.00036 0.00000
|
|
95 4S 0.00334 0.00000 0.00109 -0.00016 0.00000
|
|
96 5S 0.00052 0.00000 0.00007 0.00001 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00004
|
|
101 7PY 0.00011 0.00000 0.00004 0.00002 0.00000
|
|
102 7PZ 0.00001 0.00000 0.00001 0.00000 0.00000
|
|
103 8PX 0.00000 0.00008 0.00000 0.00000 0.00045
|
|
104 8PY 0.00078 0.00000 0.00025 0.00006 0.00000
|
|
105 8PZ 0.00003 0.00000 0.00011 0.00004 0.00000
|
|
106 9PX 0.00000 0.00013 0.00000 0.00000 0.00071
|
|
107 9PY -0.00018 0.00000 0.00005 -0.00019 0.00000
|
|
108 9PZ -0.00030 0.00000 0.00003 0.00023 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00001 0.00000 0.00003 0.00000 0.00000
|
|
117 11D+2 0.00001 0.00000 0.00002 0.00002 0.00000
|
|
118 11D-2 0.00000 0.00001 0.00000 0.00000 0.00006
|
|
119 12D 0 0.00001 0.00000 0.00000 0.00002 0.00000
|
|
120 12D+1 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
121 12D-1 0.00000 0.00000 0.00004 0.00007 0.00000
|
|
122 12D+2 0.00001 0.00000 0.00001 -0.00008 0.00000
|
|
123 12D-2 0.00000 0.00007 0.00000 0.00000 0.00034
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
137 14F-3 0.00000 0.00000 0.00001 -0.00002 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00071 0.00001 0.00000 0.00000 0.00036
|
|
148 2S 0.00388 0.00043 0.00014 0.00010 0.00330
|
|
149 3S 0.01230 0.00162 0.00054 0.00036 0.00872
|
|
150 4S 0.00334 0.00082 0.00027 -0.00016 0.00459
|
|
151 5S 0.00052 0.00005 0.00002 0.00001 0.00030
|
|
152 6PX 0.00001 0.00000 0.00000 0.00000 0.00001
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
155 7PX 0.00008 0.00002 0.00001 0.00002 0.00011
|
|
156 7PY 0.00003 0.00001 0.00000 0.00001 0.00010
|
|
157 7PZ 0.00001 0.00001 0.00000 0.00000 0.00007
|
|
158 8PX 0.00058 0.00009 0.00012 0.00004 0.00035
|
|
159 8PY 0.00019 0.00012 0.00000 0.00001 0.00054
|
|
160 8PZ 0.00003 0.00008 0.00003 0.00004 0.00036
|
|
161 9PX -0.00014 0.00000 0.00007 -0.00014 0.00000
|
|
162 9PY -0.00005 0.00007 0.00004 -0.00005 0.00034
|
|
163 9PZ -0.00030 0.00002 0.00001 0.00023 0.00010
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
170 11D+1 0.00000 0.00002 0.00001 0.00000 0.00006
|
|
171 11D-1 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
172 11D+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
173 11D-2 0.00001 0.00002 0.00000 0.00001 0.00007
|
|
174 12D 0 0.00001 0.00000 0.00000 0.00002 -0.00001
|
|
175 12D+1 0.00000 0.00001 0.00001 0.00005 0.00005
|
|
176 12D-1 0.00000 0.00001 0.00000 0.00002 0.00005
|
|
177 12D+2 0.00000 0.00000 0.00005 -0.00002 0.00003
|
|
178 12D-2 0.00001 0.00002 0.00000 -0.00006 0.00008
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
191 14F+3 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
192 14F-3 0.00000 0.00001 0.00000 -0.00002 0.00001
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00071 0.00001 0.00000 0.00000 0.00036
|
|
203 2S 0.00388 0.00043 0.00014 0.00010 0.00330
|
|
204 3S 0.01230 0.00162 0.00054 0.00036 0.00872
|
|
205 4S 0.00334 0.00082 0.00027 -0.00016 0.00459
|
|
206 5S 0.00052 0.00005 0.00002 0.00001 0.00030
|
|
207 6PX 0.00001 0.00000 0.00000 0.00000 0.00001
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
210 7PX 0.00008 0.00002 0.00001 0.00002 0.00011
|
|
211 7PY 0.00003 0.00001 0.00000 0.00001 0.00010
|
|
212 7PZ 0.00001 0.00001 0.00000 0.00000 0.00007
|
|
213 8PX 0.00058 0.00009 0.00012 0.00004 0.00035
|
|
214 8PY 0.00019 0.00012 0.00000 0.00001 0.00054
|
|
215 8PZ 0.00003 0.00008 0.00003 0.00004 0.00036
|
|
216 9PX -0.00014 0.00000 0.00007 -0.00014 0.00000
|
|
217 9PY -0.00005 0.00007 0.00004 -0.00005 0.00034
|
|
218 9PZ -0.00030 0.00002 0.00001 0.00023 0.00010
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
225 11D+1 0.00000 0.00002 0.00001 0.00000 0.00006
|
|
226 11D-1 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
227 11D+2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
228 11D-2 0.00001 0.00002 0.00000 0.00001 0.00007
|
|
229 12D 0 0.00001 0.00000 0.00000 0.00002 -0.00001
|
|
230 12D+1 0.00000 0.00001 0.00001 0.00005 0.00005
|
|
231 12D-1 0.00000 0.00001 0.00000 0.00002 0.00005
|
|
232 12D+2 0.00000 0.00000 0.00005 -0.00002 0.00003
|
|
233 12D-2 0.00001 0.00002 0.00000 -0.00006 0.00008
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00001 0.00000 0.00000 0.00003
|
|
246 14F+3 0.00000 0.00000 0.00001 0.00000 0.00001
|
|
247 14F-3 0.00000 0.00001 0.00000 -0.00002 0.00001
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
11 12 13 14 15
|
|
11 8PY 0.05365
|
|
12 8PZ 0.00000 0.07850
|
|
13 9PX 0.00000 0.00000 0.12835
|
|
14 9PY 0.06537 0.00000 0.00000 0.12835
|
|
15 9PZ 0.00000 0.09516 0.00000 0.00000 0.18587
|
|
16 10PX 0.00000 0.00000 0.07945 0.00000 0.00000
|
|
17 10PY 0.02710 0.00000 0.00000 0.07945 0.00000
|
|
18 10PZ 0.00000 0.05170 0.00000 0.00000 0.15069
|
|
19 11PX 0.00000 0.00000 0.01067 0.00000 0.00000
|
|
20 11PY 0.00282 0.00000 0.00000 0.01067 0.00000
|
|
21 11PZ 0.00000 0.01457 0.00000 0.00000 0.05473
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00048 0.00008 0.00000 0.00329 0.00057
|
|
93 2S 0.00440 0.00081 0.00000 0.01669 0.00310
|
|
94 3S 0.01163 0.00196 0.00000 0.03744 0.00638
|
|
95 4S 0.00612 -0.00089 0.00000 0.02203 -0.00317
|
|
96 5S 0.00040 0.00004 0.00000 0.00165 0.00015
|
|
97 6PX 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
98 6PY 0.00003 0.00001 0.00000 0.00008 0.00003
|
|
99 6PZ 0.00001 0.00000 0.00000 0.00003 0.00001
|
|
100 7PX 0.00000 0.00000 0.00018 0.00000 0.00000
|
|
101 7PY 0.00026 0.00015 0.00000 0.00053 0.00038
|
|
102 7PZ 0.00009 0.00000 0.00000 0.00022 0.00009
|
|
103 8PX 0.00000 0.00000 0.00146 0.00000 0.00000
|
|
104 8PY 0.00104 0.00027 0.00000 0.00185 0.00065
|
|
105 8PZ 0.00048 0.00033 0.00000 0.00111 0.00142
|
|
106 9PX 0.00000 0.00000 0.00243 0.00000 0.00000
|
|
107 9PY 0.00021 -0.00098 0.00000 0.00025 -0.00279
|
|
108 9PZ 0.00013 0.00129 0.00000 0.00039 0.00463
|
|
109 10D 0 0.00000 0.00001 0.00000 0.00000 0.00002
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00002 0.00000 0.00000 0.00002 0.00000
|
|
112 10D+2 0.00001 0.00001 0.00000 0.00001 0.00001
|
|
113 10D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00006 0.00000 0.00000 0.00011
|
|
115 11D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
116 11D-1 0.00012 0.00001 0.00000 0.00013 0.00007
|
|
117 11D+2 0.00008 0.00007 0.00000 0.00005 0.00010
|
|
118 11D-2 0.00000 0.00000 0.00014 0.00000 0.00000
|
|
119 12D 0 -0.00002 0.00009 0.00000 -0.00008 0.00020
|
|
120 12D+1 0.00000 0.00000 0.00007 0.00000 0.00000
|
|
121 12D-1 0.00013 0.00039 0.00000 0.00017 0.00112
|
|
122 12D+2 0.00003 -0.00032 0.00000 -0.00005 -0.00057
|
|
123 12D-2 0.00000 0.00000 0.00081 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
127 13F+2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00002 0.00000 0.00000 0.00000 0.00001
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 -0.00001 0.00003 0.00000 -0.00001 0.00004
|
|
134 14F+2 0.00004 0.00002 0.00000 0.00001 0.00005
|
|
135 14F-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00004 0.00000 0.00000
|
|
137 14F-3 0.00001 -0.00006 0.00000 -0.00002 -0.00006
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00012 0.00008 0.00247 0.00082 0.00057
|
|
148 2S 0.00110 0.00081 0.01251 0.00417 0.00310
|
|
149 3S 0.00291 0.00196 0.02808 0.00936 0.00638
|
|
150 4S 0.00153 -0.00089 0.01652 0.00551 -0.00317
|
|
151 5S 0.00010 0.00004 0.00124 0.00041 0.00015
|
|
152 6PX 0.00001 0.00001 0.00003 0.00003 0.00002
|
|
153 6PY 0.00000 0.00000 0.00003 0.00000 0.00001
|
|
154 6PZ 0.00000 0.00000 0.00002 0.00001 0.00001
|
|
155 7PX 0.00010 0.00011 0.00019 0.00025 0.00028
|
|
156 7PY 0.00000 0.00004 0.00025 0.00002 0.00009
|
|
157 7PZ 0.00002 0.00000 0.00017 0.00006 0.00009
|
|
158 8PX 0.00054 0.00021 0.00051 0.00124 0.00048
|
|
159 8PY 0.00006 0.00007 0.00124 0.00032 0.00016
|
|
160 8PZ 0.00012 0.00033 0.00083 0.00028 0.00142
|
|
161 9PX 0.00034 -0.00073 -0.00017 0.00097 -0.00210
|
|
162 9PY 0.00025 -0.00024 0.00097 0.00092 -0.00070
|
|
163 9PZ 0.00003 0.00129 0.00029 0.00010 0.00463
|
|
164 10D 0 0.00000 0.00001 0.00000 0.00000 0.00002
|
|
165 10D+1 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
167 10D+2 0.00001 0.00000 0.00000 0.00002 0.00000
|
|
168 10D-2 0.00000 0.00001 0.00001 0.00000 0.00001
|
|
169 11D 0 0.00000 0.00006 0.00000 0.00000 0.00011
|
|
170 11D+1 0.00003 0.00001 0.00006 0.00004 0.00005
|
|
171 11D-1 0.00000 0.00000 0.00004 -0.00001 0.00002
|
|
172 11D+2 0.00006 0.00002 0.00000 0.00012 0.00003
|
|
173 11D-2 0.00000 0.00005 0.00007 0.00000 0.00008
|
|
174 12D 0 0.00000 0.00009 -0.00006 -0.00002 0.00020
|
|
175 12D+1 0.00005 0.00029 0.00005 0.00010 0.00084
|
|
176 12D-1 0.00000 0.00010 0.00010 0.00000 0.00028
|
|
177 12D+2 0.00023 -0.00008 0.00009 0.00051 -0.00014
|
|
178 12D-2 0.00003 -0.00024 0.00008 0.00009 -0.00043
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
187 14F+1 0.00000 0.00002 -0.00001 0.00000 0.00003
|
|
188 14F-1 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
189 14F+2 0.00001 0.00001 -0.00001 0.00002 0.00001
|
|
190 14F-2 0.00000 0.00002 0.00002 -0.00001 0.00004
|
|
191 14F+3 0.00002 0.00000 0.00001 0.00003 0.00000
|
|
192 14F-3 0.00000 -0.00006 -0.00001 0.00000 -0.00006
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00012 0.00008 0.00247 0.00082 0.00057
|
|
203 2S 0.00110 0.00081 0.01251 0.00417 0.00310
|
|
204 3S 0.00291 0.00196 0.02808 0.00936 0.00638
|
|
205 4S 0.00153 -0.00089 0.01652 0.00551 -0.00317
|
|
206 5S 0.00010 0.00004 0.00124 0.00041 0.00015
|
|
207 6PX 0.00001 0.00001 0.00003 0.00003 0.00002
|
|
208 6PY 0.00000 0.00000 0.00003 0.00000 0.00001
|
|
209 6PZ 0.00000 0.00000 0.00002 0.00001 0.00001
|
|
210 7PX 0.00010 0.00011 0.00019 0.00025 0.00028
|
|
211 7PY 0.00000 0.00004 0.00025 0.00002 0.00009
|
|
212 7PZ 0.00002 0.00000 0.00017 0.00006 0.00009
|
|
213 8PX 0.00054 0.00021 0.00051 0.00124 0.00048
|
|
214 8PY 0.00006 0.00007 0.00124 0.00032 0.00016
|
|
215 8PZ 0.00012 0.00033 0.00083 0.00028 0.00142
|
|
216 9PX 0.00034 -0.00073 -0.00017 0.00097 -0.00210
|
|
217 9PY 0.00025 -0.00024 0.00097 0.00092 -0.00070
|
|
218 9PZ 0.00003 0.00129 0.00029 0.00010 0.00463
|
|
219 10D 0 0.00000 0.00001 0.00000 0.00000 0.00002
|
|
220 10D+1 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
222 10D+2 0.00001 0.00000 0.00000 0.00002 0.00000
|
|
223 10D-2 0.00000 0.00001 0.00001 0.00000 0.00001
|
|
224 11D 0 0.00000 0.00006 0.00000 0.00000 0.00011
|
|
225 11D+1 0.00003 0.00001 0.00006 0.00004 0.00005
|
|
226 11D-1 0.00000 0.00000 0.00004 -0.00001 0.00002
|
|
227 11D+2 0.00006 0.00002 0.00000 0.00012 0.00003
|
|
228 11D-2 0.00000 0.00005 0.00007 0.00000 0.00008
|
|
229 12D 0 0.00000 0.00009 -0.00006 -0.00002 0.00020
|
|
230 12D+1 0.00005 0.00029 0.00005 0.00010 0.00084
|
|
231 12D-1 0.00000 0.00010 0.00010 0.00000 0.00028
|
|
232 12D+2 0.00023 -0.00008 0.00009 0.00051 -0.00014
|
|
233 12D-2 0.00003 -0.00024 0.00008 0.00009 -0.00043
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
242 14F+1 0.00000 0.00002 -0.00001 0.00000 0.00003
|
|
243 14F-1 0.00000 0.00001 0.00000 0.00000 0.00001
|
|
244 14F+2 0.00001 0.00001 -0.00001 0.00002 0.00001
|
|
245 14F-2 0.00000 0.00002 0.00002 -0.00001 0.00004
|
|
246 14F+3 0.00002 0.00000 0.00001 0.00003 0.00000
|
|
247 14F-3 0.00000 -0.00006 -0.00001 0.00000 -0.00006
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
16 17 18 19 20
|
|
16 10PX 0.07934
|
|
17 10PY 0.00000 0.07934
|
|
18 10PZ 0.00000 0.00000 0.19810
|
|
19 11PX 0.01612 0.00000 0.00000 0.00548
|
|
20 11PY 0.00000 0.01612 0.00000 0.00000 0.00548
|
|
21 11PZ 0.00000 0.00000 0.10938 0.00000 0.00000
|
|
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00333 0.00068 0.00000 0.00052
|
|
93 2S 0.00000 0.01637 0.00362 0.00000 0.00282
|
|
94 3S 0.00000 0.04043 0.00815 0.00000 0.00851
|
|
95 4S 0.00000 0.03028 -0.00608 0.00000 0.00891
|
|
96 5S 0.00000 0.00290 0.00034 0.00000 0.00126
|
|
97 6PX 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00002 0.00001 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00001 0.00002 0.00000 0.00000
|
|
100 7PX 0.00018 0.00000 0.00000 0.00003 0.00000
|
|
101 7PY 0.00000 0.00012 0.00022 0.00000 -0.00002
|
|
102 7PZ 0.00000 0.00011 0.00019 0.00000 0.00001
|
|
103 8PX 0.00149 0.00000 0.00000 0.00029 0.00000
|
|
104 8PY 0.00000 0.00034 0.00038 0.00000 -0.00015
|
|
105 8PZ 0.00000 0.00066 0.00247 0.00000 0.00006
|
|
106 9PX 0.00306 0.00000 0.00000 0.00080 0.00000
|
|
107 9PY 0.00000 -0.00055 -0.00340 0.00000 -0.00039
|
|
108 9PZ 0.00000 0.00035 0.00830 0.00000 0.00005
|
|
109 10D 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00002 0.00007 0.00000 0.00000
|
|
117 11D+2 0.00000 -0.00003 0.00003 0.00000 0.00000
|
|
118 11D-2 0.00007 0.00000 0.00000 0.00001 0.00000
|
|
119 12D 0 0.00000 -0.00007 0.00015 0.00000 -0.00001
|
|
120 12D+1 0.00005 0.00000 0.00000 0.00001 0.00000
|
|
121 12D-1 0.00000 0.00001 0.00118 0.00000 -0.00001
|
|
122 12D+2 0.00000 -0.00012 -0.00032 0.00000 -0.00002
|
|
123 12D-2 0.00054 0.00000 0.00000 0.00006 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
134 14F+2 0.00000 -0.00001 0.00003 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 -0.00001 -0.00001 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00250 0.00083 0.00068 0.00039 0.00013
|
|
148 2S 0.01228 0.00409 0.00362 0.00212 0.00071
|
|
149 3S 0.03032 0.01011 0.00815 0.00638 0.00213
|
|
150 4S 0.02271 0.00757 -0.00608 0.00668 0.00223
|
|
151 5S 0.00218 0.00073 0.00034 0.00095 0.00032
|
|
152 6PX 0.00000 0.00001 0.00001 0.00000 0.00000
|
|
153 6PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00001 0.00000 0.00002 0.00000 0.00000
|
|
155 7PX 0.00001 0.00012 0.00017 -0.00001 0.00001
|
|
156 7PY 0.00012 0.00004 0.00006 0.00001 0.00001
|
|
157 7PZ 0.00008 0.00003 0.00019 0.00001 0.00000
|
|
158 8PX -0.00011 0.00074 0.00029 -0.00011 0.00007
|
|
159 8PY 0.00074 0.00046 0.00010 0.00007 0.00011
|
|
160 8PZ 0.00050 0.00017 0.00247 0.00005 0.00002
|
|
161 9PX -0.00052 0.00087 -0.00255 -0.00022 0.00013
|
|
162 9PY 0.00087 0.00128 -0.00085 0.00013 0.00037
|
|
163 9PZ 0.00026 0.00009 0.00830 0.00004 0.00001
|
|
164 10D 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00001 0.00006 0.00000 0.00000
|
|
171 11D-1 0.00001 -0.00001 0.00002 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00005 0.00001 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
174 12D 0 -0.00005 -0.00002 0.00015 -0.00001 0.00000
|
|
175 12D+1 -0.00002 0.00004 0.00088 -0.00001 0.00000
|
|
176 12D-1 0.00004 0.00000 0.00029 0.00000 0.00000
|
|
177 12D+2 0.00007 0.00030 -0.00008 0.00001 0.00003
|
|
178 12D-2 -0.00003 0.00007 -0.00024 -0.00001 0.00001
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
190 14F-2 0.00000 -0.00001 0.00002 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
192 14F-3 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00250 0.00083 0.00068 0.00039 0.00013
|
|
203 2S 0.01228 0.00409 0.00362 0.00212 0.00071
|
|
204 3S 0.03032 0.01011 0.00815 0.00638 0.00213
|
|
205 4S 0.02271 0.00757 -0.00608 0.00668 0.00223
|
|
206 5S 0.00218 0.00073 0.00034 0.00095 0.00032
|
|
207 6PX 0.00000 0.00001 0.00001 0.00000 0.00000
|
|
208 6PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00001 0.00000 0.00002 0.00000 0.00000
|
|
210 7PX 0.00001 0.00012 0.00017 -0.00001 0.00001
|
|
211 7PY 0.00012 0.00004 0.00006 0.00001 0.00001
|
|
212 7PZ 0.00008 0.00003 0.00019 0.00001 0.00000
|
|
213 8PX -0.00011 0.00074 0.00029 -0.00011 0.00007
|
|
214 8PY 0.00074 0.00046 0.00010 0.00007 0.00011
|
|
215 8PZ 0.00050 0.00017 0.00247 0.00005 0.00002
|
|
216 9PX -0.00052 0.00087 -0.00255 -0.00022 0.00013
|
|
217 9PY 0.00087 0.00128 -0.00085 0.00013 0.00037
|
|
218 9PZ 0.00026 0.00009 0.00830 0.00004 0.00001
|
|
219 10D 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00001 0.00006 0.00000 0.00000
|
|
226 11D-1 0.00001 -0.00001 0.00002 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00005 0.00001 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
229 12D 0 -0.00005 -0.00002 0.00015 -0.00001 0.00000
|
|
230 12D+1 -0.00002 0.00004 0.00088 -0.00001 0.00000
|
|
231 12D-1 0.00004 0.00000 0.00029 0.00000 0.00000
|
|
232 12D+2 0.00007 0.00030 -0.00008 0.00001 0.00003
|
|
233 12D-2 -0.00003 0.00007 -0.00024 -0.00001 0.00001
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
245 14F-2 0.00000 -0.00001 0.00002 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
247 14F-3 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
21 22 23 24 25
|
|
21 11PZ 0.10157
|
|
22 12D 0 0.00000 0.00000
|
|
23 12D+1 0.00000 0.00000 0.00000
|
|
24 12D-1 0.00000 0.00000 0.00000 0.00000
|
|
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
28 13D+1 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00025 0.00000 0.00000 0.00000 0.00000
|
|
93 2S 0.00151 0.00000 0.00000 0.00001 0.00001
|
|
94 3S 0.00414 0.00000 0.00000 0.00001 0.00001
|
|
95 4S -0.00514 0.00000 0.00000 0.00000 0.00000
|
|
96 5S 0.00040 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00011 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00007 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00154 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY -0.00143 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00634 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00039 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 -0.00005 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00025 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00151 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00414 0.00000 0.00001 0.00000 0.00000
|
|
150 4S -0.00514 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00040 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00011 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00005 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00154 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX -0.00107 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY -0.00036 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00634 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00029 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00010 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00025 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00151 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00414 0.00000 0.00001 0.00000 0.00000
|
|
205 4S -0.00514 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00040 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00011 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00005 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00154 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX -0.00107 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY -0.00036 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00634 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00029 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00010 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 -0.00004 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
26 27 28 29 30
|
|
26 12D-2 0.00000
|
|
27 13D 0 0.00000 0.00002
|
|
28 13D+1 0.00000 0.00000 0.00009
|
|
29 13D-1 0.00000 0.00000 0.00000 0.00009
|
|
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00005
|
|
31 13D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
32 14D 0 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
33 14D+1 0.00000 0.00000 0.00021 0.00000 0.00000
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00021 0.00000
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00013
|
|
36 14D-2 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00005 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00005 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00004
|
|
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00002 0.00002
|
|
93 2S 0.00000 0.00000 0.00000 0.00013 0.00011
|
|
94 3S 0.00000 0.00000 0.00000 0.00018 0.00016
|
|
95 4S 0.00000 0.00000 0.00000 0.00004 0.00004
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00002 0.00001
|
|
105 8PZ 0.00000 0.00001 0.00000 -0.00001 0.00001
|
|
106 9PX 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00010 0.00003 0.00003
|
|
149 3S 0.00001 0.00000 0.00013 0.00004 0.00004
|
|
150 4S 0.00000 0.00000 0.00003 0.00001 0.00001
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
159 8PY 0.00000 0.00000 0.00001 0.00000 -0.00001
|
|
160 8PZ 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00010 0.00003 0.00003
|
|
204 3S 0.00001 0.00000 0.00013 0.00004 0.00004
|
|
205 4S 0.00000 0.00000 0.00003 0.00001 0.00001
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00001 0.00001 0.00000
|
|
214 8PY 0.00000 0.00000 0.00001 0.00000 -0.00001
|
|
215 8PZ 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
31 32 33 34 35
|
|
31 13D-2 0.00005
|
|
32 14D 0 0.00000 0.00015
|
|
33 14D+1 0.00000 0.00000 0.00099
|
|
34 14D-1 0.00000 0.00000 0.00000 0.00099
|
|
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00064
|
|
36 14D-2 0.00013 0.00000 0.00000 0.00000 0.00000
|
|
37 15D 0 0.00000 0.00012 0.00000 0.00000 0.00000
|
|
38 15D+1 0.00000 0.00000 0.00043 0.00000 0.00000
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00043 0.00000
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00033
|
|
41 15D-2 0.00004 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00029 0.00027
|
|
93 2S 0.00000 0.00000 0.00000 0.00114 0.00107
|
|
94 3S 0.00000 0.00000 0.00000 0.00158 0.00148
|
|
95 4S 0.00000 0.00003 0.00000 0.00047 0.00044
|
|
96 5S 0.00000 0.00000 0.00000 0.00002 0.00001
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00004 0.00002
|
|
102 7PZ 0.00000 0.00001 0.00000 -0.00001 0.00002
|
|
103 8PX -0.00002 0.00000 0.00007 0.00000 0.00000
|
|
104 8PY 0.00000 -0.00001 0.00000 0.00010 0.00001
|
|
105 8PZ 0.00000 0.00007 0.00000 -0.00009 0.00005
|
|
106 9PX -0.00001 0.00000 0.00007 0.00000 0.00000
|
|
107 9PY 0.00000 -0.00005 0.00000 0.00001 -0.00005
|
|
108 9PZ 0.00000 0.00006 0.00000 -0.00004 0.00001
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00001 0.00000 -0.00001 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
120 12D+1 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00002 0.00000 -0.00002 0.00000
|
|
122 12D+2 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
123 12D-2 -0.00001 0.00000 0.00004 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00001 0.00000 0.00022 0.00007 0.00007
|
|
148 2S 0.00009 0.00000 0.00086 0.00029 0.00027
|
|
149 3S 0.00012 0.00000 0.00119 0.00040 0.00037
|
|
150 4S 0.00003 0.00003 0.00035 0.00012 0.00011
|
|
151 5S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00002 0.00002 -0.00001
|
|
156 7PY 0.00000 0.00000 0.00002 0.00000 -0.00001
|
|
157 7PZ 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
158 8PX 0.00001 0.00000 0.00003 0.00007 -0.00005
|
|
159 8PY 0.00000 0.00000 0.00007 0.00002 -0.00005
|
|
160 8PZ 0.00001 0.00007 -0.00007 -0.00002 0.00001
|
|
161 9PX 0.00000 -0.00003 0.00000 0.00003 -0.00006
|
|
162 9PY -0.00001 -0.00001 0.00003 0.00002 -0.00004
|
|
163 9PZ 0.00000 0.00006 -0.00003 -0.00001 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
173 11D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00002 0.00000 -0.00001 -0.00001
|
|
176 12D-1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
177 12D+2 0.00000 -0.00001 0.00000 0.00002 -0.00002
|
|
178 12D-2 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00001 0.00000 0.00022 0.00007 0.00007
|
|
203 2S 0.00009 0.00000 0.00086 0.00029 0.00027
|
|
204 3S 0.00012 0.00000 0.00119 0.00040 0.00037
|
|
205 4S 0.00003 0.00003 0.00035 0.00012 0.00011
|
|
206 5S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00002 0.00002 -0.00001
|
|
211 7PY 0.00000 0.00000 0.00002 0.00000 -0.00001
|
|
212 7PZ 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
213 8PX 0.00001 0.00000 0.00003 0.00007 -0.00005
|
|
214 8PY 0.00000 0.00000 0.00007 0.00002 -0.00005
|
|
215 8PZ 0.00001 0.00007 -0.00007 -0.00002 0.00001
|
|
216 9PX 0.00000 -0.00003 0.00000 0.00003 -0.00006
|
|
217 9PY -0.00001 -0.00001 0.00003 0.00002 -0.00004
|
|
218 9PZ 0.00000 0.00006 -0.00003 -0.00001 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
228 11D-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00002 0.00000 -0.00001 -0.00001
|
|
231 12D-1 0.00000 0.00001 -0.00001 0.00000 0.00000
|
|
232 12D+2 0.00000 -0.00001 0.00000 0.00002 -0.00002
|
|
233 12D-2 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
36 37 38 39 40
|
|
36 14D-2 0.00064
|
|
37 15D 0 0.00000 0.00024
|
|
38 15D+1 0.00000 0.00000 0.00040
|
|
39 15D-1 0.00000 0.00000 0.00000 0.00040
|
|
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00036
|
|
41 15D-2 0.00033 0.00000 0.00000 0.00000 0.00000
|
|
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 -0.00001 0.00000 0.00018 0.00020
|
|
93 2S 0.00000 -0.00007 0.00000 0.00076 0.00084
|
|
94 3S 0.00000 -0.00011 0.00000 0.00143 0.00158
|
|
95 4S 0.00000 0.00007 0.00000 0.00067 0.00074
|
|
96 5S 0.00000 0.00000 0.00000 0.00003 0.00004
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX -0.00003 0.00000 0.00001 0.00000 0.00000
|
|
101 7PY 0.00000 0.00001 0.00000 0.00001 -0.00001
|
|
102 7PZ 0.00000 0.00001 0.00000 -0.00001 0.00001
|
|
103 8PX -0.00014 0.00000 0.00006 0.00000 0.00000
|
|
104 8PY 0.00000 0.00001 0.00000 0.00002 -0.00006
|
|
105 8PZ 0.00000 0.00009 0.00000 -0.00009 0.00003
|
|
106 9PX -0.00012 0.00000 0.00008 0.00000 0.00000
|
|
107 9PY 0.00000 -0.00013 0.00000 -0.00001 -0.00010
|
|
108 9PZ 0.00000 0.00016 0.00000 -0.00005 0.00001
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00001 -0.00001
|
|
120 12D+1 -0.00001 0.00000 -0.00001 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00002 0.00000 0.00000 -0.00001
|
|
122 12D+2 0.00000 -0.00003 0.00000 0.00000 0.00000
|
|
123 12D-2 -0.00003 0.00000 0.00002 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00021 -0.00001 0.00013 0.00004 0.00005
|
|
148 2S 0.00080 -0.00007 0.00057 0.00019 0.00021
|
|
149 3S 0.00111 -0.00011 0.00107 0.00036 0.00040
|
|
150 4S 0.00033 0.00007 0.00050 0.00017 0.00019
|
|
151 5S 0.00001 0.00000 0.00003 0.00001 0.00001
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00001 0.00000 0.00000 0.00001 -0.00001
|
|
156 7PY -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
157 7PZ 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
158 8PX 0.00003 0.00000 0.00000 0.00003 -0.00008
|
|
159 8PY -0.00005 0.00000 0.00003 0.00002 -0.00004
|
|
160 8PZ 0.00004 0.00009 -0.00007 -0.00002 0.00001
|
|
161 9PX 0.00000 -0.00010 -0.00001 0.00002 -0.00010
|
|
162 9PY -0.00006 -0.00003 0.00002 0.00003 -0.00006
|
|
163 9PZ 0.00001 0.00016 -0.00004 -0.00001 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00002 0.00000 -0.00001 0.00000
|
|
176 12D-1 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
177 12D+2 0.00000 -0.00001 0.00000 0.00001 0.00000
|
|
178 12D-2 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00021 -0.00001 0.00013 0.00004 0.00005
|
|
203 2S 0.00080 -0.00007 0.00057 0.00019 0.00021
|
|
204 3S 0.00111 -0.00011 0.00107 0.00036 0.00040
|
|
205 4S 0.00033 0.00007 0.00050 0.00017 0.00019
|
|
206 5S 0.00001 0.00000 0.00003 0.00001 0.00001
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00001 0.00000 0.00000 0.00001 -0.00001
|
|
211 7PY -0.00001 0.00000 0.00001 0.00000 0.00000
|
|
212 7PZ 0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
213 8PX 0.00003 0.00000 0.00000 0.00003 -0.00008
|
|
214 8PY -0.00005 0.00000 0.00003 0.00002 -0.00004
|
|
215 8PZ 0.00004 0.00009 -0.00007 -0.00002 0.00001
|
|
216 9PX 0.00000 -0.00010 -0.00001 0.00002 -0.00010
|
|
217 9PY -0.00006 -0.00003 0.00002 0.00003 -0.00006
|
|
218 9PZ 0.00001 0.00016 -0.00004 -0.00001 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00002 0.00000 -0.00001 0.00000
|
|
231 12D-1 -0.00001 0.00001 -0.00001 0.00000 0.00000
|
|
232 12D+2 0.00000 -0.00001 0.00000 0.00001 0.00000
|
|
233 12D-2 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
41 42 43 44 45
|
|
41 15D-2 0.00036
|
|
42 16F 0 0.00000 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
93 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
94 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX -0.00013 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX -0.00018 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00015 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00063 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00119 0.00000 0.00000 0.00000 0.00000
|
|
150 4S 0.00056 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY -0.00008 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00015 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00063 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00119 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00056 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY -0.00008 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY -0.00010 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
46 47 48 49 50
|
|
46 16F-2 0.00000
|
|
47 16F+3 0.00000 0.00000
|
|
48 16F-3 0.00000 0.00000 0.00000
|
|
49 17F 0 0.00000 0.00000 0.00000 0.00003
|
|
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
93 2S 0.00000 0.00000 0.00000 0.00004 0.00000
|
|
94 3S 0.00000 0.00000 0.00000 0.00003 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00004 0.00001
|
|
149 3S 0.00000 0.00000 0.00000 0.00003 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00004 0.00001
|
|
204 3S 0.00000 0.00000 0.00000 0.00003 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
51 52 53 54 55
|
|
51 17F-1 0.00000
|
|
52 17F+2 0.00000 0.00001
|
|
53 17F-2 0.00000 0.00000 0.00001
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
59 18F+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
60 18F-2 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00002 0.00000 0.00000 0.00002
|
|
93 2S 0.00001 0.00007 0.00000 0.00000 0.00005
|
|
94 3S 0.00001 0.00005 0.00000 0.00000 0.00004
|
|
95 4S 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00001 0.00002 0.00000 0.00002
|
|
148 2S 0.00000 0.00002 0.00005 0.00000 0.00005
|
|
149 3S 0.00000 0.00001 0.00004 0.00000 0.00004
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00001 0.00002 0.00000 0.00002
|
|
203 2S 0.00000 0.00002 0.00005 0.00000 0.00005
|
|
204 3S 0.00000 0.00001 0.00004 0.00000 0.00004
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
56 57 58 59 60
|
|
56 18F 0 0.00002
|
|
57 18F+1 0.00000 0.00001
|
|
58 18F-1 0.00000 0.00000 0.00001
|
|
59 18F+2 0.00000 0.00000 0.00000 0.00003
|
|
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00003
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00002 0.00000 0.00001 0.00006 0.00000
|
|
93 2S 0.00007 0.00000 0.00002 0.00020 0.00000
|
|
94 3S 0.00007 0.00000 0.00002 0.00021 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.00004 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
104 8PY 0.00000 0.00000 -0.00001 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00001 -0.00001 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
107 9PY 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00002 0.00000 0.00000 0.00002 0.00005
|
|
148 2S 0.00007 0.00001 0.00000 0.00005 0.00015
|
|
149 3S 0.00007 0.00001 0.00000 0.00005 0.00015
|
|
150 4S 0.00000 0.00000 0.00000 0.00001 0.00003
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
160 8PZ 0.00000 0.00001 0.00000 0.00000 -0.00001
|
|
161 9PX 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00002 0.00000 0.00000 0.00002 0.00005
|
|
203 2S 0.00007 0.00001 0.00000 0.00005 0.00015
|
|
204 3S 0.00007 0.00001 0.00000 0.00005 0.00015
|
|
205 4S 0.00000 0.00000 0.00000 0.00001 0.00003
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 -0.00001 -0.00001
|
|
215 8PZ 0.00000 0.00001 0.00000 0.00000 -0.00001
|
|
216 9PX 0.00000 0.00000 0.00000 -0.00001 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 -0.00001
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
61 62 63 64 65
|
|
61 18F+3 0.00000
|
|
62 18F-3 0.00000 0.00003
|
|
63 19G 0 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00000 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
93 2S 0.00000 0.00010 0.00000 0.00000 0.00000
|
|
94 3S 0.00000 0.00010 0.00000 0.00000 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00010 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00010 0.00000 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00010 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00010 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
66 67 68 69 70
|
|
66 19G+2 0.00000
|
|
67 19G-2 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00000 0.00000 0.00000 0.00000
|
|
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
93 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
94 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
71 72 73 74 75
|
|
71 19G-4 0.00000
|
|
72 20G 0 0.00000 0.00000
|
|
73 20G+1 0.00000 0.00000 0.00000
|
|
74 20G-1 0.00000 0.00000 0.00000 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
93 2S 0.00000 0.00000 0.00000 0.00004 0.00000
|
|
94 3S 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00002 0.00001 0.00000
|
|
148 2S 0.00000 0.00000 0.00003 0.00001 0.00000
|
|
149 3S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00002 0.00001 0.00000
|
|
203 2S 0.00000 0.00000 0.00003 0.00001 0.00000
|
|
204 3S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
76 77 78 79 80
|
|
76 20G-2 0.00000
|
|
77 20G+3 0.00000 0.00000
|
|
78 20G-3 0.00000 0.00000 0.00001
|
|
79 20G+4 0.00000 0.00000 0.00000 0.00001
|
|
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00002 0.00002 0.00000
|
|
93 2S 0.00000 0.00000 0.00003 0.00005 0.00000
|
|
94 3S 0.00000 0.00000 0.00001 0.00002 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00002 0.00001 0.00002
|
|
148 2S 0.00000 0.00000 0.00003 0.00001 0.00004
|
|
149 3S 0.00000 0.00000 0.00001 0.00001 0.00002
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00002 0.00001 0.00002
|
|
203 2S 0.00000 0.00000 0.00003 0.00001 0.00004
|
|
204 3S 0.00000 0.00000 0.00001 0.00001 0.00002
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
81 82 83 84 85
|
|
81 21H 0 0.00000
|
|
82 21H+1 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
93 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
94 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
86 87 88 89 90
|
|
86 21H+3 0.00000
|
|
87 21H-3 0.00000 0.00000
|
|
88 21H+4 0.00000 0.00000 0.00000
|
|
89 21H-4 0.00000 0.00000 0.00000 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
93 2S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
94 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
95 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
96 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
91 92 93 94 95
|
|
91 21H-5 0.00000
|
|
92 2 H 1S 0.00000 0.00425
|
|
93 2S 0.00000 0.00748 0.02361
|
|
94 3S 0.00000 0.00810 0.03582 0.07871
|
|
95 4S 0.00000 0.00310 0.01616 0.04782 0.05728
|
|
96 5S 0.00000 0.00033 0.00189 0.00649 0.00808
|
|
97 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
104 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 -0.00002 -0.00028
|
|
148 2S 0.00000 0.00000 -0.00001 -0.00019 -0.00173
|
|
149 3S 0.00000 -0.00002 -0.00019 -0.00132 -0.00659
|
|
150 4S 0.00000 -0.00028 -0.00173 -0.00659 -0.00767
|
|
151 5S 0.00000 -0.00007 -0.00040 -0.00148 -0.00284
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 -0.00004
|
|
156 7PY 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 -0.00001 -0.00008 -0.00024
|
|
159 8PY 0.00000 0.00001 0.00007 0.00038 0.00032
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 -0.00005 -0.00030 -0.00096 -0.00016
|
|
162 9PY 0.00000 0.00003 0.00016 0.00056 0.00146
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00001 0.00004 0.00012 0.00005
|
|
178 12D-2 0.00000 0.00000 0.00001 0.00002 0.00011
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 -0.00002 -0.00028
|
|
203 2S 0.00000 0.00000 -0.00001 -0.00019 -0.00173
|
|
204 3S 0.00000 -0.00002 -0.00019 -0.00132 -0.00659
|
|
205 4S 0.00000 -0.00028 -0.00173 -0.00659 -0.00767
|
|
206 5S 0.00000 -0.00007 -0.00040 -0.00148 -0.00284
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 -0.00004
|
|
211 7PY 0.00000 0.00000 0.00000 0.00003 0.00002
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 -0.00001 -0.00008 -0.00024
|
|
214 8PY 0.00000 0.00001 0.00007 0.00038 0.00032
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 -0.00005 -0.00030 -0.00096 -0.00016
|
|
217 9PY 0.00000 0.00003 0.00016 0.00056 0.00146
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00001 0.00001
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00001 0.00004 0.00012 0.00005
|
|
233 12D-2 0.00000 0.00000 0.00001 0.00002 0.00011
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
96 97 98 99 100
|
|
96 5S 0.00200
|
|
97 6PX 0.00000 0.00000
|
|
98 6PY 0.00000 0.00000 0.00001
|
|
99 6PZ 0.00000 0.00000 0.00000 0.00000
|
|
100 7PX 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
101 7PY 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
102 7PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
103 8PX 0.00000 0.00000 0.00000 0.00000 0.00004
|
|
104 8PY 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
105 8PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
106 9PX 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S -0.00007 0.00000 0.00000 0.00000 0.00000
|
|
148 2S -0.00040 0.00000 0.00000 0.00000 0.00000
|
|
149 3S -0.00148 0.00000 0.00000 0.00000 0.00002
|
|
150 4S -0.00284 0.00000 0.00000 0.00000 0.00003
|
|
151 5S -0.00065 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX -0.00014 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00007 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00007 0.00000 0.00000 0.00000 0.00000
|
|
203 2S -0.00040 0.00000 0.00000 0.00000 0.00000
|
|
204 3S -0.00148 0.00000 0.00000 0.00000 0.00002
|
|
205 4S -0.00284 0.00000 0.00000 0.00000 0.00003
|
|
206 5S -0.00065 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX -0.00003 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX -0.00014 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00007 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
101 102 103 104 105
|
|
101 7PY 0.00009
|
|
102 7PZ 0.00000 0.00003
|
|
103 8PX 0.00000 0.00000 0.00018
|
|
104 8PY 0.00017 0.00000 0.00000 0.00068
|
|
105 8PZ 0.00000 0.00010 0.00000 0.00000 0.00055
|
|
106 9PX 0.00000 0.00000 0.00018 0.00000 0.00000
|
|
107 9PY -0.00001 0.00000 0.00000 0.00025 0.00000
|
|
108 9PZ 0.00000 0.00006 0.00000 0.00000 0.00056
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00004 0.00002 0.00000
|
|
149 3S 0.00001 0.00000 0.00023 0.00007 0.00000
|
|
150 4S -0.00004 0.00000 0.00028 -0.00021 0.00000
|
|
151 5S 0.00000 0.00000 0.00003 -0.00003 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
159 8PY 0.00001 0.00000 0.00002 0.00005 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
161 9PX -0.00001 0.00000 0.00000 -0.00004 0.00000
|
|
162 9PY 0.00000 0.00000 0.00004 0.00004 0.00000
|
|
163 9PZ 0.00000 0.00001 0.00000 0.00000 0.00009
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00004 0.00002 0.00000
|
|
204 3S 0.00001 0.00000 0.00023 0.00007 0.00000
|
|
205 4S -0.00004 0.00000 0.00028 -0.00021 0.00000
|
|
206 5S 0.00000 0.00000 0.00003 -0.00003 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00002 0.00000
|
|
214 8PY 0.00001 0.00000 0.00002 0.00005 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
216 9PX -0.00001 0.00000 0.00000 -0.00004 0.00000
|
|
217 9PY 0.00000 0.00000 0.00004 0.00004 0.00000
|
|
218 9PZ 0.00000 0.00001 0.00000 0.00000 0.00009
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
106 107 108 109 110
|
|
106 9PX 0.00031
|
|
107 9PY 0.00000 0.00166
|
|
108 9PZ 0.00000 0.00000 0.00129
|
|
109 10D 0 0.00000 0.00000 0.00000 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00004 -0.00006 0.00000 0.00000 0.00000
|
|
148 2S 0.00023 -0.00038 0.00000 0.00000 0.00000
|
|
149 3S 0.00076 -0.00115 0.00000 0.00000 0.00000
|
|
150 4S 0.00081 0.00049 0.00000 0.00000 0.00000
|
|
151 5S 0.00010 -0.00017 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
156 7PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
158 8PX 0.00000 -0.00003 0.00000 0.00000 0.00000
|
|
159 8PY 0.00005 0.00003 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00009 0.00000 0.00000
|
|
161 9PX -0.00002 0.00031 0.00000 0.00000 0.00000
|
|
162 9PY 0.00008 0.00019 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00039 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00005 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00004 -0.00006 0.00000 0.00000 0.00000
|
|
203 2S 0.00023 -0.00038 0.00000 0.00000 0.00000
|
|
204 3S 0.00076 -0.00115 0.00000 0.00000 0.00000
|
|
205 4S 0.00081 0.00049 0.00000 0.00000 0.00000
|
|
206 5S 0.00010 -0.00017 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 -0.00001 0.00000 0.00000 0.00000
|
|
211 7PY 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
213 8PX 0.00000 -0.00003 0.00000 0.00000 0.00000
|
|
214 8PY 0.00005 0.00003 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00009 0.00000 0.00000
|
|
216 9PX -0.00002 0.00031 0.00000 0.00000 0.00000
|
|
217 9PY 0.00008 0.00019 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00039 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00005 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
111 112 113 114 115
|
|
111 10D-1 0.00000
|
|
112 10D+2 0.00000 0.00000
|
|
113 10D-2 0.00000 0.00000 0.00000
|
|
114 11D 0 0.00000 0.00000 0.00000 0.00000
|
|
115 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
117 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
118 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
116 117 118 119 120
|
|
116 11D-1 0.00001
|
|
117 11D+2 0.00000 0.00001
|
|
118 11D-2 0.00000 0.00000 0.00000
|
|
119 12D 0 0.00000 0.00000 0.00000 0.00001
|
|
120 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 12D-1 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
123 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00001 -0.00002 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00001 -0.00002 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
121 122 123 124 125
|
|
121 12D-1 0.00008
|
|
122 12D+2 0.00000 0.00007
|
|
123 12D-2 0.00000 0.00000 0.00002
|
|
124 13F 0 0.00000 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
148 2S 0.00000 -0.00002 0.00007 0.00000 0.00000
|
|
149 3S 0.00000 -0.00005 0.00020 0.00000 0.00000
|
|
150 4S 0.00000 0.00003 0.00013 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
160 8PZ 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00005 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
163 9PZ 0.00007 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
203 2S 0.00000 -0.00002 0.00007 0.00000 0.00000
|
|
204 3S 0.00000 -0.00005 0.00020 0.00000 0.00000
|
|
205 4S 0.00000 0.00003 0.00013 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
215 8PZ 0.00002 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00005 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 -0.00001 0.00001 0.00000 0.00000
|
|
218 9PZ 0.00007 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
126 127 128 129 130
|
|
126 13F-1 0.00000
|
|
127 13F+2 0.00000 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00000 0.00000 0.00000 0.00000
|
|
130 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
132 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
131 132 133 134 135
|
|
131 14F 0 0.00000
|
|
132 14F+1 0.00000 0.00000
|
|
133 14F-1 0.00000 0.00000 0.00000
|
|
134 14F+2 0.00000 0.00000 0.00000 0.00000
|
|
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
137 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
136 137 138 139 140
|
|
136 14F+3 0.00000
|
|
137 14F-3 0.00000 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
141 142 143 144 145
|
|
141 15G+2 0.00000
|
|
142 15G-2 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00000 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
148 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
149 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
150 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
146 147 148 149 150
|
|
146 15G-4 0.00000
|
|
147 3 H 1S 0.00000 0.00425
|
|
148 2S 0.00000 0.00748 0.02361
|
|
149 3S 0.00000 0.00810 0.03582 0.07871
|
|
150 4S 0.00000 0.00310 0.01616 0.04782 0.05728
|
|
151 5S 0.00000 0.00033 0.00189 0.00649 0.00808
|
|
152 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
153 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
158 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
159 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 -0.00002 -0.00028
|
|
203 2S 0.00000 0.00000 -0.00001 -0.00019 -0.00173
|
|
204 3S 0.00000 -0.00002 -0.00019 -0.00132 -0.00659
|
|
205 4S 0.00000 -0.00028 -0.00173 -0.00659 -0.00767
|
|
206 5S 0.00000 -0.00007 -0.00040 -0.00148 -0.00284
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00003 -0.00001
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00001 0.00006 0.00030 0.00007
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 -0.00002 -0.00014 -0.00039 0.00130
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00002 0.00001
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 -0.00002
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00001 0.00005 0.00015 0.00016
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
151 152 153 154 155
|
|
151 5S 0.00200
|
|
152 6PX 0.00000 0.00001
|
|
153 6PY 0.00000 0.00000 0.00000
|
|
154 6PZ 0.00000 0.00000 0.00000 0.00000
|
|
155 7PX 0.00000 0.00002 0.00000 0.00000 0.00007
|
|
156 7PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
157 7PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
158 8PX 0.00000 0.00002 0.00000 0.00000 0.00014
|
|
159 8PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
160 8PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
161 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
162 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
163 9PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00007 0.00000 0.00000 0.00000 0.00000
|
|
203 2S -0.00040 0.00000 0.00000 0.00000 0.00000
|
|
204 3S -0.00148 0.00000 0.00000 0.00000 0.00003
|
|
205 4S -0.00284 0.00000 0.00000 0.00000 -0.00001
|
|
206 5S -0.00065 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX -0.00006 0.00000 0.00000 0.00000 -0.00001
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
156 157 158 159 160
|
|
156 7PY 0.00003
|
|
157 7PZ 0.00000 0.00003
|
|
158 8PX 0.00000 0.00000 0.00056
|
|
159 8PY 0.00007 0.00000 0.00000 0.00031
|
|
160 8PZ 0.00000 0.00010 0.00000 0.00000 0.00055
|
|
161 9PX 0.00000 0.00000 0.00023 0.00000 0.00000
|
|
162 9PY 0.00002 0.00000 0.00000 0.00020 0.00000
|
|
163 9PZ 0.00000 0.00006 0.00000 0.00000 0.00056
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00030 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00007 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00010 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
216 9PX 0.00000 0.00000 0.00006 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 -0.00002 0.00000
|
|
218 9PZ 0.00000 0.00001 0.00000 0.00000 0.00009
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
161 162 163 164 165
|
|
161 9PX 0.00132
|
|
162 9PY 0.00000 0.00064
|
|
163 9PZ 0.00000 0.00000 0.00129
|
|
164 10D 0 0.00000 0.00000 0.00000 0.00000
|
|
165 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S -0.00002 0.00000 0.00000 0.00000 0.00000
|
|
203 2S -0.00014 0.00000 0.00000 0.00000 0.00000
|
|
204 3S -0.00039 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00130 0.00000 0.00000 0.00000 0.00000
|
|
206 5S -0.00006 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX -0.00001 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
213 8PX 0.00006 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 -0.00002 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00009 0.00000 0.00000
|
|
216 9PX 0.00050 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00007 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00039 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00007 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00003 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
166 167 168 169 170
|
|
166 10D-1 0.00000
|
|
167 10D+2 0.00000 0.00000
|
|
168 10D-2 0.00000 0.00000 0.00000
|
|
169 11D 0 0.00000 0.00000 0.00000 0.00000
|
|
170 11D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
171 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
171 172 173 174 175
|
|
171 11D-1 0.00000
|
|
172 11D+2 0.00000 0.00000
|
|
173 11D-2 0.00000 0.00000 0.00001
|
|
174 12D 0 0.00000 0.00000 0.00000 0.00001
|
|
175 12D+1 0.00000 0.00000 0.00000 0.00000 0.00006
|
|
176 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
178 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00001 0.00000 -0.00002 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00007
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00002
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
176 177 178 179 180
|
|
176 12D-1 0.00002
|
|
177 12D+2 0.00000 0.00003
|
|
178 12D-2 0.00000 0.00000 0.00006
|
|
179 13F 0 0.00000 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00005 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00015 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00016 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00002 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00003 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00003 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00001 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00002 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
181 182 183 184 185
|
|
181 13F-1 0.00000
|
|
182 13F+2 0.00000 0.00000
|
|
183 13F-2 0.00000 0.00000 0.00000
|
|
184 13F+3 0.00000 0.00000 0.00000 0.00000
|
|
185 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
187 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
186 187 188 189 190
|
|
186 14F 0 0.00000
|
|
187 14F+1 0.00000 0.00000
|
|
188 14F-1 0.00000 0.00000 0.00000
|
|
189 14F+2 0.00000 0.00000 0.00000 0.00000
|
|
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
192 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
191 192 193 194 195
|
|
191 14F+3 0.00000
|
|
192 14F-3 0.00000 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00001 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
196 197 198 199 200
|
|
196 15G+2 0.00000
|
|
197 15G-2 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00000 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
203 2S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
204 3S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
205 4S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 5S 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
201 202 203 204 205
|
|
201 15G-4 0.00000
|
|
202 4 H 1S 0.00000 0.00425
|
|
203 2S 0.00000 0.00748 0.02361
|
|
204 3S 0.00000 0.00810 0.03582 0.07871
|
|
205 4S 0.00000 0.00310 0.01616 0.04782 0.05728
|
|
206 5S 0.00000 0.00033 0.00189 0.00649 0.00808
|
|
207 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
208 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
213 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
214 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
206 207 208 209 210
|
|
206 5S 0.00200
|
|
207 6PX 0.00000 0.00001
|
|
208 6PY 0.00000 0.00000 0.00000
|
|
209 6PZ 0.00000 0.00000 0.00000 0.00000
|
|
210 7PX 0.00000 0.00002 0.00000 0.00000 0.00007
|
|
211 7PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
212 7PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
213 8PX 0.00000 0.00002 0.00000 0.00000 0.00014
|
|
214 8PY 0.00000 0.00000 0.00001 0.00000 0.00000
|
|
215 8PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
216 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
217 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
218 9PZ 0.00000 0.00000 0.00000 0.00001 0.00000
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
211 212 213 214 215
|
|
211 7PY 0.00003
|
|
212 7PZ 0.00000 0.00003
|
|
213 8PX 0.00000 0.00000 0.00056
|
|
214 8PY 0.00007 0.00000 0.00000 0.00031
|
|
215 8PZ 0.00000 0.00010 0.00000 0.00000 0.00055
|
|
216 9PX 0.00000 0.00000 0.00023 0.00000 0.00000
|
|
217 9PY 0.00002 0.00000 0.00000 0.00020 0.00000
|
|
218 9PZ 0.00000 0.00006 0.00000 0.00000 0.00056
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
216 217 218 219 220
|
|
216 9PX 0.00132
|
|
217 9PY 0.00000 0.00064
|
|
218 9PZ 0.00000 0.00000 0.00129
|
|
219 10D 0 0.00000 0.00000 0.00000 0.00000
|
|
220 10D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 10D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
222 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
221 222 223 224 225
|
|
221 10D-1 0.00000
|
|
222 10D+2 0.00000 0.00000
|
|
223 10D-2 0.00000 0.00000 0.00000
|
|
224 11D 0 0.00000 0.00000 0.00000 0.00000
|
|
225 11D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
226 11D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
227 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00001
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
226 227 228 229 230
|
|
226 11D-1 0.00000
|
|
227 11D+2 0.00000 0.00000
|
|
228 11D-2 0.00000 0.00000 0.00001
|
|
229 12D 0 0.00000 0.00000 0.00000 0.00001
|
|
230 12D+1 0.00000 0.00000 0.00000 0.00000 0.00006
|
|
231 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
232 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
233 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
231 232 233 234 235
|
|
231 12D-1 0.00002
|
|
232 12D+2 0.00000 0.00003
|
|
233 12D-2 0.00000 0.00000 0.00006
|
|
234 13F 0 0.00000 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 13F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
236 237 238 239 240
|
|
236 13F-1 0.00000
|
|
237 13F+2 0.00000 0.00000
|
|
238 13F-2 0.00000 0.00000 0.00000
|
|
239 13F+3 0.00000 0.00000 0.00000 0.00000
|
|
240 13F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 14F 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
242 14F+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
241 242 243 244 245
|
|
241 14F 0 0.00000
|
|
242 14F+1 0.00000 0.00000
|
|
243 14F-1 0.00000 0.00000 0.00000
|
|
244 14F+2 0.00000 0.00000 0.00000 0.00000
|
|
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 14F+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
247 14F-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
246 247 248 249 250
|
|
246 14F+3 0.00000
|
|
247 14F-3 0.00000 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
251 252 253 254 255
|
|
251 15G+2 0.00000
|
|
252 15G-2 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00000 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
|
|
256
|
|
256 15G-4 0.00000
|
|
Gross orbital populations:
|
|
Total Alpha Beta Spin
|
|
1 1 N 1S 1.10897 0.55449 0.55449 0.00000
|
|
2 2S 0.78889 0.39444 0.39444 0.00000
|
|
3 3S 0.09274 0.04637 0.04637 0.00000
|
|
4 4S 0.46670 0.23335 0.23335 0.00000
|
|
5 5S 0.77463 0.38732 0.38732 0.00000
|
|
6 6S 0.19580 0.09790 0.09790 0.00000
|
|
7 7PX 0.07040 0.03520 0.03520 0.00000
|
|
8 7PY 0.07040 0.03520 0.03520 0.00000
|
|
9 7PZ 0.09594 0.04797 0.04797 0.00000
|
|
10 8PX 0.21195 0.10598 0.10598 0.00000
|
|
11 8PY 0.21195 0.10598 0.10598 0.00000
|
|
12 8PZ 0.28165 0.14082 0.14082 0.00000
|
|
13 9PX 0.43742 0.21871 0.21871 0.00000
|
|
14 9PY 0.43742 0.21871 0.21871 0.00000
|
|
15 9PZ 0.54857 0.27429 0.27429 0.00000
|
|
16 10PX 0.35678 0.17839 0.17839 0.00000
|
|
17 10PY 0.35678 0.17839 0.17839 0.00000
|
|
18 10PZ 0.56849 0.28425 0.28425 0.00000
|
|
19 11PX 0.06969 0.03484 0.03484 0.00000
|
|
20 11PY 0.06969 0.03484 0.03484 0.00000
|
|
21 11PZ 0.30760 0.15380 0.15380 0.00000
|
|
22 12D 0 0.00001 0.00000 0.00000 0.00000
|
|
23 12D+1 0.00007 0.00003 0.00003 0.00000
|
|
24 12D-1 0.00007 0.00003 0.00003 0.00000
|
|
25 12D+2 0.00005 0.00002 0.00002 0.00000
|
|
26 12D-2 0.00005 0.00002 0.00002 0.00000
|
|
27 13D 0 0.00013 0.00006 0.00006 0.00000
|
|
28 13D+1 0.00099 0.00049 0.00049 0.00000
|
|
29 13D-1 0.00099 0.00049 0.00049 0.00000
|
|
30 13D+2 0.00070 0.00035 0.00035 0.00000
|
|
31 13D-2 0.00070 0.00035 0.00035 0.00000
|
|
32 14D 0 0.00066 0.00033 0.00033 0.00000
|
|
33 14D+1 0.00721 0.00360 0.00360 0.00000
|
|
34 14D-1 0.00721 0.00360 0.00360 0.00000
|
|
35 14D+2 0.00559 0.00279 0.00279 0.00000
|
|
36 14D-2 0.00559 0.00279 0.00279 0.00000
|
|
37 15D 0 0.00039 0.00020 0.00020 0.00000
|
|
38 15D+1 0.00551 0.00275 0.00275 0.00000
|
|
39 15D-1 0.00551 0.00275 0.00275 0.00000
|
|
40 15D+2 0.00512 0.00256 0.00256 0.00000
|
|
41 15D-2 0.00512 0.00256 0.00256 0.00000
|
|
42 16F 0 0.00001 0.00001 0.00001 0.00000
|
|
43 16F+1 0.00000 0.00000 0.00000 0.00000
|
|
44 16F-1 0.00000 0.00000 0.00000 0.00000
|
|
45 16F+2 0.00001 0.00000 0.00000 0.00000
|
|
46 16F-2 0.00001 0.00000 0.00000 0.00000
|
|
47 16F+3 0.00000 0.00000 0.00000 0.00000
|
|
48 16F-3 0.00001 0.00001 0.00001 0.00000
|
|
49 17F 0 0.00035 0.00017 0.00017 0.00000
|
|
50 17F+1 0.00004 0.00002 0.00002 0.00000
|
|
51 17F-1 0.00004 0.00002 0.00002 0.00000
|
|
52 17F+2 0.00024 0.00012 0.00012 0.00000
|
|
53 17F-2 0.00024 0.00012 0.00012 0.00000
|
|
54 17F+3 0.00000 0.00000 0.00000 0.00000
|
|
55 17F-3 0.00036 0.00018 0.00018 0.00000
|
|
56 18F 0 0.00054 0.00027 0.00027 0.00000
|
|
57 18F+1 0.00009 0.00004 0.00004 0.00000
|
|
58 18F-1 0.00009 0.00004 0.00004 0.00000
|
|
59 18F+2 0.00070 0.00035 0.00035 0.00000
|
|
60 18F-2 0.00070 0.00035 0.00035 0.00000
|
|
61 18F+3 0.00000 0.00000 0.00000 0.00000
|
|
62 18F-3 0.00068 0.00034 0.00034 0.00000
|
|
63 19G 0 0.00000 0.00000 0.00000 0.00000
|
|
64 19G+1 0.00001 0.00000 0.00000 0.00000
|
|
65 19G-1 0.00001 0.00000 0.00000 0.00000
|
|
66 19G+2 0.00000 0.00000 0.00000 0.00000
|
|
67 19G-2 0.00000 0.00000 0.00000 0.00000
|
|
68 19G+3 0.00000 0.00000 0.00000 0.00000
|
|
69 19G-3 0.00001 0.00001 0.00001 0.00000
|
|
70 19G+4 0.00001 0.00000 0.00000 0.00000
|
|
71 19G-4 0.00001 0.00000 0.00000 0.00000
|
|
72 20G 0 0.00004 0.00002 0.00002 0.00000
|
|
73 20G+1 0.00014 0.00007 0.00007 0.00000
|
|
74 20G-1 0.00014 0.00007 0.00007 0.00000
|
|
75 20G+2 0.00000 0.00000 0.00000 0.00000
|
|
76 20G-2 0.00000 0.00000 0.00000 0.00000
|
|
77 20G+3 0.00000 0.00000 0.00000 0.00000
|
|
78 20G-3 0.00021 0.00010 0.00010 0.00000
|
|
79 20G+4 0.00017 0.00008 0.00008 0.00000
|
|
80 20G-4 0.00017 0.00008 0.00008 0.00000
|
|
81 21H 0 0.00000 0.00000 0.00000 0.00000
|
|
82 21H+1 0.00000 0.00000 0.00000 0.00000
|
|
83 21H-1 0.00000 0.00000 0.00000 0.00000
|
|
84 21H+2 0.00000 0.00000 0.00000 0.00000
|
|
85 21H-2 0.00000 0.00000 0.00000 0.00000
|
|
86 21H+3 0.00000 0.00000 0.00000 0.00000
|
|
87 21H-3 0.00000 0.00000 0.00000 0.00000
|
|
88 21H+4 0.00002 0.00001 0.00001 0.00000
|
|
89 21H-4 0.00002 0.00001 0.00001 0.00000
|
|
90 21H+5 0.00000 0.00000 0.00000 0.00000
|
|
91 21H-5 0.00000 0.00000 0.00000 0.00000
|
|
92 2 H 1S 0.03575 0.01787 0.01787 0.00000
|
|
93 2S 0.15021 0.07511 0.07511 0.00000
|
|
94 3S 0.33412 0.16706 0.16706 0.00000
|
|
95 4S 0.18681 0.09341 0.09341 0.00000
|
|
96 5S 0.01542 0.00771 0.00771 0.00000
|
|
97 6PX 0.00005 0.00003 0.00003 0.00000
|
|
98 6PY 0.00034 0.00017 0.00017 0.00000
|
|
99 6PZ 0.00015 0.00007 0.00007 0.00000
|
|
100 7PX 0.00060 0.00030 0.00030 0.00000
|
|
101 7PY 0.00291 0.00146 0.00146 0.00000
|
|
102 7PZ 0.00129 0.00065 0.00065 0.00000
|
|
103 8PX 0.00534 0.00267 0.00267 0.00000
|
|
104 8PY 0.01304 0.00652 0.00652 0.00000
|
|
105 8PZ 0.01177 0.00588 0.00588 0.00000
|
|
106 9PX 0.01157 0.00579 0.00579 0.00000
|
|
107 9PY 0.00000 0.00000 0.00000 0.00000
|
|
108 9PZ 0.02710 0.01355 0.01355 0.00000
|
|
109 10D 0 0.00003 0.00002 0.00002 0.00000
|
|
110 10D+1 0.00000 0.00000 0.00000 0.00000
|
|
111 10D-1 0.00007 0.00003 0.00003 0.00000
|
|
112 10D+2 0.00006 0.00003 0.00003 0.00000
|
|
113 10D-2 0.00004 0.00002 0.00002 0.00000
|
|
114 11D 0 0.00027 0.00014 0.00014 0.00000
|
|
115 11D+1 0.00001 0.00001 0.00001 0.00000
|
|
116 11D-1 0.00076 0.00038 0.00038 0.00000
|
|
117 11D+2 0.00053 0.00027 0.00027 0.00000
|
|
118 11D-2 0.00036 0.00018 0.00018 0.00000
|
|
119 12D 0 0.00036 0.00018 0.00018 0.00000
|
|
120 12D+1 0.00015 0.00007 0.00007 0.00000
|
|
121 12D-1 0.00476 0.00238 0.00238 0.00000
|
|
122 12D+2 -0.00022 -0.00011 -0.00011 0.00000
|
|
123 12D-2 0.00274 0.00137 0.00137 0.00000
|
|
124 13F 0 0.00001 0.00000 0.00000 0.00000
|
|
125 13F+1 0.00000 0.00000 0.00000 0.00000
|
|
126 13F-1 0.00002 0.00001 0.00001 0.00000
|
|
127 13F+2 0.00002 0.00001 0.00001 0.00000
|
|
128 13F-2 0.00000 0.00000 0.00000 0.00000
|
|
129 13F+3 0.00001 0.00001 0.00001 0.00000
|
|
130 13F-3 0.00002 0.00001 0.00001 0.00000
|
|
131 14F 0 0.00009 0.00004 0.00004 0.00000
|
|
132 14F+1 0.00001 0.00001 0.00001 0.00000
|
|
133 14F-1 0.00006 0.00003 0.00003 0.00000
|
|
134 14F+2 0.00024 0.00012 0.00012 0.00000
|
|
135 14F-2 0.00001 0.00001 0.00001 0.00000
|
|
136 14F+3 0.00012 0.00006 0.00006 0.00000
|
|
137 14F-3 -0.00010 -0.00005 -0.00005 0.00000
|
|
138 15G 0 0.00000 0.00000 0.00000 0.00000
|
|
139 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
140 15G-1 0.00000 0.00000 0.00000 0.00000
|
|
141 15G+2 0.00000 0.00000 0.00000 0.00000
|
|
142 15G-2 0.00000 0.00000 0.00000 0.00000
|
|
143 15G+3 0.00000 0.00000 0.00000 0.00000
|
|
144 15G-3 0.00001 0.00000 0.00000 0.00000
|
|
145 15G+4 0.00000 0.00000 0.00000 0.00000
|
|
146 15G-4 0.00000 0.00000 0.00000 0.00000
|
|
147 3 H 1S 0.03575 0.01787 0.01787 0.00000
|
|
148 2S 0.15021 0.07511 0.07511 0.00000
|
|
149 3S 0.33412 0.16706 0.16706 0.00000
|
|
150 4S 0.18681 0.09341 0.09341 0.00000
|
|
151 5S 0.01542 0.00771 0.00771 0.00000
|
|
152 6PX 0.00027 0.00013 0.00013 0.00000
|
|
153 6PY 0.00013 0.00006 0.00006 0.00000
|
|
154 6PZ 0.00015 0.00007 0.00007 0.00000
|
|
155 7PX 0.00233 0.00117 0.00117 0.00000
|
|
156 7PY 0.00118 0.00059 0.00059 0.00000
|
|
157 7PZ 0.00129 0.00065 0.00065 0.00000
|
|
158 8PX 0.01112 0.00556 0.00556 0.00000
|
|
159 8PY 0.00726 0.00363 0.00363 0.00000
|
|
160 8PZ 0.01177 0.00588 0.00588 0.00000
|
|
161 9PX 0.00289 0.00145 0.00145 0.00000
|
|
162 9PY 0.00868 0.00434 0.00434 0.00000
|
|
163 9PZ 0.02710 0.01355 0.01355 0.00000
|
|
164 10D 0 0.00003 0.00002 0.00002 0.00000
|
|
165 10D+1 0.00005 0.00003 0.00003 0.00000
|
|
166 10D-1 0.00002 0.00001 0.00001 0.00000
|
|
167 10D+2 0.00005 0.00002 0.00002 0.00000
|
|
168 10D-2 0.00006 0.00003 0.00003 0.00000
|
|
169 11D 0 0.00027 0.00014 0.00014 0.00000
|
|
170 11D+1 0.00057 0.00029 0.00029 0.00000
|
|
171 11D-1 0.00020 0.00010 0.00010 0.00000
|
|
172 11D+2 0.00040 0.00020 0.00020 0.00000
|
|
173 11D-2 0.00049 0.00024 0.00024 0.00000
|
|
174 12D 0 0.00036 0.00018 0.00018 0.00000
|
|
175 12D+1 0.00360 0.00180 0.00180 0.00000
|
|
176 12D-1 0.00130 0.00065 0.00065 0.00000
|
|
177 12D+2 0.00200 0.00100 0.00100 0.00000
|
|
178 12D-2 0.00052 0.00026 0.00026 0.00000
|
|
179 13F 0 0.00001 0.00000 0.00000 0.00000
|
|
180 13F+1 0.00002 0.00001 0.00001 0.00000
|
|
181 13F-1 0.00001 0.00000 0.00000 0.00000
|
|
182 13F+2 0.00001 0.00000 0.00000 0.00000
|
|
183 13F-2 0.00002 0.00001 0.00001 0.00000
|
|
184 13F+3 0.00001 0.00001 0.00001 0.00000
|
|
185 13F-3 0.00002 0.00001 0.00001 0.00000
|
|
186 14F 0 0.00009 0.00004 0.00004 0.00000
|
|
187 14F+1 0.00005 0.00002 0.00002 0.00000
|
|
188 14F-1 0.00002 0.00001 0.00001 0.00000
|
|
189 14F+2 0.00007 0.00003 0.00003 0.00000
|
|
190 14F-2 0.00018 0.00009 0.00009 0.00000
|
|
191 14F+3 0.00012 0.00006 0.00006 0.00000
|
|
192 14F-3 -0.00010 -0.00005 -0.00005 0.00000
|
|
193 15G 0 0.00000 0.00000 0.00000 0.00000
|
|
194 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
195 15G-1 0.00000 0.00000 0.00000 0.00000
|
|
196 15G+2 0.00000 0.00000 0.00000 0.00000
|
|
197 15G-2 0.00000 0.00000 0.00000 0.00000
|
|
198 15G+3 0.00000 0.00000 0.00000 0.00000
|
|
199 15G-3 0.00001 0.00000 0.00000 0.00000
|
|
200 15G+4 0.00000 0.00000 0.00000 0.00000
|
|
201 15G-4 0.00000 0.00000 0.00000 0.00000
|
|
202 4 H 1S 0.03575 0.01787 0.01787 0.00000
|
|
203 2S 0.15021 0.07511 0.07511 0.00000
|
|
204 3S 0.33412 0.16706 0.16706 0.00000
|
|
205 4S 0.18681 0.09341 0.09341 0.00000
|
|
206 5S 0.01542 0.00771 0.00771 0.00000
|
|
207 6PX 0.00027 0.00013 0.00013 0.00000
|
|
208 6PY 0.00013 0.00006 0.00006 0.00000
|
|
209 6PZ 0.00015 0.00007 0.00007 0.00000
|
|
210 7PX 0.00233 0.00117 0.00117 0.00000
|
|
211 7PY 0.00118 0.00059 0.00059 0.00000
|
|
212 7PZ 0.00129 0.00065 0.00065 0.00000
|
|
213 8PX 0.01112 0.00556 0.00556 0.00000
|
|
214 8PY 0.00726 0.00363 0.00363 0.00000
|
|
215 8PZ 0.01177 0.00588 0.00588 0.00000
|
|
216 9PX 0.00289 0.00145 0.00145 0.00000
|
|
217 9PY 0.00868 0.00434 0.00434 0.00000
|
|
218 9PZ 0.02710 0.01355 0.01355 0.00000
|
|
219 10D 0 0.00003 0.00002 0.00002 0.00000
|
|
220 10D+1 0.00005 0.00003 0.00003 0.00000
|
|
221 10D-1 0.00002 0.00001 0.00001 0.00000
|
|
222 10D+2 0.00005 0.00002 0.00002 0.00000
|
|
223 10D-2 0.00006 0.00003 0.00003 0.00000
|
|
224 11D 0 0.00027 0.00014 0.00014 0.00000
|
|
225 11D+1 0.00057 0.00029 0.00029 0.00000
|
|
226 11D-1 0.00020 0.00010 0.00010 0.00000
|
|
227 11D+2 0.00040 0.00020 0.00020 0.00000
|
|
228 11D-2 0.00049 0.00024 0.00024 0.00000
|
|
229 12D 0 0.00036 0.00018 0.00018 0.00000
|
|
230 12D+1 0.00360 0.00180 0.00180 0.00000
|
|
231 12D-1 0.00130 0.00065 0.00065 0.00000
|
|
232 12D+2 0.00200 0.00100 0.00100 0.00000
|
|
233 12D-2 0.00052 0.00026 0.00026 0.00000
|
|
234 13F 0 0.00001 0.00000 0.00000 0.00000
|
|
235 13F+1 0.00002 0.00001 0.00001 0.00000
|
|
236 13F-1 0.00001 0.00000 0.00000 0.00000
|
|
237 13F+2 0.00001 0.00000 0.00000 0.00000
|
|
238 13F-2 0.00002 0.00001 0.00001 0.00000
|
|
239 13F+3 0.00001 0.00001 0.00001 0.00000
|
|
240 13F-3 0.00002 0.00001 0.00001 0.00000
|
|
241 14F 0 0.00009 0.00004 0.00004 0.00000
|
|
242 14F+1 0.00005 0.00002 0.00002 0.00000
|
|
243 14F-1 0.00002 0.00001 0.00001 0.00000
|
|
244 14F+2 0.00007 0.00003 0.00003 0.00000
|
|
245 14F-2 0.00018 0.00009 0.00009 0.00000
|
|
246 14F+3 0.00012 0.00006 0.00006 0.00000
|
|
247 14F-3 -0.00010 -0.00005 -0.00005 0.00000
|
|
248 15G 0 0.00000 0.00000 0.00000 0.00000
|
|
249 15G+1 0.00000 0.00000 0.00000 0.00000
|
|
250 15G-1 0.00000 0.00000 0.00000 0.00000
|
|
251 15G+2 0.00000 0.00000 0.00000 0.00000
|
|
252 15G-2 0.00000 0.00000 0.00000 0.00000
|
|
253 15G+3 0.00000 0.00000 0.00000 0.00000
|
|
254 15G-3 0.00001 0.00000 0.00000 0.00000
|
|
255 15G+4 0.00000 0.00000 0.00000 0.00000
|
|
256 15G-4 0.00000 0.00000 0.00000 0.00000
|
|
Condensed to atoms (all electrons):
|
|
1 2 3 4
|
|
1 N 6.299601 0.426521 0.426521 0.426521
|
|
2 H 0.426521 0.444387 -0.031982 -0.031982
|
|
3 H 0.426521 -0.031982 0.444387 -0.031982
|
|
4 H 0.426521 -0.031982 -0.031982 0.444387
|
|
Atomic-Atomic Spin Densities.
|
|
1 2 3 4
|
|
1 N 0.000000 0.000000 0.000000 0.000000
|
|
2 H 0.000000 0.000000 0.000000 0.000000
|
|
3 H 0.000000 0.000000 0.000000 0.000000
|
|
4 H 0.000000 0.000000 0.000000 0.000000
|
|
Mulliken charges and spin densities:
|
|
1 2
|
|
1 N -0.579165 0.000000
|
|
2 H 0.193055 0.000000
|
|
3 H 0.193055 0.000000
|
|
4 H 0.193055 0.000000
|
|
Sum of Mulliken charges = 0.00000 0.00000
|
|
Mulliken charges and spin densities with hydrogens summed into heavy atoms:
|
|
1 2
|
|
1 N 0.000000 0.000000
|
|
Electronic spatial extent (au): <R**2>= 26.6773
|
|
Charge= 0.0000 electrons
|
|
Dipole moment (field-independent basis, Debye):
|
|
X= 0.0000 Y= 0.0000 Z= -1.6866 Tot= 1.6866
|
|
Quadrupole moment (field-independent basis, Debye-Ang):
|
|
XX= -6.2464 YY= -6.2464 ZZ= -9.1772
|
|
XY= 0.0000 XZ= 0.0000 YZ= 0.0000
|
|
Traceless Quadrupole moment (field-independent basis, Debye-Ang):
|
|
XX= 0.9769 YY= 0.9769 ZZ= -1.9539
|
|
XY= 0.0000 XZ= 0.0000 YZ= 0.0000
|
|
Octapole moment (field-independent basis, Debye-Ang**2):
|
|
XXX= 0.0000 YYY= 0.9402 ZZZ= -1.4800 XYY= 0.0000
|
|
XXY= -0.9402 XXZ= -0.9397 XZZ= 0.0000 YZZ= 0.0000
|
|
YYZ= -0.9397 XYZ= 0.0000
|
|
Hexadecapole moment (field-independent basis, Debye-Ang**3):
|
|
XXXX= -9.9179 YYYY= -9.9179 ZZZZ= -12.0057 XXXY= 0.0000
|
|
XXXZ= 0.0000 YYYX= 0.0000 YYYZ= -0.3868 ZZZX= 0.0000
|
|
ZZZY= 0.0000 XXYY= -3.3060 XXZZ= -3.7378 YYZZ= -3.7378
|
|
XXYZ= 0.3868 YYXZ= 0.0000 ZZXY= 0.0000
|
|
N-N= 1.190567219859D+01 E-N=-1.556690269007D+02 KE= 5.613969708360D+01
|
|
Symmetry A' KE= 5.353024285903D+01
|
|
Symmetry A" KE= 2.609454224571D+00
|
|
Orbital energies and kinetic energies (alpha):
|
|
1 2
|
|
1 (A1)--O -15.541817 22.124651
|
|
2 (A1)--O -1.141337 1.778778
|
|
3 (E)--O -0.624431 1.304727
|
|
4 (E)--O -0.624431 1.304727
|
|
5 (A1)--O -0.433119 1.556965
|
|
6 (A1)--V 0.091912 0.290100
|
|
7 (E)--V 0.143172 0.268292
|
|
8 (E)--V 0.143172 0.268292
|
|
9 (A1)--V 0.261683 0.486264
|
|
10 (E)--V 0.282982 0.367084
|
|
11 (E)--V 0.282982 0.367084
|
|
12 (A1)--V 0.426955 0.880886
|
|
13 (E)--V 0.459604 0.634993
|
|
14 (E)--V 0.459604 0.634993
|
|
15 (A1)--V 0.467974 0.861250
|
|
16 (E)--V 0.489113 1.123889
|
|
17 (E)--V 0.489113 1.123889
|
|
18 (A1)--V 0.688754 0.953455
|
|
19 (E)--V 0.712246 0.870856
|
|
20 (E)--V 0.712246 0.870856
|
|
21 (A2)--V 0.716522 0.775355
|
|
22 (E)--V 0.804146 0.927734
|
|
23 (E)--V 0.804146 0.927734
|
|
24 (E)--V 0.883523 1.004393
|
|
25 (E)--V 0.883523 1.004393
|
|
26 (A1)--V 0.886372 1.120543
|
|
27 (A1)--V 0.983719 1.211199
|
|
28 (E)--V 1.026585 1.173576
|
|
29 (E)--V 1.026585 1.173576
|
|
30 (A1)--V 1.157669 2.212261
|
|
31 (E)--V 1.242570 2.260788
|
|
32 (E)--V 1.242570 2.260788
|
|
33 (A1)--V 1.323263 1.925116
|
|
34 (E)--V 1.519490 1.876207
|
|
35 (E)--V 1.519490 1.876207
|
|
36 (A1)--V 1.640324 2.020115
|
|
37 (A2)--V 1.707165 1.859386
|
|
38 (E)--V 1.777352 1.974781
|
|
39 (E)--V 1.777352 1.974781
|
|
40 (E)--V 1.787852 1.900329
|
|
41 (E)--V 1.787852 1.900329
|
|
42 (A2)--V 1.835365 1.958839
|
|
43 (E)--V 1.883016 2.026793
|
|
44 (E)--V 1.883016 2.026793
|
|
45 (A1)--V 1.910488 2.116379
|
|
46 (E)--V 1.958865 2.152087
|
|
47 (E)--V 1.958865 2.152087
|
|
48 (E)--V 2.022850 2.203526
|
|
49 (E)--V 2.022850 2.203526
|
|
50 (A1)--V 2.053096 2.534935
|
|
51 (E)--V 2.153825 2.474965
|
|
52 (E)--V 2.153825 2.474965
|
|
53 (A1)--V 2.194971 2.783160
|
|
54 (A1)--V 2.280768 2.454779
|
|
55 (E)--V 2.404171 2.664469
|
|
56 (E)--V 2.404171 2.664469
|
|
57 (A2)--V 2.576060 2.724854
|
|
58 (E)--V 2.603395 2.810156
|
|
59 (E)--V 2.603395 2.810156
|
|
60 (A1)--V 2.693011 2.937034
|
|
61 (E)--V 2.715463 3.059874
|
|
62 (E)--V 2.715463 3.059874
|
|
63 (A1)--V 2.771938 4.002576
|
|
64 (E)--V 2.865965 3.749116
|
|
65 (E)--V 2.865965 3.749116
|
|
66 (A1)--V 2.900538 3.778127
|
|
67 (A2)--V 2.948247 3.081697
|
|
68 (A1)--V 3.333617 3.865471
|
|
69 (E)--V 3.434572 3.891531
|
|
70 (E)--V 3.434572 3.891531
|
|
71 (E)--V 3.569722 4.468009
|
|
72 (E)--V 3.569722 4.468009
|
|
73 (A1)--V 3.647959 4.667619
|
|
74 (E)--V 3.730809 4.067838
|
|
75 (E)--V 3.730809 4.067838
|
|
76 (E)--V 3.930930 4.521905
|
|
77 (E)--V 3.930930 4.521905
|
|
78 (E)--V 4.082300 4.232650
|
|
79 (E)--V 4.082300 4.232650
|
|
80 (A1)--V 4.246634 4.801856
|
|
81 (A2)--V 4.297676 4.434366
|
|
82 (E)--V 4.374135 4.666600
|
|
83 (E)--V 4.374135 4.666600
|
|
84 (A1)--V 4.433311 5.224165
|
|
85 (E)--V 4.523883 4.882115
|
|
86 (E)--V 4.523883 4.882115
|
|
87 (A2)--V 4.551130 4.872918
|
|
88 (E)--V 4.642054 4.965562
|
|
89 (E)--V 4.642054 4.965562
|
|
90 (E)--V 4.743888 4.987676
|
|
91 (E)--V 4.743888 4.987676
|
|
92 (A1)--V 4.806411 5.077140
|
|
93 (A1)--V 4.943208 5.186897
|
|
94 (A1)--V 4.955220 5.294398
|
|
95 (E)--V 4.983747 5.672364
|
|
96 (E)--V 4.983747 5.672364
|
|
97 (A2)--V 4.993556 5.256482
|
|
98 (E)--V 5.051335 5.261654
|
|
99 (E)--V 5.051335 5.261654
|
|
100 (E)--V 5.176725 5.461164
|
|
101 (E)--V 5.176725 5.461164
|
|
102 (A2)--V 5.248004 5.596735
|
|
103 (E)--V 5.271434 5.824366
|
|
104 (E)--V 5.271434 5.824366
|
|
105 (A1)--V 5.301274 6.198854
|
|
106 (E)--V 5.478652 6.167250
|
|
107 (E)--V 5.478652 6.167250
|
|
108 (A2)--V 5.519662 5.703567
|
|
109 (A1)--V 5.584511 6.089905
|
|
110 (E)--V 5.807096 6.225500
|
|
111 (E)--V 5.807096 6.225500
|
|
112 (A1)--V 5.921177 7.061074
|
|
113 (E)--V 5.986034 6.818724
|
|
114 (E)--V 5.986034 6.818724
|
|
115 (A1)--V 6.145908 6.744995
|
|
116 (A2)--V 6.186648 6.525354
|
|
117 (E)--V 6.200505 6.746181
|
|
118 (E)--V 6.200505 6.746181
|
|
119 (A1)--V 6.281874 8.635519
|
|
120 (A1)--V 6.564519 7.080750
|
|
121 (E)--V 6.595717 6.980660
|
|
122 (E)--V 6.595717 6.980660
|
|
123 (A1)--V 6.616983 7.051140
|
|
124 (E)--V 6.937969 7.688109
|
|
125 (E)--V 6.937969 7.688109
|
|
126 (E)--V 6.959932 7.983374
|
|
127 (E)--V 6.959932 7.983374
|
|
128 (E)--V 7.146565 7.683281
|
|
129 (E)--V 7.146565 7.683281
|
|
130 (A1)--V 7.384484 9.003013
|
|
131 (A2)--V 7.443605 7.872549
|
|
132 (E)--V 7.469499 8.260840
|
|
133 (E)--V 7.469499 8.260840
|
|
134 (E)--V 8.028166 9.243206
|
|
135 (E)--V 8.028166 9.243206
|
|
136 (A1)--V 8.157642 9.053504
|
|
137 (E)--V 8.503186 9.593946
|
|
138 (E)--V 8.503186 9.593946
|
|
139 (E)--V 8.569005 9.265377
|
|
140 (E)--V 8.569005 9.265377
|
|
141 (A2)--V 8.692107 9.460037
|
|
142 (A1)--V 8.947173 10.153225
|
|
143 (E)--V 9.053138 10.144847
|
|
144 (E)--V 9.053138 10.144847
|
|
145 (E)--V 10.987750 11.609344
|
|
146 (E)--V 10.987750 11.609344
|
|
147 (E)--V 11.116376 11.869067
|
|
148 (E)--V 11.116376 11.869067
|
|
149 (A1)--V 11.116819 17.036419
|
|
150 (A2)--V 11.450497 12.102164
|
|
151 (A1)--V 11.541363 12.272608
|
|
152 (E)--V 11.918307 12.852767
|
|
153 (E)--V 11.918307 12.852767
|
|
154 (A1)--V 11.932468 13.551217
|
|
155 (E)--V 12.108628 14.242527
|
|
156 (E)--V 12.108628 14.242527
|
|
157 (A1)--V 12.500836 13.602034
|
|
158 (E)--V 12.554344 13.009334
|
|
159 (E)--V 12.554344 13.009334
|
|
160 (A2)--V 12.626654 13.011068
|
|
161 (E)--V 12.642392 13.192005
|
|
162 (E)--V 12.642392 13.192005
|
|
163 (E)--V 12.674311 13.382672
|
|
164 (E)--V 12.674311 13.382672
|
|
165 (A1)--V 12.710091 13.261462
|
|
166 (E)--V 12.763693 14.415501
|
|
167 (E)--V 12.763693 14.415501
|
|
168 (A1)--V 12.778346 13.433163
|
|
169 (A2)--V 12.798051 13.200182
|
|
170 (E)--V 12.950095 13.789806
|
|
171 (E)--V 12.950095 13.789806
|
|
172 (E)--V 13.182397 13.989471
|
|
173 (E)--V 13.182397 13.989471
|
|
174 (A2)--V 13.261706 13.669918
|
|
175 (A1)--V 13.318042 14.460188
|
|
176 (A2)--V 13.354183 14.140709
|
|
177 (A1)--V 13.367790 16.971204
|
|
178 (E)--V 13.423817 14.010154
|
|
179 (E)--V 13.423817 14.010154
|
|
180 (E)--V 13.576098 14.185591
|
|
181 (E)--V 13.576098 14.185591
|
|
182 (A1)--V 13.638553 14.292169
|
|
183 (A2)--V 13.647926 14.242420
|
|
184 (E)--V 13.688293 14.832236
|
|
185 (E)--V 13.688293 14.832236
|
|
186 (E)--V 13.780548 14.604631
|
|
187 (E)--V 13.780548 14.604631
|
|
188 (A1)--V 13.829779 14.716337
|
|
189 (E)--V 13.849893 14.517526
|
|
190 (E)--V 13.849893 14.517526
|
|
191 (A2)--V 13.879811 14.529394
|
|
192 (E)--V 13.989994 15.003235
|
|
193 (E)--V 13.989994 15.003235
|
|
194 (A1)--V 14.074166 15.065851
|
|
195 (E)--V 14.115831 14.797170
|
|
196 (E)--V 14.115831 14.797170
|
|
197 (E)--V 14.248012 15.404973
|
|
198 (E)--V 14.248012 15.404973
|
|
199 (A1)--V 14.429935 16.116975
|
|
200 (A1)--V 14.528913 16.381912
|
|
201 (E)--V 14.674093 15.418857
|
|
202 (E)--V 14.674093 15.418857
|
|
203 (A2)--V 14.744324 15.397290
|
|
204 (E)--V 14.756858 15.937064
|
|
205 (E)--V 14.756858 15.937064
|
|
206 (E)--V 14.950466 15.790273
|
|
207 (E)--V 14.950466 15.790273
|
|
208 (A2)--V 14.972341 15.871859
|
|
209 (A1)--V 14.972474 16.382054
|
|
210 (E)--V 15.028287 16.911349
|
|
211 (E)--V 15.028287 16.911349
|
|
212 (A1)--V 15.380293 18.046427
|
|
213 (E)--V 15.591839 16.549882
|
|
214 (E)--V 15.591839 16.549882
|
|
215 (A1)--V 15.887421 17.530405
|
|
216 (E)--V 16.038550 17.818349
|
|
217 (E)--V 16.038550 17.818349
|
|
218 (A1)--V 16.234704 18.014245
|
|
219 (E)--V 16.380633 18.282306
|
|
220 (E)--V 16.380633 18.282306
|
|
221 (A1)--V 16.495972 17.692512
|
|
222 (A2)--V 16.738075 18.759764
|
|
223 (E)--V 16.742721 18.540848
|
|
224 (E)--V 16.742721 18.540848
|
|
225 (E)--V 16.946019 18.479632
|
|
226 (E)--V 16.946019 18.479632
|
|
227 (E)--V 16.986109 18.561641
|
|
228 (E)--V 16.986109 18.561641
|
|
229 (A1)--V 17.102010 18.300890
|
|
230 (E)--V 17.195728 18.293045
|
|
231 (E)--V 17.195728 18.293045
|
|
232 (A1)--V 17.216848 18.847173
|
|
233 (E)--V 17.376125 18.563664
|
|
234 (E)--V 17.376125 18.563664
|
|
235 (A2)--V 17.487531 18.284553
|
|
236 (E)--V 17.745591 19.482065
|
|
237 (E)--V 17.745591 19.482065
|
|
238 (A1)--V 17.998844 21.256613
|
|
239 (E)--V 18.018370 20.507755
|
|
240 (E)--V 18.018370 20.507755
|
|
241 (A2)--V 18.404681 19.627756
|
|
242 (E)--V 18.639613 21.206677
|
|
243 (E)--V 18.639613 21.206677
|
|
244 (E)--V 20.682287 22.090288
|
|
245 (E)--V 20.682287 22.090288
|
|
246 (A2)--V 20.689153 21.904299
|
|
247 (A1)--V 20.806965 22.919809
|
|
248 (E)--V 21.202637 23.748630
|
|
249 (E)--V 21.202637 23.748630
|
|
250 (A1)--V 21.249512 23.970918
|
|
251 (E)--V 21.985978 26.482878
|
|
252 (E)--V 21.985978 26.482878
|
|
253 (A1)--V 22.513995 25.999513
|
|
254 (E)--V 23.595886 26.865601
|
|
255 (E)--V 23.595886 26.865601
|
|
256 (A1)--V 54.073200 107.018998
|
|
Total kinetic energy from orbitals= 5.613969708360D+01
|
|
Isotropic Fermi Contact Couplings
|
|
Atom a.u. MegaHertz Gauss 10(-4) cm-1
|
|
1 N(14) 0.00000 0.00000 0.00000 0.00000
|
|
2 H(1) 0.00000 0.00000 0.00000 0.00000
|
|
3 H(1) 0.00000 0.00000 0.00000 0.00000
|
|
4 H(1) 0.00000 0.00000 0.00000 0.00000
|
|
--------------------------------------------------------
|
|
Center ---- Spin Dipole Couplings ----
|
|
3XX-RR 3YY-RR 3ZZ-RR
|
|
--------------------------------------------------------
|
|
1 Atom 0.000000 0.000000 0.000000
|
|
2 Atom 0.000000 0.000000 0.000000
|
|
3 Atom 0.000000 0.000000 0.000000
|
|
4 Atom 0.000000 0.000000 0.000000
|
|
--------------------------------------------------------
|
|
XY XZ YZ
|
|
--------------------------------------------------------
|
|
1 Atom 0.000000 0.000000 0.000000
|
|
2 Atom 0.000000 0.000000 0.000000
|
|
3 Atom 0.000000 0.000000 0.000000
|
|
4 Atom 0.000000 0.000000 0.000000
|
|
--------------------------------------------------------
|
|
|
|
|
|
---------------------------------------------------------------------------------
|
|
Anisotropic Spin Dipole Couplings in Principal Axis System
|
|
---------------------------------------------------------------------------------
|
|
|
|
Atom a.u. MegaHertz Gauss 10(-4) cm-1 Axes
|
|
|
|
Baa 0.0000 0.000 0.000 0.000 1.0000 0.0000 0.0000
|
|
1 N(14) Bbb 0.0000 0.000 0.000 0.000 0.0000 1.0000 0.0000
|
|
Bcc 0.0000 0.000 0.000 0.000 0.0000 0.0000 1.0000
|
|
|
|
Baa 0.0000 0.000 0.000 0.000 1.0000 0.0000 0.0000
|
|
2 H(1) Bbb 0.0000 0.000 0.000 0.000 0.0000 1.0000 0.0000
|
|
Bcc 0.0000 0.000 0.000 0.000 0.0000 0.0000 1.0000
|
|
|
|
Baa 0.0000 0.000 0.000 0.000 1.0000 0.0000 0.0000
|
|
3 H(1) Bbb 0.0000 0.000 0.000 0.000 0.0000 1.0000 0.0000
|
|
Bcc 0.0000 0.000 0.000 0.000 0.0000 0.0000 1.0000
|
|
|
|
Baa 0.0000 0.000 0.000 0.000 1.0000 0.0000 0.0000
|
|
4 H(1) Bbb 0.0000 0.000 0.000 0.000 0.0000 1.0000 0.0000
|
|
Bcc 0.0000 0.000 0.000 0.000 0.0000 0.0000 1.0000
|
|
|
|
|
|
---------------------------------------------------------------------------------
|
|
|
|
No NMR shielding tensors so no spin-rotation constants.
|
|
Leave Link 601 at Thu Apr 4 10:56:37 2019, MaxMem= 13421772800 cpu: 22.4
|
|
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l9999.exe)
|
|
1\1\GINC-COMPUTE-3-5\SP\ROCCSD(T)-FC\CC-pV5Z\H3N1\LOOS\04-Apr-2019\0\\
|
|
#p ROCCSD(T) cc-pV5Z pop=full gfprint\\G2\\0,1\N\X,1,1.\H,1,1.01719433
|
|
,2,113.26166981\H,1,1.01719433,2,113.26166981,3,120.,0\H,1,1.01719433,
|
|
2,113.26166981,3,240.,0\\Version=ES64L-G09RevD.01\State=1-A1\HF=-56.22
|
|
41278\MP2=-56.4824846\MP3=-56.4893083\PUHF=-56.2241278\PMP2-0=-56.4824
|
|
846\MP4SDQ=-56.4903717\CCSD=-56.4902038\CCSD(T)=-56.4993559\RMSD=2.280
|
|
e-09\PG=C03V [C3(N1),3SGV(H1)]\\@
|
|
|
|
|
|
DO YOU KNOW THAT THE LETTERS IN "EPISCOPAL", WHEN
|
|
REARRANGED, SPELL "PEPSI COLA"?
|
|
Job cpu time: 0 days 16 hours 19 minutes 11.9 seconds.
|
|
File lengths (MBytes): RWF= 2292 Int= 0 D2E= 0 Chk= 6 Scr= 1
|
|
Normal termination of Gaussian 09 at Thu Apr 4 10:56:37 2019.
|