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srDFT_G2/G09/Large_core/Molecules/v5z/CH4.out
Pierre-Francois Loos ca128a0e6d data
2019-04-04 11:10:45 +02:00

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Entering Gaussian System, Link 0=g09
Input=CH4.inp
Output=CH4.out
Initial command:
/share/apps/gaussian/g09d01/nehalem/g09/l1.exe "/mnt/beegfs/tmpdir/42440/Gau-123447.inp" -scrdir="/mnt/beegfs/tmpdir/42440/"
Entering Link 1 = /share/apps/gaussian/g09d01/nehalem/g09/l1.exe PID= 123448.
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
2-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 Tue Apr 2 22:30:43 2019, MaxMem= 13421772800 cpu: 1.4
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l101.exe)
--
G2
--
Symbolic Z-matrix:
Charge = 0 Multiplicity = 1
C
H 1 RCH
H 1 RCH 2 109.47122
H 1 RCH 2 109.47122 3 109.47122 1
H 1 RCH 2 109.47122 3 109.47122 -1
Variables:
RCH 1.09185
5 tetrahedral angles replaced.
NAtoms= 5 NQM= 5 NQMF= 0 NMMI= 0 NMMIF= 0
NMic= 0 NMicF= 0.
5 tetrahedral angles replaced.
Isotopes and Nuclear Properties:
(Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
in nuclear magnetons)
Atom 1 2 3 4 5
IAtWgt= 12 1 1 1 1
AtmWgt= 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250
NucSpn= 0 1 1 1 1
AtZEff= 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
NQMom= 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
NMagM= 0.0000000 2.7928460 2.7928460 2.7928460 2.7928460
AtZNuc= 6.0000000 1.0000000 1.0000000 1.0000000 1.0000000
Leave Link 101 at Tue Apr 2 22:30:43 2019, MaxMem= 13421772800 cpu: 1.3
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l202.exe)
Input orientation:
---------------------------------------------------------------------
Center Atomic Atomic Coordinates (Angstroms)
Number Number Type X Y Z
---------------------------------------------------------------------
1 6 0 0.000000 0.000000 0.000000
2 1 0 0.000000 0.000000 1.091854
3 1 0 1.029410 0.000000 -0.363951
4 1 0 -0.514705 0.891495 -0.363951
5 1 0 -0.514705 -0.891495 -0.363951
---------------------------------------------------------------------
Distance matrix (angstroms):
1 2 3 4 5
1 C 0.000000
2 H 1.091854 0.000000
3 H 1.091854 1.782990 0.000000
4 H 1.091854 1.782990 1.782990 0.000000
5 H 1.091854 1.782990 1.782990 1.782990 0.000000
Stoichiometry CH4
Framework group TD[O(C),4C3(H)]
Deg. of freedom 1
Full point group TD NOp 24
Largest Abelian subgroup D2 NOp 4
Largest concise Abelian subgroup D2 NOp 4
Standard orientation:
---------------------------------------------------------------------
Center Atomic Atomic Coordinates (Angstroms)
Number Number Type X Y Z
---------------------------------------------------------------------
1 6 0 0.000000 0.000000 0.000000
2 1 0 0.630382 0.630382 0.630382
3 1 0 -0.630382 -0.630382 0.630382
4 1 0 0.630382 -0.630382 -0.630382
5 1 0 -0.630382 0.630382 -0.630382
---------------------------------------------------------------------
Rotational constants (GHZ): 157.7371648 157.7371648 157.7371648
Leave Link 202 at Tue Apr 2 22:30:43 2019, MaxMem= 13421772800 cpu: 0.5
(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 114 were deleted.
AO basis set (Overlap normalization):
Atom C1 Shell 1 S 9 bf 1 - 1 0.000000000000 0.000000000000 0.000000000000
0.9677000000D+05 0.4625203266D-04
0.1450000000D+05 0.3324069183D-03
0.3300000000D+04 0.1767277677D-02
0.9358000000D+03 0.7354171702D-02
0.3062000000D+03 0.2611963959D-01
0.1113000000D+03 0.7807287867D-01
0.4390000000D+02 0.1959607249D+00
0.1840000000D+02 0.3683568961D+00
0.8054000000D+01 0.4404591813D+00
Atom C1 Shell 2 S 7 bf 2 - 2 0.000000000000 0.000000000000 0.000000000000
0.9358000000D+03 -0.5149307386D-04
0.3062000000D+03 -0.1884316386D-03
0.1113000000D+03 -0.2667334384D-02
0.4390000000D+02 -0.1333849355D-01
0.1840000000D+02 -0.7549891227D-01
0.8054000000D+01 -0.2599952349D+00
0.3637000000D+01 -0.6974918333D+00
Atom C1 Shell 3 S 1 bf 3 - 3 0.000000000000 0.000000000000 0.000000000000
0.1656000000D+01 0.1000000000D+01
Atom C1 Shell 4 S 1 bf 4 - 4 0.000000000000 0.000000000000 0.000000000000
0.6333000000D+00 0.1000000000D+01
Atom C1 Shell 5 S 1 bf 5 - 5 0.000000000000 0.000000000000 0.000000000000
0.2545000000D+00 0.1000000000D+01
Atom C1 Shell 6 S 1 bf 6 - 6 0.000000000000 0.000000000000 0.000000000000
0.1019000000D+00 0.1000000000D+01
Atom C1 Shell 7 P 4 bf 7 - 9 0.000000000000 0.000000000000 0.000000000000
0.1018000000D+03 0.6748259919D-02
0.2404000000D+02 0.5283486105D-01
0.7571000000D+01 0.2398548186D+00
0.2732000000D+01 0.7877211236D+00
Atom C1 Shell 8 P 1 bf 10 - 12 0.000000000000 0.000000000000 0.000000000000
0.1085000000D+01 0.1000000000D+01
Atom C1 Shell 9 P 1 bf 13 - 15 0.000000000000 0.000000000000 0.000000000000
0.4496000000D+00 0.1000000000D+01
Atom C1 Shell 10 P 1 bf 16 - 18 0.000000000000 0.000000000000 0.000000000000
0.1876000000D+00 0.1000000000D+01
Atom C1 Shell 11 P 1 bf 19 - 21 0.000000000000 0.000000000000 0.000000000000
0.7606000000D-01 0.1000000000D+01
Atom C1 Shell 12 D 1 bf 22 - 26 0.000000000000 0.000000000000 0.000000000000
0.3134000000D+01 0.1000000000D+01
Atom C1 Shell 13 D 1 bf 27 - 31 0.000000000000 0.000000000000 0.000000000000
0.1233000000D+01 0.1000000000D+01
Atom C1 Shell 14 D 1 bf 32 - 36 0.000000000000 0.000000000000 0.000000000000
0.4850000000D+00 0.1000000000D+01
Atom C1 Shell 15 D 1 bf 37 - 41 0.000000000000 0.000000000000 0.000000000000
0.1910000000D+00 0.1000000000D+01
Atom C1 Shell 16 F 1 bf 42 - 48 0.000000000000 0.000000000000 0.000000000000
0.2006000000D+01 0.1000000000D+01
Atom C1 Shell 17 F 1 bf 49 - 55 0.000000000000 0.000000000000 0.000000000000
0.8380000000D+00 0.1000000000D+01
Atom C1 Shell 18 F 1 bf 56 - 62 0.000000000000 0.000000000000 0.000000000000
0.3500000000D+00 0.1000000000D+01
Atom C1 Shell 19 G 1 bf 63 - 71 0.000000000000 0.000000000000 0.000000000000
0.1753000000D+01 0.1000000000D+01
Atom C1 Shell 20 G 1 bf 72 - 80 0.000000000000 0.000000000000 0.000000000000
0.6780000000D+00 0.1000000000D+01
Atom C1 Shell 21 H 1 bf 81 - 91 0.000000000000 0.000000000000 0.000000000000
0.1259000000D+01 0.1000000000D+01
Atom H2 Shell 22 S 4 bf 92 - 92 1.191249925884 1.191249925884 1.191249925884
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 1.191249925884 1.191249925884 1.191249925884
0.1283000000D+01 0.1000000000D+01
Atom H2 Shell 24 S 1 bf 94 - 94 1.191249925884 1.191249925884 1.191249925884
0.4655000000D+00 0.1000000000D+01
Atom H2 Shell 25 S 1 bf 95 - 95 1.191249925884 1.191249925884 1.191249925884
0.1811000000D+00 0.1000000000D+01
Atom H2 Shell 26 S 1 bf 96 - 96 1.191249925884 1.191249925884 1.191249925884
0.7279000000D-01 0.1000000000D+01
Atom H2 Shell 27 P 1 bf 97 - 99 1.191249925884 1.191249925884 1.191249925884
0.4516000000D+01 0.1000000000D+01
Atom H2 Shell 28 P 1 bf 100 - 102 1.191249925884 1.191249925884 1.191249925884
0.1712000000D+01 0.1000000000D+01
Atom H2 Shell 29 P 1 bf 103 - 105 1.191249925884 1.191249925884 1.191249925884
0.6490000000D+00 0.1000000000D+01
Atom H2 Shell 30 P 1 bf 106 - 108 1.191249925884 1.191249925884 1.191249925884
0.2460000000D+00 0.1000000000D+01
Atom H2 Shell 31 D 1 bf 109 - 113 1.191249925884 1.191249925884 1.191249925884
0.2950000000D+01 0.1000000000D+01
Atom H2 Shell 32 D 1 bf 114 - 118 1.191249925884 1.191249925884 1.191249925884
0.1206000000D+01 0.1000000000D+01
Atom H2 Shell 33 D 1 bf 119 - 123 1.191249925884 1.191249925884 1.191249925884
0.4930000000D+00 0.1000000000D+01
Atom H2 Shell 34 F 1 bf 124 - 130 1.191249925884 1.191249925884 1.191249925884
0.2506000000D+01 0.1000000000D+01
Atom H2 Shell 35 F 1 bf 131 - 137 1.191249925884 1.191249925884 1.191249925884
0.8750000000D+00 0.1000000000D+01
Atom H2 Shell 36 G 1 bf 138 - 146 1.191249925884 1.191249925884 1.191249925884
0.2358000000D+01 0.1000000000D+01
Atom H3 Shell 37 S 4 bf 147 - 147 -1.191249925884 -1.191249925884 1.191249925884
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 -1.191249925884 -1.191249925884 1.191249925884
0.1283000000D+01 0.1000000000D+01
Atom H3 Shell 39 S 1 bf 149 - 149 -1.191249925884 -1.191249925884 1.191249925884
0.4655000000D+00 0.1000000000D+01
Atom H3 Shell 40 S 1 bf 150 - 150 -1.191249925884 -1.191249925884 1.191249925884
0.1811000000D+00 0.1000000000D+01
Atom H3 Shell 41 S 1 bf 151 - 151 -1.191249925884 -1.191249925884 1.191249925884
0.7279000000D-01 0.1000000000D+01
Atom H3 Shell 42 P 1 bf 152 - 154 -1.191249925884 -1.191249925884 1.191249925884
0.4516000000D+01 0.1000000000D+01
Atom H3 Shell 43 P 1 bf 155 - 157 -1.191249925884 -1.191249925884 1.191249925884
0.1712000000D+01 0.1000000000D+01
Atom H3 Shell 44 P 1 bf 158 - 160 -1.191249925884 -1.191249925884 1.191249925884
0.6490000000D+00 0.1000000000D+01
Atom H3 Shell 45 P 1 bf 161 - 163 -1.191249925884 -1.191249925884 1.191249925884
0.2460000000D+00 0.1000000000D+01
Atom H3 Shell 46 D 1 bf 164 - 168 -1.191249925884 -1.191249925884 1.191249925884
0.2950000000D+01 0.1000000000D+01
Atom H3 Shell 47 D 1 bf 169 - 173 -1.191249925884 -1.191249925884 1.191249925884
0.1206000000D+01 0.1000000000D+01
Atom H3 Shell 48 D 1 bf 174 - 178 -1.191249925884 -1.191249925884 1.191249925884
0.4930000000D+00 0.1000000000D+01
Atom H3 Shell 49 F 1 bf 179 - 185 -1.191249925884 -1.191249925884 1.191249925884
0.2506000000D+01 0.1000000000D+01
Atom H3 Shell 50 F 1 bf 186 - 192 -1.191249925884 -1.191249925884 1.191249925884
0.8750000000D+00 0.1000000000D+01
Atom H3 Shell 51 G 1 bf 193 - 201 -1.191249925884 -1.191249925884 1.191249925884
0.2358000000D+01 0.1000000000D+01
Atom H4 Shell 52 S 4 bf 202 - 202 1.191249925884 -1.191249925884 -1.191249925884
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 1.191249925884 -1.191249925884 -1.191249925884
0.1283000000D+01 0.1000000000D+01
Atom H4 Shell 54 S 1 bf 204 - 204 1.191249925884 -1.191249925884 -1.191249925884
0.4655000000D+00 0.1000000000D+01
Atom H4 Shell 55 S 1 bf 205 - 205 1.191249925884 -1.191249925884 -1.191249925884
0.1811000000D+00 0.1000000000D+01
Atom H4 Shell 56 S 1 bf 206 - 206 1.191249925884 -1.191249925884 -1.191249925884
0.7279000000D-01 0.1000000000D+01
Atom H4 Shell 57 P 1 bf 207 - 209 1.191249925884 -1.191249925884 -1.191249925884
0.4516000000D+01 0.1000000000D+01
Atom H4 Shell 58 P 1 bf 210 - 212 1.191249925884 -1.191249925884 -1.191249925884
0.1712000000D+01 0.1000000000D+01
Atom H4 Shell 59 P 1 bf 213 - 215 1.191249925884 -1.191249925884 -1.191249925884
0.6490000000D+00 0.1000000000D+01
Atom H4 Shell 60 P 1 bf 216 - 218 1.191249925884 -1.191249925884 -1.191249925884
0.2460000000D+00 0.1000000000D+01
Atom H4 Shell 61 D 1 bf 219 - 223 1.191249925884 -1.191249925884 -1.191249925884
0.2950000000D+01 0.1000000000D+01
Atom H4 Shell 62 D 1 bf 224 - 228 1.191249925884 -1.191249925884 -1.191249925884
0.1206000000D+01 0.1000000000D+01
Atom H4 Shell 63 D 1 bf 229 - 233 1.191249925884 -1.191249925884 -1.191249925884
0.4930000000D+00 0.1000000000D+01
Atom H4 Shell 64 F 1 bf 234 - 240 1.191249925884 -1.191249925884 -1.191249925884
0.2506000000D+01 0.1000000000D+01
Atom H4 Shell 65 F 1 bf 241 - 247 1.191249925884 -1.191249925884 -1.191249925884
0.8750000000D+00 0.1000000000D+01
Atom H4 Shell 66 G 1 bf 248 - 256 1.191249925884 -1.191249925884 -1.191249925884
0.2358000000D+01 0.1000000000D+01
Atom H5 Shell 67 S 4 bf 257 - 257 -1.191249925884 1.191249925884 -1.191249925884
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 H5 Shell 68 S 1 bf 258 - 258 -1.191249925884 1.191249925884 -1.191249925884
0.1283000000D+01 0.1000000000D+01
Atom H5 Shell 69 S 1 bf 259 - 259 -1.191249925884 1.191249925884 -1.191249925884
0.4655000000D+00 0.1000000000D+01
Atom H5 Shell 70 S 1 bf 260 - 260 -1.191249925884 1.191249925884 -1.191249925884
0.1811000000D+00 0.1000000000D+01
Atom H5 Shell 71 S 1 bf 261 - 261 -1.191249925884 1.191249925884 -1.191249925884
0.7279000000D-01 0.1000000000D+01
Atom H5 Shell 72 P 1 bf 262 - 264 -1.191249925884 1.191249925884 -1.191249925884
0.4516000000D+01 0.1000000000D+01
Atom H5 Shell 73 P 1 bf 265 - 267 -1.191249925884 1.191249925884 -1.191249925884
0.1712000000D+01 0.1000000000D+01
Atom H5 Shell 74 P 1 bf 268 - 270 -1.191249925884 1.191249925884 -1.191249925884
0.6490000000D+00 0.1000000000D+01
Atom H5 Shell 75 P 1 bf 271 - 273 -1.191249925884 1.191249925884 -1.191249925884
0.2460000000D+00 0.1000000000D+01
Atom H5 Shell 76 D 1 bf 274 - 278 -1.191249925884 1.191249925884 -1.191249925884
0.2950000000D+01 0.1000000000D+01
Atom H5 Shell 77 D 1 bf 279 - 283 -1.191249925884 1.191249925884 -1.191249925884
0.1206000000D+01 0.1000000000D+01
Atom H5 Shell 78 D 1 bf 284 - 288 -1.191249925884 1.191249925884 -1.191249925884
0.4930000000D+00 0.1000000000D+01
Atom H5 Shell 79 F 1 bf 289 - 295 -1.191249925884 1.191249925884 -1.191249925884
0.2506000000D+01 0.1000000000D+01
Atom H5 Shell 80 F 1 bf 296 - 302 -1.191249925884 1.191249925884 -1.191249925884
0.8750000000D+00 0.1000000000D+01
Atom H5 Shell 81 G 1 bf 303 - 311 -1.191249925884 1.191249925884 -1.191249925884
0.2358000000D+01 0.1000000000D+01
There are 106 symmetry adapted cartesian basis functions of A symmetry.
There are 100 symmetry adapted cartesian basis functions of B1 symmetry.
There are 100 symmetry adapted cartesian basis functions of B2 symmetry.
There are 100 symmetry adapted cartesian basis functions of B3 symmetry.
There are 80 symmetry adapted basis functions of A symmetry.
There are 77 symmetry adapted basis functions of B1 symmetry.
There are 77 symmetry adapted basis functions of B2 symmetry.
There are 77 symmetry adapted basis functions of B3 symmetry.
311 basis functions, 441 primitive gaussians, 406 cartesian basis functions
5 alpha electrons 5 beta electrons
nuclear repulsion energy 13.4125731779 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= 5 NActive= 5 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 Tue Apr 2 22:30:43 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= 311 RedAO= T EigKep= 1.98D-05 NBF= 80 77 77 77
NBsUse= 311 1.00D-06 EigRej= -1.00D+00 NBFU= 80 77 77 77
Leave Link 302 at Tue Apr 2 22:30:44 2019, MaxMem= 13421772800 cpu: 19.0
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l303.exe)
DipDrv: MaxL=1.
Leave Link 303 at Tue Apr 2 22:30:44 2019, MaxMem= 13421772800 cpu: 1.8
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l401.exe)
ExpMin= 7.28D-02 ExpMax= 9.68D+04 ExpMxC= 3.06D+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.
DSYEVD-2 returned Info= 161 IAlg= 4 N= 80 NDim= 311 NE2= 43155731 trying DSYEV.
Harris En= -40.4007788127555
JPrj=0 DoOrth=F DoCkMO=F.
Initial guess orbital symmetries:
Occupied (A1) (A1) (T2) (T2) (T2)
Virtual (A1) (T2) (T2) (T2) (T2) (T2) (T2) (T2) (T2) (T2)
(E) (E) (A1) (A1) (T2) (T2) (T2) (T1) (T1) (T1)
(T2) (T2) (T2) (T2) (T2) (T2) (A1) (T2) (T2) (T2)
(E) (E) (A1) (T2) (T2) (T2) (E) (E) (T1) (T1)
(T1) (A1) (T2) (T2) (T2) (T1) (T1) (T1) (T2) (T2)
(T2) (E) (E) (A1) (T2) (T2) (T2) (E) (E) (T2)
(T2) (T2) (T1) (T1) (T1) (T2) (T2) (T2) (A1) (T2)
(T2) (T2) (T1) (T1) (T1) (A1) (T2) (T2) (T2) (E)
(E) (T2) (T2) (T2) (T1) (T1) (T1) (T2) (T2) (T2)
(A1) (E) (E) (T2) (T2) (T2) (A1) (A2) (E) (E)
(T1) (T1) (T1) (T2) (T2) (T2) (T2) (T2) (T2) (T1)
(T1) (T1) (E) (E) (A1) (T1) (T1) (T1) (T2) (T2)
(T2) (A1) (T2) (T2) (T2) (T2) (T2) (T2) (T1) (T1)
(T1) (E) (E) (T2) (T2) (T2) (T1) (T1) (T1) (A1)
(E) (E) (T2) (T2) (T2) (T2) (T2) (T2) (A1) (E)
(E) (T1) (T1) (T1) (T2) (T2) (T2) (T2) (T2) (T2)
(T1) (T1) (T1) (E) (E) (A1) (T2) (T2) (T2) (T1)
(T1) (T1) (T2) (T2) (T2) (A1) (T2) (T2) (T2) (E)
(E) (E) (E) (T2) (T2) (T2) (T1) (T1) (T1) (A1)
(T2) (T2) (T2) (T2) (T2) (T2) (A1) (T1) (T1) (T1)
(E) (E) (A2) (T2) (T2) (T2) (T1) (T1) (T1) (E)
(E) (T1) (T1) (T1) (T2) (T2) (T2) (T2) (T2) (T2)
(A1) (A2) (T1) (T1) (T1) (T2) (T2) (T2) (E) (E)
(T2) (T2) (T2) (A1) (T1) (T1) (T1) (T2) (T2) (T2)
(T1) (T1) (T1) (E) (E) (T2) (T2) (T2) (A1) (E)
(E) (T1) (T1) (T1) (T2) (T2) (T2) (T1) (T1) (T1)
(T2) (T2) (T2) (E) (E) (A1) (T2) (T2) (T2) (A1)
(T2) (T2) (T2) (E) (E) (T1) (T1) (T1) (T2) (T2)
(T2) (T1) (T1) (T1) (T2) (T2) (T2) (E) (E) (T2)
(T2) (T2) (E) (E) (T1) (T1) (T1) (T2) (T2) (T2)
(A1) (A1) (T2) (T2) (T2) (A1)
The electronic state of the initial guess is 1-A1.
Leave Link 401 at Tue Apr 2 22:30:45 2019, MaxMem= 13421772800 cpu: 22.4
(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=1471815922.
IVT= 528448 IEndB= 528448 NGot= 13421772800 MDV= 12832623436
LenX= 12832623436 LenY= 12832458159
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= 48516 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0
Petite list used in FoFCou.
Cycle 1 Pass 1 IDiag 1:
E= -40.0780653403061
DIIS: error= 7.05D-02 at cycle 1 NSaved= 1.
NSaved= 1 IEnMin= 1 EnMin= -40.0780653403061 IErMin= 1 ErrMin= 7.05D-02
ErrMax= 7.05D-02 0.00D+00 EMaxC= 1.00D-01 BMatC= 1.84D-01 BMatP= 1.84D-01
IDIUse=3 WtCom= 2.95D-01 WtEn= 7.05D-01
Coeff-Com: 0.100D+01
Coeff-En: 0.100D+01
Coeff: 0.100D+01
Gap= 0.558 Goal= None Shift= 0.000
GapD= 0.558 DampG=2.000 DampE=0.500 DampFc=1.0000 IDamp=-1.
RMSDP=7.67D-04 MaxDP=6.01D-02 OVMax= 1.50D-01
Cycle 2 Pass 1 IDiag 1:
E= -40.1941348515365 Delta-E= -0.116069511230 Rises=F Damp=F
DIIS: error= 2.88D-02 at cycle 2 NSaved= 2.
NSaved= 2 IEnMin= 2 EnMin= -40.1941348515365 IErMin= 2 ErrMin= 2.88D-02
ErrMax= 2.88D-02 0.00D+00 EMaxC= 1.00D-01 BMatC= 2.54D-02 BMatP= 1.84D-01
IDIUse=3 WtCom= 7.12D-01 WtEn= 2.88D-01
Coeff-Com: 0.233D+00 0.767D+00
Coeff-En: 0.000D+00 0.100D+01
Coeff: 0.166D+00 0.834D+00
Gap= 0.657 Goal= None Shift= 0.000
RMSDP=2.04D-04 MaxDP=2.02D-02 DE=-1.16D-01 OVMax= 5.03D-02
Cycle 3 Pass 1 IDiag 1:
E= -40.2159085705788 Delta-E= -0.021773719042 Rises=F Damp=F
DIIS: error= 5.23D-03 at cycle 3 NSaved= 3.
NSaved= 3 IEnMin= 3 EnMin= -40.2159085705788 IErMin= 3 ErrMin= 5.23D-03
ErrMax= 5.23D-03 0.00D+00 EMaxC= 1.00D-01 BMatC= 8.11D-04 BMatP= 2.54D-02
IDIUse=3 WtCom= 9.48D-01 WtEn= 5.23D-02
Coeff-Com: -0.300D-01 0.959D-01 0.934D+00
Coeff-En: 0.000D+00 0.000D+00 0.100D+01
Coeff: -0.284D-01 0.909D-01 0.938D+00
Gap= 0.639 Goal= None Shift= 0.000
RMSDP=4.93D-05 MaxDP=3.54D-03 DE=-2.18D-02 OVMax= 9.12D-03
Cycle 4 Pass 1 IDiag 1:
E= -40.2167409032654 Delta-E= -0.000832332687 Rises=F Damp=F
DIIS: error= 5.80D-04 at cycle 4 NSaved= 4.
NSaved= 4 IEnMin= 4 EnMin= -40.2167409032654 IErMin= 4 ErrMin= 5.80D-04
ErrMax= 5.80D-04 0.00D+00 EMaxC= 1.00D-01 BMatC= 6.65D-06 BMatP= 8.11D-04
IDIUse=3 WtCom= 9.94D-01 WtEn= 5.80D-03
Coeff-Com: 0.707D-02-0.398D-01-0.271D+00 0.130D+01
Coeff-En: 0.000D+00 0.000D+00 0.000D+00 0.100D+01
Coeff: 0.703D-02-0.396D-01-0.270D+00 0.130D+01
Gap= 0.639 Goal= None Shift= 0.000
RMSDP=1.59D-05 MaxDP=1.14D-03 DE=-8.32D-04 OVMax= 1.66D-03
Cycle 5 Pass 1 IDiag 1:
E= -40.2167565632557 Delta-E= -0.000015659990 Rises=F Damp=F
DIIS: error= 7.45D-05 at cycle 5 NSaved= 5.
NSaved= 5 IEnMin= 5 EnMin= -40.2167565632557 IErMin= 5 ErrMin= 7.45D-05
ErrMax= 7.45D-05 0.00D+00 EMaxC= 1.00D-01 BMatC= 1.55D-07 BMatP= 6.65D-06
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: -0.391D-03 0.348D-02 0.240D-01-0.257D+00 0.123D+01
Coeff: -0.391D-03 0.348D-02 0.240D-01-0.257D+00 0.123D+01
Gap= 0.639 Goal= None Shift= 0.000
RMSDP=2.95D-06 MaxDP=1.86D-04 DE=-1.57D-05 OVMax= 3.01D-04
Cycle 6 Pass 1 IDiag 1:
E= -40.2167569567296 Delta-E= -0.000000393474 Rises=F Damp=F
DIIS: error= 3.50D-06 at cycle 6 NSaved= 6.
NSaved= 6 IEnMin= 6 EnMin= -40.2167569567296 IErMin= 6 ErrMin= 3.50D-06
ErrMax= 3.50D-06 0.00D+00 EMaxC= 1.00D-01 BMatC= 5.93D-10 BMatP= 1.55D-07
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: 0.538D-04-0.539D-03-0.378D-02 0.490D-01-0.277D+00 0.123D+01
Coeff: 0.538D-04-0.539D-03-0.378D-02 0.490D-01-0.277D+00 0.123D+01
Gap= 0.639 Goal= None Shift= 0.000
RMSDP=2.91D-07 MaxDP=1.43D-05 DE=-3.93D-07 OVMax= 1.83D-05
Cycle 7 Pass 1 IDiag 1:
E= -40.2167569582188 Delta-E= -0.000000001489 Rises=F Damp=F
DIIS: error= 1.39D-07 at cycle 7 NSaved= 7.
NSaved= 7 IEnMin= 7 EnMin= -40.2167569582188 IErMin= 7 ErrMin= 1.39D-07
ErrMax= 1.39D-07 0.00D+00 EMaxC= 1.00D-01 BMatC= 3.06D-12 BMatP= 5.93D-10
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: -0.565D-05 0.590D-04 0.435D-03-0.620D-02 0.365D-01-0.202D+00
Coeff-Com: 0.117D+01
Coeff: -0.565D-05 0.590D-04 0.435D-03-0.620D-02 0.365D-01-0.202D+00
Coeff: 0.117D+01
Gap= 0.639 Goal= None Shift= 0.000
RMSDP=3.26D-08 MaxDP=2.07D-06 DE=-1.49D-09 OVMax= 1.22D-06
Cycle 8 Pass 1 IDiag 1:
E= -40.2167569582223 Delta-E= -0.000000000004 Rises=F Damp=F
DIIS: error= 1.18D-08 at cycle 8 NSaved= 8.
NSaved= 8 IEnMin= 8 EnMin= -40.2167569582223 IErMin= 8 ErrMin= 1.18D-08
ErrMax= 1.18D-08 0.00D+00 EMaxC= 1.00D-01 BMatC= 1.09D-14 BMatP= 3.06D-12
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: 0.429D-06-0.449D-05-0.352D-04 0.529D-03-0.314D-02 0.185D-01
Coeff-Com: -0.144D+00 0.113D+01
Coeff: 0.429D-06-0.449D-05-0.352D-04 0.529D-03-0.314D-02 0.185D-01
Coeff: -0.144D+00 0.113D+01
Gap= 0.639 Goal= None Shift= 0.000
RMSDP=2.60D-09 MaxDP=1.85D-07 DE=-3.55D-12 OVMax= 7.43D-08
SCF Done: E(ROHF) = -40.2167569582 A.U. after 8 cycles
NFock= 8 Conv=0.26D-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= 4.015595480405D+01 PE=-1.198519808280D+02 EE= 2.606669588781D+01
Annihilation of the first spin contaminant:
S**2 before annihilation 0.0000, after 0.0000
Leave Link 502 at Tue Apr 2 22:31:06 2019, MaxMem= 13421772800 cpu: 499.3
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l801.exe)
Windowed orbitals will be sorted by symmetry type.
GenMOA: NOpAll= 24 NOp2=4 NOpUse= 24 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= 9.68D+04 ExpMxC= 3.06D+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 1.98D-04
Largest core mixing into a valence orbital is 2.78D-05
Largest valence mixing into a core orbital is 1.98D-04
Largest core mixing into a valence orbital is 2.78D-05
Range of M.O.s used for correlation: 2 311
NBasis= 311 NAE= 5 NBE= 5 NFC= 1 NFV= 0
NROrb= 310 NOA= 4 NOB= 4 NVA= 306 NVB= 306
**** Warning!!: The largest alpha MO coefficient is 0.67141895D+02
**** Warning!!: The largest beta MO coefficient is 0.67141895D+02
Singles contribution to E2= -0.2058457328D-15
Leave Link 801 at Tue Apr 2 22:31:14 2019, MaxMem= 13421772800 cpu: 179.2
(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= 13418870200
LASXX= 14726103 LTotXX= 14726103 LenRXX= 29597581
LTotAB= 14871478 MaxLAS= 35214760 LenRXY= 0
NonZer= 44323684 LenScr= 67043328 LnRSAI= 35214760
LnScr1= 53346304 LExtra= 0 Total= 185201973
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= 13418870200
LASXX= 14726103 LTotXX= 14726103 LenRXX= 29216889
LTotAB= 14490786 MaxLAS= 35214760 LenRXY= 0
NonZer= 43942992 LenScr= 66322432 LnRSAI= 35214760
LnScr1= 53346304 LExtra= 0 Total= 184100385
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 = 0.6240255260D-02 E2= -0.1886239971D-01
alpha-beta T2 = 0.5052413098D-01 E2= -0.1766793251D+00
beta-beta T2 = 0.6240255260D-02 E2= -0.1886239971D-01
ANorm= 0.1031021164D+01
E2 = -0.2144041246D+00 EUMP2 = -0.40431161082786D+02
(S**2,0)= 0.00000D+00 (S**2,1)= 0.00000D+00
E(PUHF)= -0.40216756958D+02 E(PMP2)= -0.40431161083D+02
Leave Link 804 at Tue Apr 2 22:31:37 2019, MaxMem= 13421772800 cpu: 565.8
(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=1471291218.
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= 48516 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)= 0.18941759D-01
Maximum subspace dimension= 5
Norm of the A-vectors is 3.4942877D-02 conv= 1.00D-05.
RLE energy= -0.2100114001
E3= -0.14457154D-01 EROMP3= -0.40445618236D+02
E4(SDQ)= -0.17340567D-02 ROMP4(SDQ)= -0.40447352293D+02
VARIATIONAL ENERGIES WITH THE FIRST-ORDER WAVEFUNCTION:
DE(Corr)= -0.20991952 E(Corr)= -40.426676477
NORM(A)= 0.10294884D+01
Iteration Nr. 2
**********************
DD1Dir will call FoFMem 1 times, MxPair= 44
NAB= 16 NAA= 6 NBB= 6.
Norm of the A-vectors is 1.8211783D-01 conv= 1.00D-05.
RLE energy= -0.2121614930
DE(Corr)= -0.22398175 E(CORR)= -40.440738712 Delta=-1.41D-02
NORM(A)= 0.10303365D+01
Iteration Nr. 3
**********************
DD1Dir will call FoFMem 1 times, MxPair= 44
NAB= 16 NAA= 6 NBB= 6.
Norm of the A-vectors is 1.6196090D-01 conv= 1.00D-05.
RLE energy= -0.2247293949
DE(Corr)= -0.22476858 E(CORR)= -40.441525534 Delta=-7.87D-04
NORM(A)= 0.10358881D+01
Iteration Nr. 4
**********************
DD1Dir will call FoFMem 1 times, MxPair= 44
NAB= 16 NAA= 6 NBB= 6.
Norm of the A-vectors is 5.7645532D-02 conv= 1.00D-05.
RLE energy= -0.2299816058
DE(Corr)= -0.22853966 E(CORR)= -40.445296615 Delta=-3.77D-03
NORM(A)= 0.10389064D+01
Iteration Nr. 5
**********************
DD1Dir will call FoFMem 1 times, MxPair= 44
NAB= 16 NAA= 6 NBB= 6.
Norm of the A-vectors is 6.9474146D-03 conv= 1.00D-05.
RLE energy= -0.2308125388
DE(Corr)= -0.23039957 E(CORR)= -40.447156524 Delta=-1.86D-03
NORM(A)= 0.10394138D+01
Iteration Nr. 6
**********************
DD1Dir will call FoFMem 1 times, MxPair= 44
NAB= 16 NAA= 6 NBB= 6.
Norm of the A-vectors is 1.9349362D-03 conv= 1.00D-05.
RLE energy= -0.2306061931
DE(Corr)= -0.23067082 E(CORR)= -40.447427783 Delta=-2.71D-04
NORM(A)= 0.10393003D+01
Iteration Nr. 7
**********************
DD1Dir will call FoFMem 1 times, MxPair= 44
NAB= 16 NAA= 6 NBB= 6.
Norm of the A-vectors is 1.9536415D-04 conv= 1.00D-05.
RLE energy= -0.2306058346
DE(Corr)= -0.23060557 E(CORR)= -40.447362524 Delta= 6.53D-05
NORM(A)= 0.10393002D+01
Iteration Nr. 8
**********************
DD1Dir will call FoFMem 1 times, MxPair= 44
NAB= 16 NAA= 6 NBB= 6.
Norm of the A-vectors is 3.9598480D-05 conv= 1.00D-05.
RLE energy= -0.2306058600
DE(Corr)= -0.23060596 E(CORR)= -40.447362922 Delta=-3.98D-07
NORM(A)= 0.10393000D+01
Iteration Nr. 9
**********************
DD1Dir will call FoFMem 1 times, MxPair= 44
NAB= 16 NAA= 6 NBB= 6.
Norm of the A-vectors is 1.0762168D-05 conv= 1.00D-05.
RLE energy= -0.2306058373
DE(Corr)= -0.23060579 E(CORR)= -40.447362748 Delta= 1.74D-07
NORM(A)= 0.10393000D+01
Iteration Nr. 10
**********************
DD1Dir will call FoFMem 1 times, MxPair= 44
NAB= 16 NAA= 6 NBB= 6.
Norm of the A-vectors is 2.8508624D-06 conv= 1.00D-05.
RLE energy= -0.2306058302
DE(Corr)= -0.23060583 E(CORR)= -40.447362787 Delta=-3.94D-08
NORM(A)= 0.10393000D+01
CI/CC converged in 10 iterations to DelEn=-3.94D-08 Conv= 1.00D-07 ErrA1= 2.85D-06 Conv= 1.00D-05
Largest amplitude= 2.39D-02
Time for triples= 116556.10 seconds.
T4(CCSD)= -0.73802837D-02
T5(CCSD)= 0.24219311D-03
CCSD(T)= -0.40454500878D+02
Discarding MO integrals.
Leave Link 913 at Tue Apr 2 23:59:05 2019, MaxMem= 13421772800 cpu: 121289.7
(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) (T2) (T2) (T2)
Virtual (A1) (T2) (T2) (T2) (T2) (T2) (T2) (A1) (T2) (T2)
(T2) (E) (E) (A1) (T2) (T2) (T2) (T1) (T1) (T1)
(T2) (T2) (T2) (T2) (T2) (T2) (A1) (E) (E) (T2)
(T2) (T2) (A1) (T2) (T2) (T2) (E) (E) (T1) (T1)
(T1) (A1) (T2) (T2) (T2) (T1) (T1) (T1) (E) (E)
(T2) (T2) (T2) (A1) (E) (E) (T2) (T2) (T2) (T2)
(T2) (T2) (T1) (T1) (T1) (T2) (T2) (T2) (A1) (T1)
(T1) (T1) (T2) (T2) (T2) (A1) (T2) (T2) (T2) (E)
(E) (T2) (T2) (T2) (T1) (T1) (T1) (T2) (T2) (T2)
(A1) (T2) (T2) (T2) (A2) (E) (E) (E) (E) (A1)
(T1) (T1) (T1) (T2) (T2) (T2) (E) (E) (T2) (T2)
(T2) (A1) (T1) (T1) (T1) (T1) (T1) (T1) (T2) (T2)
(T2) (A1) (T2) (T2) (T2) (T2) (T2) (T2) (T1) (T1)
(T1) (E) (E) (T1) (T1) (T1) (T2) (T2) (T2) (T2)
(T2) (T2) (A1) (E) (E) (T2) (T2) (T2) (A1) (E)
(E) (T1) (T1) (T1) (T2) (T2) (T2) (T2) (T2) (T2)
(T1) (T1) (T1) (E) (E) (T2) (T2) (T2) (A1) (T1)
(T1) (T1) (T2) (T2) (T2) (T2) (T2) (T2) (A1) (E)
(E) (E) (E) (T2) (T2) (T2) (T1) (T1) (T1) (A1)
(T2) (T2) (T2) (T2) (T2) (T2) (A1) (T1) (T1) (T1)
(E) (E) (A2) (T1) (T1) (T1) (T2) (T2) (T2) (E)
(E) (T1) (T1) (T1) (T2) (T2) (T2) (A2) (T2) (T2)
(T2) (A1) (T1) (T1) (T1) (E) (E) (T2) (T2) (T2)
(T2) (T2) (T2) (A1) (T1) (T1) (T1) (T2) (T2) (T2)
(T1) (T1) (T1) (E) (E) (E) (E) (T2) (T2) (T2)
(A1) (T1) (T1) (T1) (T2) (T2) (T2) (T1) (T1) (T1)
(T2) (T2) (T2) (E) (E) (A1) (T2) (T2) (T2) (A1)
(T2) (T2) (T2) (E) (E) (T1) (T1) (T1) (T2) (T2)
(T2) (T1) (T1) (T1) (T2) (T2) (T2) (E) (E) (T2)
(T2) (T2) (E) (E) (T1) (T1) (T1) (T2) (T2) (T2)
(A1) (A1) (T2) (T2) (T2) (A1)
The electronic state is 1-A1.
Alpha occ. eigenvalues -- -11.20710 -0.94145 -0.54426 -0.54426 -0.54426
Alpha virt. eigenvalues -- 0.09492 0.14865 0.14865 0.14865 0.21012
Alpha virt. eigenvalues -- 0.21012 0.21012 0.39720 0.44880 0.44880
Alpha virt. eigenvalues -- 0.44880 0.46495 0.46495 0.50129 0.58908
Alpha virt. eigenvalues -- 0.58908 0.58908 0.67154 0.67154 0.67154
Alpha virt. eigenvalues -- 0.71077 0.71077 0.71077 0.93091 0.93091
Alpha virt. eigenvalues -- 0.93091 0.96966 0.97215 0.97215 1.06280
Alpha virt. eigenvalues -- 1.06280 1.06280 1.15631 1.29202 1.29202
Alpha virt. eigenvalues -- 1.29202 1.45259 1.45259 1.47901 1.47901
Alpha virt. eigenvalues -- 1.47901 1.58476 1.62207 1.62207 1.62207
Alpha virt. eigenvalues -- 1.78243 1.78243 1.78243 1.88171 1.88171
Alpha virt. eigenvalues -- 1.90418 1.90418 1.90418 2.08268 2.08593
Alpha virt. eigenvalues -- 2.08593 2.10890 2.10890 2.10890 2.18330
Alpha virt. eigenvalues -- 2.18330 2.18330 2.38837 2.38837 2.38837
Alpha virt. eigenvalues -- 2.46534 2.46534 2.46534 2.58439 2.65825
Alpha virt. eigenvalues -- 2.65825 2.65825 2.71227 2.71227 2.71227
Alpha virt. eigenvalues -- 2.92272 3.16335 3.16335 3.16335 3.30216
Alpha virt. eigenvalues -- 3.30216 3.46221 3.46221 3.46221 3.73727
Alpha virt. eigenvalues -- 3.73727 3.73727 3.77309 3.77309 3.77309
Alpha virt. eigenvalues -- 3.91657 4.07599 4.07599 4.07599 4.11620
Alpha virt. eigenvalues -- 4.12625 4.12625 4.16386 4.16386 4.19988
Alpha virt. eigenvalues -- 4.25816 4.25816 4.25816 4.54858 4.54858
Alpha virt. eigenvalues -- 4.54858 4.72558 4.72558 4.72678 4.72678
Alpha virt. eigenvalues -- 4.72678 4.75704 4.81206 4.81206 4.81206
Alpha virt. eigenvalues -- 4.87807 4.87807 4.87807 4.91405 4.91405
Alpha virt. eigenvalues -- 4.91405 5.19328 5.37278 5.37278 5.37278
Alpha virt. eigenvalues -- 5.43068 5.43068 5.43068 5.48947 5.48947
Alpha virt. eigenvalues -- 5.48947 5.51353 5.51353 5.67718 5.67718
Alpha virt. eigenvalues -- 5.67718 5.75963 5.75963 5.75963 6.02143
Alpha virt. eigenvalues -- 6.02143 6.02143 6.03813 6.08025 6.08025
Alpha virt. eigenvalues -- 6.26396 6.26396 6.26396 6.41756 6.89850
Alpha virt. eigenvalues -- 6.89850 7.01240 7.01240 7.01240 7.11697
Alpha virt. eigenvalues -- 7.11697 7.11697 7.48077 7.48077 7.48077
Alpha virt. eigenvalues -- 7.63741 7.63741 7.63741 7.83400 7.83400
Alpha virt. eigenvalues -- 8.18590 8.18590 8.18590 8.22337 9.50030
Alpha virt. eigenvalues -- 9.50030 9.50030 9.61573 9.61573 9.61573
Alpha virt. eigenvalues -- 9.84851 9.84851 9.84851 9.88007 9.95222
Alpha virt. eigenvalues -- 9.95222 10.30004 10.30004 10.47501 10.47501
Alpha virt. eigenvalues -- 10.47501 10.47831 10.47831 10.47831 10.86685
Alpha virt. eigenvalues -- 11.12814 11.12814 11.12814 11.44366 11.44366
Alpha virt. eigenvalues -- 11.44366 11.56346 11.82486 11.82486 11.82486
Alpha virt. eigenvalues -- 12.40062 12.40062 12.57411 12.73205 12.73205
Alpha virt. eigenvalues -- 12.73205 12.76250 12.76250 12.76250 12.81222
Alpha virt. eigenvalues -- 12.81222 12.86299 12.86299 12.86299 12.95448
Alpha virt. eigenvalues -- 12.95448 12.95448 13.00076 13.02189 13.02189
Alpha virt. eigenvalues -- 13.02189 13.02748 13.26315 13.26315 13.26315
Alpha virt. eigenvalues -- 13.42937 13.42937 13.43401 13.43401 13.43401
Alpha virt. eigenvalues -- 13.56129 13.56129 13.56129 13.64170 13.99825
Alpha virt. eigenvalues -- 13.99825 13.99825 14.07913 14.07913 14.07913
Alpha virt. eigenvalues -- 14.22870 14.22870 14.22870 14.26544 14.26544
Alpha virt. eigenvalues -- 14.28900 14.28900 14.35428 14.35428 14.35428
Alpha virt. eigenvalues -- 14.35899 14.47305 14.47305 14.47305 14.57177
Alpha virt. eigenvalues -- 14.57177 14.57177 14.78492 14.78492 14.78492
Alpha virt. eigenvalues -- 14.88528 14.88528 14.88528 15.10171 15.10171
Alpha virt. eigenvalues -- 15.53930 15.63466 15.63466 15.63466 15.67923
Alpha virt. eigenvalues -- 15.79632 15.79632 15.79632 15.94636 15.94636
Alpha virt. eigenvalues -- 16.61415 16.61415 16.61415 16.91564 16.91564
Alpha virt. eigenvalues -- 16.91564 17.44018 17.44018 17.44018 17.89366
Alpha virt. eigenvalues -- 17.89366 17.89366 17.98079 17.98079 18.37787
Alpha virt. eigenvalues -- 18.37787 18.37787 18.50054 18.50054 18.63571
Alpha virt. eigenvalues -- 18.63571 18.63571 18.95411 18.95411 18.95411
Alpha virt. eigenvalues -- 19.12525 20.84862 20.86019 20.86019 20.86019
Alpha virt. eigenvalues -- 43.12644
Molecular Orbital Coefficients:
1 2 3 4 5
(A1)--O (A1)--O (T2)--O (T2)--O (T2)--O
Eigenvalues -- -11.20710 -0.94145 -0.54426 -0.54426 -0.54426
1 1 C 1S 0.56554 -0.10179 0.00000 0.00000 0.00000
2 2S -0.41991 0.16784 0.00000 0.00000 0.00000
3 3S 0.07950 -0.02261 0.00000 0.00000 0.00000
4 4S 0.00223 0.25229 0.00000 0.00000 0.00000
5 5S 0.00086 0.33409 0.00000 0.00000 0.00000
6 6S 0.00003 0.06784 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 0.00000 0.08826
8 7PY 0.00000 0.00000 0.08826 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.08826 0.00000
10 8PX 0.00000 0.00000 0.00000 0.00000 0.15082
11 8PY 0.00000 0.00000 0.15082 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.15082 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 0.22108
14 9PY 0.00000 0.00000 0.22108 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.22108 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 0.14929
17 10PY 0.00000 0.00000 0.14929 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.14929 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 0.03998
20 11PY 0.00000 0.00000 0.03998 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.03998 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00246 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00246
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00246 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00870 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00870
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00870 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.02147 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.02147
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.02147 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 0.01072 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.01072
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 0.01072 0.00000
42 16F 0 0.00000 0.00000 0.00000 -0.00044 0.00000
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00027
44 16F-1 0.00000 0.00000 0.00027 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-2 0.00010 0.00105 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.00000 0.00000 0.00000 -0.00034
48 16F-3 0.00000 0.00000 0.00034 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 -0.00177 0.00000
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00108
51 17F-1 0.00000 0.00000 0.00108 0.00000 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
53 17F-2 0.00019 0.00559 0.00000 0.00000 0.00000
54 17F+3 0.00000 0.00000 0.00000 0.00000 -0.00140
55 17F-3 0.00000 0.00000 0.00140 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 -0.00234 0.00000
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00143
58 18F-1 0.00000 0.00000 0.00143 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
60 18F-2 0.00013 0.00619 0.00000 0.00000 0.00000
61 18F+3 0.00000 0.00000 0.00000 0.00000 -0.00185
62 18F-3 0.00000 0.00000 0.00185 0.00000 0.00000
63 19G 0 -0.00004 -0.00028 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 -0.00016 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00000 -0.00016
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00046 0.00000
68 19G+3 0.00000 0.00000 -0.00043 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00043
70 19G+4 -0.00003 -0.00024 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 -0.00004 -0.00145 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 -0.00090 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.00000 0.00000 -0.00090
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.00256 0.00000
77 20G+3 0.00000 0.00000 -0.00239 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00239
79 20G+4 -0.00003 -0.00123 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 -0.00041 0.00000
82 21H+1 0.00000 0.00000 0.00000 0.00000 -0.00040
83 21H-1 0.00000 0.00000 -0.00040 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 -0.00005
87 21H-3 0.00000 0.00000 0.00005 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 -0.00034 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 -0.00036
91 21H-5 0.00000 0.00000 -0.00036 0.00000 0.00000
92 2 H 1S 0.00007 0.02010 0.02428 0.02428 0.02428
93 2S 0.00009 0.04538 0.05602 0.05602 0.05602
94 3S 0.00029 0.08639 0.11872 0.11872 0.11872
95 4S 0.00005 0.05832 0.12559 0.12559 0.12559
96 5S 0.00001 0.00346 0.02769 0.02769 0.02769
97 6PX -0.00001 -0.00058 -0.00060 -0.00060 -0.00004
98 6PY -0.00001 -0.00058 -0.00004 -0.00060 -0.00060
99 6PZ -0.00001 -0.00058 -0.00060 -0.00004 -0.00060
100 7PX -0.00001 -0.00176 -0.00205 -0.00205 -0.00003
101 7PY -0.00001 -0.00176 -0.00003 -0.00205 -0.00205
102 7PZ -0.00001 -0.00176 -0.00205 -0.00003 -0.00205
103 8PX -0.00013 -0.00773 -0.00917 -0.00917 -0.00216
104 8PY -0.00013 -0.00773 -0.00216 -0.00917 -0.00917
105 8PZ -0.00013 -0.00773 -0.00917 -0.00216 -0.00917
106 9PX -0.00003 -0.00478 -0.01078 -0.01078 -0.00222
107 9PY -0.00003 -0.00478 -0.00222 -0.01078 -0.01078
108 9PZ -0.00003 -0.00478 -0.01078 -0.00222 -0.01078
109 10D 0 0.00000 0.00000 0.00009 -0.00018 0.00009
110 10D+1 0.00000 0.00016 0.00017 0.00000 0.00000
111 10D-1 0.00000 0.00016 0.00000 0.00000 0.00017
112 10D+2 0.00000 0.00000 0.00015 0.00000 -0.00015
113 10D-2 0.00000 0.00016 0.00000 0.00017 0.00000
114 11D 0 0.00000 0.00000 0.00026 -0.00053 0.00026
115 11D+1 0.00004 0.00071 0.00156 0.00094 0.00094
116 11D-1 0.00004 0.00071 0.00094 0.00094 0.00156
117 11D+2 0.00000 0.00000 0.00046 0.00000 -0.00046
118 11D-2 0.00004 0.00071 0.00094 0.00156 0.00094
119 12D 0 0.00000 0.00000 0.00042 -0.00084 0.00042
120 12D+1 0.00006 0.00168 0.00297 0.00157 0.00157
121 12D-1 0.00006 0.00168 0.00157 0.00157 0.00297
122 12D+2 0.00000 0.00000 0.00073 0.00000 -0.00073
123 12D-2 0.00006 0.00168 0.00157 0.00297 0.00157
124 13F 0 0.00000 0.00006 0.00005 0.00009 0.00005
125 13F+1 0.00000 -0.00004 -0.00008 0.00002 -0.00005
126 13F-1 0.00000 -0.00004 -0.00005 0.00002 -0.00008
127 13F+2 0.00000 0.00000 -0.00006 0.00000 0.00006
128 13F-2 -0.00001 -0.00011 -0.00011 -0.00011 -0.00011
129 13F+3 0.00000 0.00005 0.00000 0.00007 0.00007
130 13F-3 0.00000 -0.00005 -0.00007 -0.00007 0.00000
131 14F 0 0.00002 0.00017 0.00042 0.00038 0.00042
132 14F+1 -0.00001 -0.00010 -0.00037 -0.00015 -0.00023
133 14F-1 -0.00001 -0.00010 -0.00023 -0.00015 -0.00037
134 14F+2 0.00000 0.00000 -0.00014 0.00000 0.00014
135 14F-2 -0.00003 -0.00022 -0.00086 -0.00086 -0.00086
136 14F+3 0.00001 0.00013 0.00025 0.00042 0.00030
137 14F-3 -0.00001 -0.00013 -0.00030 -0.00042 -0.00025
138 15G 0 -0.00001 -0.00004 -0.00006 -0.00005 -0.00006
139 15G+1 0.00000 -0.00001 -0.00002 -0.00003 -0.00002
140 15G-1 0.00000 -0.00001 -0.00002 -0.00003 -0.00002
141 15G+2 0.00000 0.00000 0.00001 0.00000 -0.00001
142 15G-2 0.00001 0.00003 0.00008 0.00006 0.00008
143 15G+3 -0.00001 -0.00003 -0.00005 -0.00007 -0.00008
144 15G-3 0.00001 0.00003 0.00008 0.00007 0.00005
145 15G+4 -0.00001 -0.00004 -0.00004 -0.00005 -0.00004
146 15G-4 0.00000 0.00000 0.00001 0.00000 -0.00001
147 3 H 1S 0.00007 0.02010 -0.02428 0.02428 -0.02428
148 2S 0.00009 0.04538 -0.05602 0.05602 -0.05602
149 3S 0.00029 0.08639 -0.11872 0.11872 -0.11872
150 4S 0.00005 0.05832 -0.12559 0.12559 -0.12559
151 5S 0.00001 0.00346 -0.02769 0.02769 -0.02769
152 6PX 0.00001 0.00058 -0.00060 0.00060 -0.00004
153 6PY 0.00001 0.00058 -0.00004 0.00060 -0.00060
154 6PZ -0.00001 -0.00058 0.00060 -0.00004 0.00060
155 7PX 0.00001 0.00176 -0.00205 0.00205 -0.00003
156 7PY 0.00001 0.00176 -0.00003 0.00205 -0.00205
157 7PZ -0.00001 -0.00176 0.00205 -0.00003 0.00205
158 8PX 0.00013 0.00773 -0.00917 0.00917 -0.00216
159 8PY 0.00013 0.00773 -0.00216 0.00917 -0.00917
160 8PZ -0.00013 -0.00773 0.00917 -0.00216 0.00917
161 9PX 0.00003 0.00478 -0.01078 0.01078 -0.00222
162 9PY 0.00003 0.00478 -0.00222 0.01078 -0.01078
163 9PZ -0.00003 -0.00478 0.01078 -0.00222 0.01078
164 10D 0 0.00000 0.00000 -0.00009 -0.00018 -0.00009
165 10D+1 0.00000 -0.00016 0.00017 0.00000 0.00000
166 10D-1 0.00000 -0.00016 0.00000 0.00000 0.00017
167 10D+2 0.00000 0.00000 -0.00015 0.00000 0.00015
168 10D-2 0.00000 0.00016 0.00000 0.00017 0.00000
169 11D 0 0.00000 0.00000 -0.00026 -0.00053 -0.00026
170 11D+1 -0.00004 -0.00071 0.00156 -0.00094 0.00094
171 11D-1 -0.00004 -0.00071 0.00094 -0.00094 0.00156
172 11D+2 0.00000 0.00000 -0.00046 0.00000 0.00046
173 11D-2 0.00004 0.00071 -0.00094 0.00156 -0.00094
174 12D 0 0.00000 0.00000 -0.00042 -0.00084 -0.00042
175 12D+1 -0.00006 -0.00168 0.00297 -0.00157 0.00157
176 12D-1 -0.00006 -0.00168 0.00157 -0.00157 0.00297
177 12D+2 0.00000 0.00000 -0.00073 0.00000 0.00073
178 12D-2 0.00006 0.00168 -0.00157 0.00297 -0.00157
179 13F 0 0.00000 0.00006 -0.00005 0.00009 -0.00005
180 13F+1 0.00000 0.00004 -0.00008 -0.00002 -0.00005
181 13F-1 0.00000 0.00004 -0.00005 -0.00002 -0.00008
182 13F+2 0.00000 0.00000 0.00006 0.00000 -0.00006
183 13F-2 -0.00001 -0.00011 0.00011 -0.00011 0.00011
184 13F+3 0.00000 -0.00005 0.00000 -0.00007 0.00007
185 13F-3 0.00000 0.00005 -0.00007 0.00007 0.00000
186 14F 0 0.00002 0.00017 -0.00042 0.00038 -0.00042
187 14F+1 0.00001 0.00010 -0.00037 0.00015 -0.00023
188 14F-1 0.00001 0.00010 -0.00023 0.00015 -0.00037
189 14F+2 0.00000 0.00000 0.00014 0.00000 -0.00014
190 14F-2 -0.00003 -0.00022 0.00086 -0.00086 0.00086
191 14F+3 -0.00001 -0.00013 0.00025 -0.00042 0.00030
192 14F-3 0.00001 0.00013 -0.00030 0.00042 -0.00025
193 15G 0 -0.00001 -0.00004 0.00006 -0.00005 0.00006
194 15G+1 0.00000 0.00001 -0.00002 0.00003 -0.00002
195 15G-1 0.00000 0.00001 -0.00002 0.00003 -0.00002
196 15G+2 0.00000 0.00000 -0.00001 0.00000 0.00001
197 15G-2 0.00001 0.00003 -0.00008 0.00006 -0.00008
198 15G+3 0.00001 0.00003 -0.00005 0.00007 -0.00008
199 15G-3 -0.00001 -0.00003 0.00008 -0.00007 0.00005
200 15G+4 -0.00001 -0.00004 0.00004 -0.00005 0.00004
201 15G-4 0.00000 0.00000 -0.00001 0.00000 0.00001
202 4 H 1S 0.00007 0.02010 -0.02428 -0.02428 0.02428
203 2S 0.00009 0.04538 -0.05602 -0.05602 0.05602
204 3S 0.00029 0.08639 -0.11872 -0.11872 0.11872
205 4S 0.00005 0.05832 -0.12559 -0.12559 0.12559
206 5S 0.00001 0.00346 -0.02769 -0.02769 0.02769
207 6PX -0.00001 -0.00058 0.00060 0.00060 -0.00004
208 6PY 0.00001 0.00058 -0.00004 -0.00060 0.00060
209 6PZ 0.00001 0.00058 -0.00060 -0.00004 0.00060
210 7PX -0.00001 -0.00176 0.00205 0.00205 -0.00003
211 7PY 0.00001 0.00176 -0.00003 -0.00205 0.00205
212 7PZ 0.00001 0.00176 -0.00205 -0.00003 0.00205
213 8PX -0.00013 -0.00773 0.00917 0.00917 -0.00216
214 8PY 0.00013 0.00773 -0.00216 -0.00917 0.00917
215 8PZ 0.00013 0.00773 -0.00917 -0.00216 0.00917
216 9PX -0.00003 -0.00478 0.01078 0.01078 -0.00222
217 9PY 0.00003 0.00478 -0.00222 -0.01078 0.01078
218 9PZ 0.00003 0.00478 -0.01078 -0.00222 0.01078
219 10D 0 0.00000 0.00000 -0.00009 0.00018 0.00009
220 10D+1 0.00000 -0.00016 0.00017 0.00000 0.00000
221 10D-1 0.00000 0.00016 0.00000 0.00000 0.00017
222 10D+2 0.00000 0.00000 -0.00015 0.00000 -0.00015
223 10D-2 0.00000 -0.00016 0.00000 0.00017 0.00000
224 11D 0 0.00000 0.00000 -0.00026 0.00053 0.00026
225 11D+1 -0.00004 -0.00071 0.00156 0.00094 -0.00094
226 11D-1 0.00004 0.00071 -0.00094 -0.00094 0.00156
227 11D+2 0.00000 0.00000 -0.00046 0.00000 -0.00046
228 11D-2 -0.00004 -0.00071 0.00094 0.00156 -0.00094
229 12D 0 0.00000 0.00000 -0.00042 0.00084 0.00042
230 12D+1 -0.00006 -0.00168 0.00297 0.00157 -0.00157
231 12D-1 0.00006 0.00168 -0.00157 -0.00157 0.00297
232 12D+2 0.00000 0.00000 -0.00073 0.00000 -0.00073
233 12D-2 -0.00006 -0.00168 0.00157 0.00297 -0.00157
234 13F 0 0.00000 -0.00006 0.00005 0.00009 -0.00005
235 13F+1 0.00000 -0.00004 0.00008 -0.00002 -0.00005
236 13F-1 0.00000 0.00004 -0.00005 0.00002 0.00008
237 13F+2 0.00000 0.00000 -0.00006 0.00000 -0.00006
238 13F-2 -0.00001 -0.00011 0.00011 0.00011 -0.00011
239 13F+3 0.00000 0.00005 0.00000 -0.00007 0.00007
240 13F-3 0.00000 0.00005 -0.00007 -0.00007 0.00000
241 14F 0 -0.00002 -0.00017 0.00042 0.00038 -0.00042
242 14F+1 -0.00001 -0.00010 0.00037 0.00015 -0.00023
243 14F-1 0.00001 0.00010 -0.00023 -0.00015 0.00037
244 14F+2 0.00000 0.00000 -0.00014 0.00000 -0.00014
245 14F-2 -0.00003 -0.00022 0.00086 0.00086 -0.00086
246 14F+3 0.00001 0.00013 -0.00025 -0.00042 0.00030
247 14F-3 0.00001 0.00013 -0.00030 -0.00042 0.00025
248 15G 0 -0.00001 -0.00004 0.00006 0.00005 -0.00006
249 15G+1 0.00000 0.00001 -0.00002 -0.00003 0.00002
250 15G-1 0.00000 -0.00001 0.00002 0.00003 -0.00002
251 15G+2 0.00000 0.00000 -0.00001 0.00000 -0.00001
252 15G-2 -0.00001 -0.00003 0.00008 0.00006 -0.00008
253 15G+3 0.00001 0.00003 -0.00005 -0.00007 0.00008
254 15G-3 0.00001 0.00003 -0.00008 -0.00007 0.00005
255 15G+4 -0.00001 -0.00004 0.00004 0.00005 -0.00004
256 15G-4 0.00000 0.00000 0.00001 0.00000 0.00001
257 5 H 1S 0.00007 0.02010 0.02428 -0.02428 -0.02428
258 2S 0.00009 0.04538 0.05602 -0.05602 -0.05602
259 3S 0.00029 0.08639 0.11872 -0.11872 -0.11872
260 4S 0.00005 0.05832 0.12559 -0.12559 -0.12559
261 5S 0.00001 0.00346 0.02769 -0.02769 -0.02769
262 6PX 0.00001 0.00058 0.00060 -0.00060 -0.00004
263 6PY -0.00001 -0.00058 -0.00004 0.00060 0.00060
264 6PZ 0.00001 0.00058 0.00060 -0.00004 -0.00060
265 7PX 0.00001 0.00176 0.00205 -0.00205 -0.00003
266 7PY -0.00001 -0.00176 -0.00003 0.00205 0.00205
267 7PZ 0.00001 0.00176 0.00205 -0.00003 -0.00205
268 8PX 0.00013 0.00773 0.00917 -0.00917 -0.00216
269 8PY -0.00013 -0.00773 -0.00216 0.00917 0.00917
270 8PZ 0.00013 0.00773 0.00917 -0.00216 -0.00917
271 9PX 0.00003 0.00478 0.01078 -0.01078 -0.00222
272 9PY -0.00003 -0.00478 -0.00222 0.01078 0.01078
273 9PZ 0.00003 0.00478 0.01078 -0.00222 -0.01078
274 10D 0 0.00000 0.00000 0.00009 0.00018 -0.00009
275 10D+1 0.00000 0.00016 0.00017 0.00000 0.00000
276 10D-1 0.00000 -0.00016 0.00000 0.00000 0.00017
277 10D+2 0.00000 0.00000 0.00015 0.00000 0.00015
278 10D-2 0.00000 -0.00016 0.00000 0.00017 0.00000
279 11D 0 0.00000 0.00000 0.00026 0.00053 -0.00026
280 11D+1 0.00004 0.00071 0.00156 -0.00094 -0.00094
281 11D-1 -0.00004 -0.00071 -0.00094 0.00094 0.00156
282 11D+2 0.00000 0.00000 0.00046 0.00000 0.00046
283 11D-2 -0.00004 -0.00071 -0.00094 0.00156 0.00094
284 12D 0 0.00000 0.00000 0.00042 0.00084 -0.00042
285 12D+1 0.00006 0.00168 0.00297 -0.00157 -0.00157
286 12D-1 -0.00006 -0.00168 -0.00157 0.00157 0.00297
287 12D+2 0.00000 0.00000 0.00073 0.00000 0.00073
288 12D-2 -0.00006 -0.00168 -0.00157 0.00297 0.00157
289 13F 0 0.00000 -0.00006 -0.00005 0.00009 0.00005
290 13F+1 0.00000 0.00004 0.00008 0.00002 -0.00005
291 13F-1 0.00000 -0.00004 -0.00005 -0.00002 0.00008
292 13F+2 0.00000 0.00000 0.00006 0.00000 0.00006
293 13F-2 -0.00001 -0.00011 -0.00011 0.00011 0.00011
294 13F+3 0.00000 -0.00005 0.00000 0.00007 0.00007
295 13F-3 0.00000 -0.00005 -0.00007 0.00007 0.00000
296 14F 0 -0.00002 -0.00017 -0.00042 0.00038 0.00042
297 14F+1 0.00001 0.00010 0.00037 -0.00015 -0.00023
298 14F-1 -0.00001 -0.00010 -0.00023 0.00015 0.00037
299 14F+2 0.00000 0.00000 0.00014 0.00000 0.00014
300 14F-2 -0.00003 -0.00022 -0.00086 0.00086 0.00086
301 14F+3 -0.00001 -0.00013 -0.00025 0.00042 0.00030
302 14F-3 -0.00001 -0.00013 -0.00030 0.00042 0.00025
303 15G 0 -0.00001 -0.00004 -0.00006 0.00005 0.00006
304 15G+1 0.00000 -0.00001 -0.00002 0.00003 0.00002
305 15G-1 0.00000 0.00001 0.00002 -0.00003 -0.00002
306 15G+2 0.00000 0.00000 0.00001 0.00000 0.00001
307 15G-2 -0.00001 -0.00003 -0.00008 0.00006 0.00008
308 15G+3 -0.00001 -0.00003 -0.00005 0.00007 0.00008
309 15G-3 -0.00001 -0.00003 -0.00008 0.00007 0.00005
310 15G+4 -0.00001 -0.00004 -0.00004 0.00005 0.00004
311 15G-4 0.00000 0.00000 -0.00001 0.00000 -0.00001
6 7 8 9 10
(A1)--V (T2)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 0.09492 0.14865 0.14865 0.14865 0.21012
1 1 C 1S -0.03483 0.00000 0.00000 0.00000 0.00000
2 2S 0.04856 0.00000 0.00000 0.00000 0.00000
3 3S -0.05735 0.00000 0.00000 0.00000 0.00000
4 4S -0.14801 0.00000 0.00000 0.00000 0.00000
5 5S 3.51155 0.00000 0.00000 0.00000 0.00000
6 6S 6.68096 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 -0.03106 0.00348
8 7PY 0.00000 0.00000 -0.03106 0.00000 0.00000
9 7PZ 0.00000 -0.03106 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 -0.20268 -0.05656
11 8PY 0.00000 0.00000 -0.20268 0.00000 0.00000
12 8PZ 0.00000 -0.20268 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 1.66433 1.09469
14 9PY 0.00000 0.00000 1.66433 0.00000 0.00000
15 9PZ 0.00000 1.66433 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 6.45750 3.06316
17 10PY 0.00000 0.00000 6.45750 0.00000 0.00000
18 10PZ 0.00000 6.45750 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 -0.70760 3.62605
20 11PY 0.00000 0.00000 -0.70760 0.00000 0.00000
21 11PZ 0.00000 -0.70760 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 -0.00523 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 -0.00523 -0.00922
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 -0.00523 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 0.01456 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.01456 0.03798
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.01456 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 0.72837 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.72837 0.21964
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.72837 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 1.72465 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 1.72465 1.05630
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 1.72465 0.00000 0.00000 0.00000
42 16F 0 0.00000 0.00311 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.00000 -0.00191 0.00139
44 16F-1 0.00000 0.00000 -0.00191 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-2 -0.00183 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.00000 0.00000 0.00246 -0.00179
48 16F-3 0.00000 0.00000 -0.00246 0.00000 0.00000
49 17F 0 0.00000 -0.06653 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.00000 0.04074 0.01037
51 17F-1 0.00000 0.00000 0.04074 0.00000 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
53 17F-2 0.06140 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.00000 0.00000 0.00000 -0.05260 -0.01339
55 17F-3 0.00000 0.00000 0.05260 0.00000 0.00000
56 18F 0 0.00000 -0.11612 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 0.00000 0.07111 0.02072
58 18F-1 0.00000 0.00000 0.07111 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
60 18F-2 0.22939 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.00000 0.00000 0.00000 -0.09180 -0.02676
62 18F-3 0.00000 0.00000 0.09180 0.00000 0.00000
63 19G 0 -0.00017 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 -0.00143 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 -0.00143 -0.00261
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00404 0.00000 0.00000 0.00000
68 19G+3 0.00000 0.00000 -0.00378 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.00378 0.00689
70 19G+4 -0.00015 0.00000 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 -0.02732 0.00000 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 -0.03555 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.00000 -0.03555 -0.01180
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.10056 0.00000 0.00000 0.00000
77 20G+3 0.00000 0.00000 -0.09406 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.09406 0.03122
79 20G+4 -0.02309 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 -0.00696 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 0.00000 -0.00586 -0.00062
83 21H-1 0.00000 0.00000 -0.00586 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 0.00018 0.00544
87 21H-3 0.00000 0.00000 -0.00018 0.00000 0.00000
88 21H+4 0.00000 -0.00435 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 -0.00574 -0.00303
91 21H-5 0.00000 0.00000 -0.00574 0.00000 0.00000
92 2 H 1S -0.00144 -0.00422 -0.00422 -0.00422 -0.00967
93 2S 0.03836 0.05254 0.05254 0.05254 0.03983
94 3S -0.48851 -0.94093 -0.94093 -0.94093 -0.48216
95 4S -1.44865 -5.29470 -5.29470 -5.29470 -3.02668
96 5S -1.18292 2.47685 2.47685 2.47685 -1.82592
97 6PX -0.00113 0.00129 0.00129 0.00064 0.00234
98 6PY -0.00113 0.00129 0.00064 0.00129 -0.00047
99 6PZ -0.00113 0.00064 0.00129 0.00129 -0.00047
100 7PX 0.00050 -0.00978 -0.00978 -0.00553 -0.01288
101 7PY 0.00050 -0.00978 -0.00553 -0.00978 -0.00653
102 7PZ 0.00050 -0.00553 -0.00978 -0.00978 -0.00653
103 8PX 0.06808 0.25923 0.25923 0.19365 0.11455
104 8PY 0.06808 0.25923 0.19365 0.25923 0.10982
105 8PZ 0.06808 0.19365 0.25923 0.25923 0.10982
106 9PX 0.34216 0.99356 0.99356 0.67299 0.37662
107 9PY 0.34216 0.99356 0.67299 0.99356 0.60879
108 9PZ 0.34216 0.67299 0.99356 0.99356 0.60879
109 10D 0 0.00000 -0.00150 0.00075 0.00075 0.00127
110 10D+1 0.00059 0.00164 0.00015 0.00164 0.00137
111 10D-1 0.00059 0.00164 0.00164 0.00015 0.00144
112 10D+2 0.00000 0.00000 0.00130 -0.00130 -0.00220
113 10D-2 0.00059 0.00015 0.00164 0.00164 0.00137
114 11D 0 0.00000 0.01101 -0.00551 -0.00551 -0.00651
115 11D+1 -0.00694 -0.01880 -0.01509 -0.01880 -0.00905
116 11D-1 -0.00694 -0.01880 -0.01880 -0.01509 -0.01116
117 11D+2 0.00000 0.00000 -0.00954 0.00954 0.01128
118 11D-2 -0.00694 -0.01509 -0.01880 -0.01880 -0.00905
119 12D 0 0.00000 0.05453 -0.02726 -0.02726 -0.01243
120 12D+1 -0.04171 -0.08963 -0.18070 -0.08963 -0.06374
121 12D-1 -0.04171 -0.08963 -0.08963 -0.18070 -0.11388
122 12D+2 0.00000 0.00000 -0.04722 0.04722 0.02153
123 12D-2 -0.04171 -0.18070 -0.08963 -0.08963 -0.06374
124 13F 0 -0.00003 -0.00077 -0.00049 -0.00049 -0.00015
125 13F+1 0.00002 0.00065 -0.00005 0.00047 -0.00004
126 13F-1 0.00002 0.00065 0.00047 -0.00005 -0.00045
127 13F+2 0.00000 0.00000 -0.00044 0.00044 0.00068
128 13F-2 0.00037 0.00126 0.00126 0.00126 0.00007
129 13F+3 -0.00002 -0.00012 -0.00066 -0.00061 0.00005
130 13F-3 0.00002 0.00012 0.00061 0.00066 0.00054
131 14F 0 -0.00439 -0.01224 -0.00579 -0.00579 -0.00463
132 14F+1 0.00269 -0.00664 0.01373 0.00750 0.00847
133 14F-1 0.00269 -0.00664 0.00750 0.01373 0.01224
134 14F+2 0.00000 0.00000 0.01288 -0.01288 -0.01190
135 14F-2 0.00812 0.01327 0.01327 0.01327 0.01524
136 14F+3 -0.00347 -0.01247 0.00331 -0.00968 -0.01093
137 14F-3 0.00347 0.01247 0.00968 -0.00331 -0.00363
138 15G 0 0.00019 0.00020 0.00074 0.00074 0.00056
139 15G+1 0.00020 0.00078 0.00002 -0.00018 -0.00022
140 15G-1 0.00020 0.00078 -0.00018 0.00002 0.00006
141 15G+2 0.00000 0.00000 -0.00048 0.00048 0.00024
142 15G-2 -0.00055 -0.00006 -0.00085 -0.00085 -0.00115
143 15G+3 0.00052 0.00061 0.00006 0.00097 0.00131
144 15G-3 -0.00052 -0.00061 -0.00097 -0.00006 -0.00016
145 15G+4 0.00016 0.00090 0.00026 0.00026 0.00029
146 15G-4 0.00000 0.00000 -0.00051 0.00051 0.00067
147 3 H 1S -0.00144 -0.00422 0.00422 0.00422 0.00967
148 2S 0.03836 0.05254 -0.05254 -0.05254 -0.03983
149 3S -0.48851 -0.94093 0.94093 0.94093 0.48216
150 4S -1.44865 -5.29470 5.29470 5.29470 3.02668
151 5S -1.18292 2.47685 -2.47685 -2.47685 1.82592
152 6PX 0.00113 -0.00129 0.00129 0.00064 0.00234
153 6PY 0.00113 -0.00129 0.00064 0.00129 -0.00047
154 6PZ -0.00113 0.00064 -0.00129 -0.00129 0.00047
155 7PX -0.00050 0.00978 -0.00978 -0.00553 -0.01288
156 7PY -0.00050 0.00978 -0.00553 -0.00978 -0.00653
157 7PZ 0.00050 -0.00553 0.00978 0.00978 0.00653
158 8PX -0.06808 -0.25923 0.25923 0.19365 0.11455
159 8PY -0.06808 -0.25923 0.19365 0.25923 0.10982
160 8PZ 0.06808 0.19365 -0.25923 -0.25923 -0.10982
161 9PX -0.34216 -0.99356 0.99356 0.67299 0.37662
162 9PY -0.34216 -0.99356 0.67299 0.99356 0.60879
163 9PZ 0.34216 0.67299 -0.99356 -0.99356 -0.60879
164 10D 0 0.00000 -0.00150 -0.00075 -0.00075 -0.00127
165 10D+1 -0.00059 -0.00164 0.00015 0.00164 0.00137
166 10D-1 -0.00059 -0.00164 0.00164 0.00015 0.00144
167 10D+2 0.00000 0.00000 -0.00130 0.00130 0.00220
168 10D-2 0.00059 0.00015 -0.00164 -0.00164 -0.00137
169 11D 0 0.00000 0.01101 0.00551 0.00551 0.00651
170 11D+1 0.00694 0.01880 -0.01509 -0.01880 -0.00905
171 11D-1 0.00694 0.01880 -0.01880 -0.01509 -0.01116
172 11D+2 0.00000 0.00000 0.00954 -0.00954 -0.01128
173 11D-2 -0.00694 -0.01509 0.01880 0.01880 0.00905
174 12D 0 0.00000 0.05453 0.02726 0.02726 0.01243
175 12D+1 0.04171 0.08963 -0.18070 -0.08963 -0.06374
176 12D-1 0.04171 0.08963 -0.08963 -0.18070 -0.11388
177 12D+2 0.00000 0.00000 0.04722 -0.04722 -0.02153
178 12D-2 -0.04171 -0.18070 0.08963 0.08963 0.06374
179 13F 0 -0.00003 -0.00077 0.00049 0.00049 0.00015
180 13F+1 -0.00002 -0.00065 -0.00005 0.00047 -0.00004
181 13F-1 -0.00002 -0.00065 0.00047 -0.00005 -0.00045
182 13F+2 0.00000 0.00000 0.00044 -0.00044 -0.00068
183 13F-2 0.00037 0.00126 -0.00126 -0.00126 -0.00007
184 13F+3 0.00002 0.00012 -0.00066 -0.00061 0.00005
185 13F-3 -0.00002 -0.00012 0.00061 0.00066 0.00054
186 14F 0 -0.00439 -0.01224 0.00579 0.00579 0.00463
187 14F+1 -0.00269 0.00664 0.01373 0.00750 0.00847
188 14F-1 -0.00269 0.00664 0.00750 0.01373 0.01224
189 14F+2 0.00000 0.00000 -0.01288 0.01288 0.01190
190 14F-2 0.00812 0.01327 -0.01327 -0.01327 -0.01524
191 14F+3 0.00347 0.01247 0.00331 -0.00968 -0.01093
192 14F-3 -0.00347 -0.01247 0.00968 -0.00331 -0.00363
193 15G 0 0.00019 0.00020 -0.00074 -0.00074 -0.00056
194 15G+1 -0.00020 -0.00078 0.00002 -0.00018 -0.00022
195 15G-1 -0.00020 -0.00078 -0.00018 0.00002 0.00006
196 15G+2 0.00000 0.00000 0.00048 -0.00048 -0.00024
197 15G-2 -0.00055 -0.00006 0.00085 0.00085 0.00115
198 15G+3 -0.00052 -0.00061 0.00006 0.00097 0.00131
199 15G-3 0.00052 0.00061 -0.00097 -0.00006 -0.00016
200 15G+4 0.00016 0.00090 -0.00026 -0.00026 -0.00029
201 15G-4 0.00000 0.00000 0.00051 -0.00051 -0.00067
202 4 H 1S -0.00144 0.00422 0.00422 -0.00422 -0.00967
203 2S 0.03836 -0.05254 -0.05254 0.05254 0.03983
204 3S -0.48851 0.94093 0.94093 -0.94093 -0.48216
205 4S -1.44865 5.29470 5.29470 -5.29470 -3.02668
206 5S -1.18292 -2.47685 -2.47685 2.47685 -1.82592
207 6PX -0.00113 -0.00129 -0.00129 0.00064 0.00234
208 6PY 0.00113 0.00129 0.00064 -0.00129 0.00047
209 6PZ 0.00113 0.00064 0.00129 -0.00129 0.00047
210 7PX 0.00050 0.00978 0.00978 -0.00553 -0.01288
211 7PY -0.00050 -0.00978 -0.00553 0.00978 0.00653
212 7PZ -0.00050 -0.00553 -0.00978 0.00978 0.00653
213 8PX 0.06808 -0.25923 -0.25923 0.19365 0.11455
214 8PY -0.06808 0.25923 0.19365 -0.25923 -0.10982
215 8PZ -0.06808 0.19365 0.25923 -0.25923 -0.10982
216 9PX 0.34216 -0.99356 -0.99356 0.67299 0.37662
217 9PY -0.34216 0.99356 0.67299 -0.99356 -0.60879
218 9PZ -0.34216 0.67299 0.99356 -0.99356 -0.60879
219 10D 0 0.00000 0.00150 -0.00075 0.00075 0.00127
220 10D+1 -0.00059 0.00164 0.00015 -0.00164 -0.00137
221 10D-1 0.00059 -0.00164 -0.00164 0.00015 0.00144
222 10D+2 0.00000 0.00000 -0.00130 -0.00130 -0.00220
223 10D-2 -0.00059 0.00015 0.00164 -0.00164 -0.00137
224 11D 0 0.00000 -0.01101 0.00551 -0.00551 -0.00651
225 11D+1 0.00694 -0.01880 -0.01509 0.01880 0.00905
226 11D-1 -0.00694 0.01880 0.01880 -0.01509 -0.01116
227 11D+2 0.00000 0.00000 0.00954 0.00954 0.01128
228 11D-2 0.00694 -0.01509 -0.01880 0.01880 0.00905
229 12D 0 0.00000 -0.05453 0.02726 -0.02726 -0.01243
230 12D+1 0.04171 -0.08963 -0.18070 0.08963 0.06374
231 12D-1 -0.04171 0.08963 0.08963 -0.18070 -0.11388
232 12D+2 0.00000 0.00000 0.04722 0.04722 0.02153
233 12D-2 0.04171 -0.18070 -0.08963 0.08963 0.06374
234 13F 0 0.00003 -0.00077 -0.00049 0.00049 0.00015
235 13F+1 0.00002 -0.00065 0.00005 0.00047 -0.00004
236 13F-1 -0.00002 0.00065 0.00047 0.00005 0.00045
237 13F+2 0.00000 0.00000 -0.00044 -0.00044 -0.00068
238 13F-2 0.00037 -0.00126 -0.00126 0.00126 0.00007
239 13F+3 -0.00002 0.00012 0.00066 -0.00061 0.00005
240 13F-3 -0.00002 0.00012 0.00061 -0.00066 -0.00054
241 14F 0 0.00439 -0.01224 -0.00579 0.00579 0.00463
242 14F+1 0.00269 0.00664 -0.01373 0.00750 0.00847
243 14F-1 -0.00269 -0.00664 0.00750 -0.01373 -0.01224
244 14F+2 0.00000 0.00000 0.01288 0.01288 0.01190
245 14F-2 0.00812 -0.01327 -0.01327 0.01327 0.01524
246 14F+3 -0.00347 0.01247 -0.00331 -0.00968 -0.01093
247 14F-3 -0.00347 0.01247 0.00968 0.00331 0.00363
248 15G 0 0.00019 -0.00020 -0.00074 0.00074 0.00056
249 15G+1 -0.00020 0.00078 0.00002 0.00018 0.00022
250 15G-1 0.00020 -0.00078 0.00018 0.00002 0.00006
251 15G+2 0.00000 0.00000 0.00048 0.00048 0.00024
252 15G-2 0.00055 -0.00006 -0.00085 0.00085 0.00115
253 15G+3 -0.00052 0.00061 0.00006 -0.00097 -0.00131
254 15G-3 -0.00052 0.00061 0.00097 -0.00006 -0.00016
255 15G+4 0.00016 -0.00090 -0.00026 0.00026 0.00029
256 15G-4 0.00000 0.00000 -0.00051 -0.00051 -0.00067
257 5 H 1S -0.00144 0.00422 -0.00422 0.00422 0.00967
258 2S 0.03836 -0.05254 0.05254 -0.05254 -0.03983
259 3S -0.48851 0.94093 -0.94093 0.94093 0.48216
260 4S -1.44865 5.29470 -5.29470 5.29470 3.02668
261 5S -1.18292 -2.47685 2.47685 -2.47685 1.82592
262 6PX 0.00113 0.00129 -0.00129 0.00064 0.00234
263 6PY -0.00113 -0.00129 0.00064 -0.00129 0.00047
264 6PZ 0.00113 0.00064 -0.00129 0.00129 -0.00047
265 7PX -0.00050 -0.00978 0.00978 -0.00553 -0.01288
266 7PY 0.00050 0.00978 -0.00553 0.00978 0.00653
267 7PZ -0.00050 -0.00553 0.00978 -0.00978 -0.00653
268 8PX -0.06808 0.25923 -0.25923 0.19365 0.11455
269 8PY 0.06808 -0.25923 0.19365 -0.25923 -0.10982
270 8PZ -0.06808 0.19365 -0.25923 0.25923 0.10982
271 9PX -0.34216 0.99356 -0.99356 0.67299 0.37662
272 9PY 0.34216 -0.99356 0.67299 -0.99356 -0.60879
273 9PZ -0.34216 0.67299 -0.99356 0.99356 0.60879
274 10D 0 0.00000 0.00150 0.00075 -0.00075 -0.00127
275 10D+1 0.00059 -0.00164 0.00015 -0.00164 -0.00137
276 10D-1 -0.00059 0.00164 -0.00164 0.00015 0.00144
277 10D+2 0.00000 0.00000 0.00130 0.00130 0.00220
278 10D-2 -0.00059 0.00015 -0.00164 0.00164 0.00137
279 11D 0 0.00000 -0.01101 -0.00551 0.00551 0.00651
280 11D+1 -0.00694 0.01880 -0.01509 0.01880 0.00905
281 11D-1 0.00694 -0.01880 0.01880 -0.01509 -0.01116
282 11D+2 0.00000 0.00000 -0.00954 -0.00954 -0.01128
283 11D-2 0.00694 -0.01509 0.01880 -0.01880 -0.00905
284 12D 0 0.00000 -0.05453 -0.02726 0.02726 0.01243
285 12D+1 -0.04171 0.08963 -0.18070 0.08963 0.06374
286 12D-1 0.04171 -0.08963 0.08963 -0.18070 -0.11388
287 12D+2 0.00000 0.00000 -0.04722 -0.04722 -0.02153
288 12D-2 0.04171 -0.18070 0.08963 -0.08963 -0.06374
289 13F 0 0.00003 -0.00077 0.00049 -0.00049 -0.00015
290 13F+1 -0.00002 0.00065 0.00005 0.00047 -0.00004
291 13F-1 0.00002 -0.00065 0.00047 0.00005 0.00045
292 13F+2 0.00000 0.00000 0.00044 0.00044 0.00068
293 13F-2 0.00037 -0.00126 0.00126 -0.00126 -0.00007
294 13F+3 0.00002 -0.00012 0.00066 -0.00061 0.00005
295 13F-3 0.00002 -0.00012 0.00061 -0.00066 -0.00054
296 14F 0 0.00439 -0.01224 0.00579 -0.00579 -0.00463
297 14F+1 -0.00269 -0.00664 -0.01373 0.00750 0.00847
298 14F-1 0.00269 0.00664 0.00750 -0.01373 -0.01224
299 14F+2 0.00000 0.00000 -0.01288 -0.01288 -0.01190
300 14F-2 0.00812 -0.01327 0.01327 -0.01327 -0.01524
301 14F+3 0.00347 -0.01247 -0.00331 -0.00968 -0.01093
302 14F-3 0.00347 -0.01247 0.00968 0.00331 0.00363
303 15G 0 0.00019 -0.00020 0.00074 -0.00074 -0.00056
304 15G+1 0.00020 -0.00078 0.00002 0.00018 0.00022
305 15G-1 -0.00020 0.00078 0.00018 0.00002 0.00006
306 15G+2 0.00000 0.00000 -0.00048 -0.00048 -0.00024
307 15G-2 0.00055 -0.00006 0.00085 -0.00085 -0.00115
308 15G+3 0.00052 -0.00061 0.00006 -0.00097 -0.00131
309 15G-3 0.00052 -0.00061 0.00097 -0.00006 -0.00016
310 15G+4 0.00016 -0.00090 0.00026 -0.00026 -0.00029
311 15G-4 0.00000 0.00000 0.00051 0.00051 0.00067
11 12 13 14 15
(T2)--V (T2)--V (A1)--V (T2)--V (T2)--V
Eigenvalues -- 0.21012 0.21012 0.39720 0.44880 0.44880
1 1 C 1S 0.00000 0.00000 0.04523 0.00000 0.00000
2 2S 0.00000 0.00000 -0.12629 0.00000 0.00000
3 3S 0.00000 0.00000 -0.18652 0.00000 0.00000
4 4S 0.00000 0.00000 -1.55101 0.00000 0.00000
5 5S 0.00000 0.00000 16.65120 0.00000 0.00000
6 6S 0.00000 0.00000 23.64090 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
8 7PY 0.00348 0.00000 0.00000 0.00000 0.08566
9 7PZ 0.00000 0.00348 0.00000 0.08566 0.00000
10 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
11 8PY -0.05656 0.00000 0.00000 0.00000 -0.07223
12 8PZ 0.00000 -0.05656 0.00000 -0.07223 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
14 9PY 1.09469 0.00000 0.00000 0.00000 2.40921
15 9PZ 0.00000 1.09469 0.00000 2.40921 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
17 10PY 3.06316 0.00000 0.00000 0.00000 10.18928
18 10PZ 0.00000 3.06316 0.00000 10.18928 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
20 11PY 3.62605 0.00000 0.00000 0.00000 -2.37890
21 11PZ 0.00000 3.62605 0.00000 -2.37890 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 -0.00922 0.00000 0.00000 0.00000 -0.00279
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 -0.00922 0.00000 -0.00279 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.03798 0.00000 0.00000 0.00000 -0.03973
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 0.03798 0.00000 -0.03973 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.21964 0.00000 0.00000 0.00000 1.26110
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 0.21964 0.00000 1.26110 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 1.05630 0.00000 0.00000 0.00000 2.36298
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 1.05630 0.00000 2.36298 0.00000
42 16F 0 0.00000 -0.00226 0.00000 0.01076 0.00000
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F-1 0.00139 0.00000 0.00000 0.00000 -0.00659
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-2 0.00000 0.00000 -0.01463 0.00000 0.00000
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
48 16F-3 0.00179 0.00000 0.00000 0.00000 -0.00851
49 17F 0 0.00000 -0.01693 0.00000 -0.12560 0.00000
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
51 17F-1 0.01037 0.00000 0.00000 0.00000 0.07692
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.31000 0.00000 0.00000
54 17F+3 0.00000 0.00000 0.00000 0.00000 0.00000
55 17F-3 0.01339 0.00000 0.00000 0.00000 0.09930
56 18F 0 0.00000 -0.03384 0.00000 -0.28530 0.00000
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
58 18F-1 0.02072 0.00000 0.00000 0.00000 0.17471
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
60 18F-2 0.00000 0.00000 1.01268 0.00000 0.00000
61 18F+3 0.00000 0.00000 0.00000 0.00000 0.00000
62 18F-3 0.02676 0.00000 0.00000 0.00000 0.22555
63 19G 0 0.00000 0.00000 -0.00248 0.00000 0.00000
64 19G+1 -0.00261 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 0.00737 0.00000 0.00001 0.00000
68 19G+3 -0.00689 0.00000 0.00000 0.00000 -0.00001
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 -0.00209 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 -0.11151 0.00000 0.00000
73 20G+1 -0.01180 0.00000 0.00000 0.00000 -0.05606
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 0.03338 0.00000 0.15856 0.00000
77 20G+3 -0.03122 0.00000 0.00000 0.00000 -0.14832
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 -0.09424 0.00000 0.00000
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 -0.00527 0.00000 -0.00642 0.00000
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
83 21H-1 -0.00062 0.00000 0.00000 0.00000 -0.01161
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 -0.00544 0.00000 0.00000 0.00000 0.00845
88 21H+4 0.00000 0.00338 0.00000 -0.01484 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 -0.00303 0.00000 0.00000 0.00000 -0.00744
92 2 H 1S -0.00967 -0.00967 -0.00241 -0.00749 -0.00749
93 2S 0.03983 0.03983 0.12407 0.03375 0.03375
94 3S -0.48216 -0.48216 -2.03936 -1.50287 -1.50287
95 4S -3.02668 -3.02668 -7.78078 -7.40029 -7.40029
96 5S -1.82592 -1.82592 -1.85425 2.91559 2.91559
97 6PX -0.00047 -0.00047 0.00074 0.00073 0.00073
98 6PY 0.00234 -0.00047 0.00074 0.00073 -0.00141
99 6PZ -0.00047 0.00234 0.00074 -0.00141 0.00073
100 7PX -0.00653 -0.00653 -0.01068 -0.01506 -0.01506
101 7PY -0.01288 -0.00653 -0.01068 -0.01506 0.00321
102 7PZ -0.00653 -0.01288 -0.01068 0.00321 -0.01506
103 8PX 0.10982 0.10982 0.41959 0.36879 0.36879
104 8PY 0.11455 0.10982 0.41959 0.36879 0.29032
105 8PZ 0.10982 0.11455 0.41959 0.29032 0.36879
106 9PX 0.60879 0.60879 1.57310 1.18479 1.18479
107 9PY 0.37662 0.60879 1.57310 1.18479 0.97467
108 9PZ 0.60879 0.37662 1.57310 0.97467 1.18479
109 10D 0 0.00127 -0.00254 0.00000 -0.00013 0.00006
110 10D+1 0.00144 0.00137 0.00206 0.00193 -0.00080
111 10D-1 0.00137 0.00137 0.00206 0.00193 0.00193
112 10D+2 0.00220 0.00000 0.00000 0.00000 0.00011
113 10D-2 0.00137 0.00144 0.00206 -0.00080 0.00193
114 11D 0 -0.00651 0.01303 0.00000 0.00229 -0.00115
115 11D+1 -0.01116 -0.00905 -0.03437 -0.02997 -0.01883
116 11D-1 -0.00905 -0.00905 -0.03437 -0.02997 -0.02997
117 11D+2 -0.01128 0.00000 0.00000 0.00000 -0.00199
118 11D-2 -0.00905 -0.01116 -0.03437 -0.01883 -0.02997
119 12D 0 -0.01243 0.02486 0.00000 0.05571 -0.02786
120 12D+1 -0.11388 -0.06374 -0.20709 -0.10921 -0.20082
121 12D-1 -0.06374 -0.06374 -0.20709 -0.10921 -0.10921
122 12D+2 -0.02153 0.00000 0.00000 0.00000 -0.04825
123 12D-2 -0.06374 -0.11388 -0.20709 -0.20082 -0.10921
124 13F 0 -0.00015 0.00006 -0.00095 -0.00147 -0.00114
125 13F+1 -0.00045 0.00064 0.00058 0.00078 0.00062
126 13F-1 -0.00004 0.00064 0.00058 0.00078 0.00090
127 13F+2 -0.00068 0.00000 0.00000 0.00000 -0.00010
128 13F-2 0.00007 0.00007 0.00286 0.00245 0.00245
129 13F+3 -0.00054 0.00030 -0.00075 -0.00084 -0.00096
130 13F-3 -0.00005 -0.00030 0.00075 0.00084 0.00116
131 14F 0 -0.00463 -0.01383 -0.01745 -0.00600 -0.00539
132 14F+1 0.01224 -0.00658 0.01069 -0.00216 0.00876
133 14F-1 0.00847 -0.00658 0.01069 -0.00216 0.00368
134 14F+2 0.01190 0.00000 0.00000 0.00000 0.00691
135 14F-2 0.01524 0.01524 0.03160 0.00851 0.00851
136 14F+3 0.00363 -0.01095 -0.01380 -0.00849 -0.00003
137 14F-3 0.01093 0.01095 0.01380 0.00849 0.00474
138 15G 0 0.00056 0.00029 0.00100 0.00004 0.00062
139 15G+1 0.00006 0.00104 0.00072 0.00004 0.00004
140 15G-1 -0.00022 0.00104 0.00072 0.00004 0.00004
141 15G+2 -0.00024 0.00000 0.00000 0.00000 -0.00052
142 15G-2 -0.00115 -0.00018 -0.00202 -0.00013 -0.00012
143 15G+3 0.00016 0.00084 0.00189 0.00011 0.00012
144 15G-3 -0.00131 -0.00084 -0.00189 -0.00011 -0.00011
145 15G+4 0.00029 0.00061 0.00084 0.00081 0.00013
146 15G-4 -0.00067 0.00000 0.00000 0.00000 0.00000
147 3 H 1S 0.00967 -0.00967 -0.00241 -0.00749 0.00749
148 2S -0.03983 0.03983 0.12407 0.03375 -0.03375
149 3S 0.48216 -0.48216 -2.03936 -1.50287 1.50287
150 4S 3.02668 -3.02668 -7.78078 -7.40029 7.40029
151 5S 1.82592 -1.82592 -1.85425 2.91559 -2.91559
152 6PX -0.00047 0.00047 -0.00074 -0.00073 0.00073
153 6PY 0.00234 0.00047 -0.00074 -0.00073 -0.00141
154 6PZ 0.00047 0.00234 0.00074 -0.00141 -0.00073
155 7PX -0.00653 0.00653 0.01068 0.01506 -0.01506
156 7PY -0.01288 0.00653 0.01068 0.01506 0.00321
157 7PZ 0.00653 -0.01288 -0.01068 0.00321 0.01506
158 8PX 0.10982 -0.10982 -0.41959 -0.36879 0.36879
159 8PY 0.11455 -0.10982 -0.41959 -0.36879 0.29032
160 8PZ -0.10982 0.11455 0.41959 0.29032 -0.36879
161 9PX 0.60879 -0.60879 -1.57310 -1.18479 1.18479
162 9PY 0.37662 -0.60879 -1.57310 -1.18479 0.97467
163 9PZ -0.60879 0.37662 1.57310 0.97467 -1.18479
164 10D 0 -0.00127 -0.00254 0.00000 -0.00013 -0.00006
165 10D+1 0.00144 -0.00137 -0.00206 -0.00193 -0.00080
166 10D-1 0.00137 -0.00137 -0.00206 -0.00193 0.00193
167 10D+2 -0.00220 0.00000 0.00000 0.00000 -0.00011
168 10D-2 -0.00137 0.00144 0.00206 -0.00080 -0.00193
169 11D 0 0.00651 0.01303 0.00000 0.00229 0.00115
170 11D+1 -0.01116 0.00905 0.03437 0.02997 -0.01883
171 11D-1 -0.00905 0.00905 0.03437 0.02997 -0.02997
172 11D+2 0.01128 0.00000 0.00000 0.00000 0.00199
173 11D-2 0.00905 -0.01116 -0.03437 -0.01883 0.02997
174 12D 0 0.01243 0.02486 0.00000 0.05571 0.02786
175 12D+1 -0.11388 0.06374 0.20709 0.10921 -0.20082
176 12D-1 -0.06374 0.06374 0.20709 0.10921 -0.10921
177 12D+2 0.02153 0.00000 0.00000 0.00000 0.04825
178 12D-2 0.06374 -0.11388 -0.20709 -0.20082 0.10921
179 13F 0 0.00015 0.00006 -0.00095 -0.00147 0.00114
180 13F+1 -0.00045 -0.00064 -0.00058 -0.00078 0.00062
181 13F-1 -0.00004 -0.00064 -0.00058 -0.00078 0.00090
182 13F+2 0.00068 0.00000 0.00000 0.00000 0.00010
183 13F-2 -0.00007 0.00007 0.00286 0.00245 -0.00245
184 13F+3 -0.00054 -0.00030 0.00075 0.00084 -0.00096
185 13F-3 -0.00005 0.00030 -0.00075 -0.00084 0.00116
186 14F 0 0.00463 -0.01383 -0.01745 -0.00600 0.00539
187 14F+1 0.01224 0.00658 -0.01069 0.00216 0.00876
188 14F-1 0.00847 0.00658 -0.01069 0.00216 0.00368
189 14F+2 -0.01190 0.00000 0.00000 0.00000 -0.00691
190 14F-2 -0.01524 0.01524 0.03160 0.00851 -0.00851
191 14F+3 0.00363 0.01095 0.01380 0.00849 -0.00003
192 14F-3 0.01093 -0.01095 -0.01380 -0.00849 0.00474
193 15G 0 -0.00056 0.00029 0.00100 0.00004 -0.00062
194 15G+1 0.00006 -0.00104 -0.00072 -0.00004 0.00004
195 15G-1 -0.00022 -0.00104 -0.00072 -0.00004 0.00004
196 15G+2 0.00024 0.00000 0.00000 0.00000 0.00052
197 15G-2 0.00115 -0.00018 -0.00202 -0.00013 0.00012
198 15G+3 0.00016 -0.00084 -0.00189 -0.00011 0.00012
199 15G-3 -0.00131 0.00084 0.00189 0.00011 -0.00011
200 15G+4 -0.00029 0.00061 0.00084 0.00081 -0.00013
201 15G-4 0.00067 0.00000 0.00000 0.00000 0.00000
202 4 H 1S 0.00967 0.00967 -0.00241 0.00749 0.00749
203 2S -0.03983 -0.03983 0.12407 -0.03375 -0.03375
204 3S 0.48216 0.48216 -2.03936 1.50287 1.50287
205 4S 3.02668 3.02668 -7.78078 7.40029 7.40029
206 5S 1.82592 1.82592 -1.85425 -2.91559 -2.91559
207 6PX 0.00047 0.00047 0.00074 -0.00073 -0.00073
208 6PY 0.00234 -0.00047 -0.00074 0.00073 -0.00141
209 6PZ -0.00047 0.00234 -0.00074 -0.00141 0.00073
210 7PX 0.00653 0.00653 -0.01068 0.01506 0.01506
211 7PY -0.01288 -0.00653 0.01068 -0.01506 0.00321
212 7PZ -0.00653 -0.01288 0.01068 0.00321 -0.01506
213 8PX -0.10982 -0.10982 0.41959 -0.36879 -0.36879
214 8PY 0.11455 0.10982 -0.41959 0.36879 0.29032
215 8PZ 0.10982 0.11455 -0.41959 0.29032 0.36879
216 9PX -0.60879 -0.60879 1.57310 -1.18479 -1.18479
217 9PY 0.37662 0.60879 -1.57310 1.18479 0.97467
218 9PZ 0.60879 0.37662 -1.57310 0.97467 1.18479
219 10D 0 -0.00127 0.00254 0.00000 0.00013 -0.00006
220 10D+1 0.00144 0.00137 -0.00206 0.00193 -0.00080
221 10D-1 -0.00137 -0.00137 0.00206 -0.00193 -0.00193
222 10D+2 -0.00220 0.00000 0.00000 0.00000 -0.00011
223 10D-2 0.00137 0.00144 -0.00206 -0.00080 0.00193
224 11D 0 0.00651 -0.01303 0.00000 -0.00229 0.00115
225 11D+1 -0.01116 -0.00905 0.03437 -0.02997 -0.01883
226 11D-1 0.00905 0.00905 -0.03437 0.02997 0.02997
227 11D+2 0.01128 0.00000 0.00000 0.00000 0.00199
228 11D-2 -0.00905 -0.01116 0.03437 -0.01883 -0.02997
229 12D 0 0.01243 -0.02486 0.00000 -0.05571 0.02786
230 12D+1 -0.11388 -0.06374 0.20709 -0.10921 -0.20082
231 12D-1 0.06374 0.06374 -0.20709 0.10921 0.10921
232 12D+2 0.02153 0.00000 0.00000 0.00000 0.04825
233 12D-2 -0.06374 -0.11388 0.20709 -0.20082 -0.10921
234 13F 0 -0.00015 0.00006 0.00095 -0.00147 -0.00114
235 13F+1 0.00045 -0.00064 0.00058 -0.00078 -0.00062
236 13F-1 -0.00004 0.00064 -0.00058 0.00078 0.00090
237 13F+2 -0.00068 0.00000 0.00000 0.00000 -0.00010
238 13F-2 -0.00007 -0.00007 0.00286 -0.00245 -0.00245
239 13F+3 0.00054 -0.00030 -0.00075 0.00084 0.00096
240 13F-3 -0.00005 -0.00030 -0.00075 0.00084 0.00116
241 14F 0 -0.00463 -0.01383 0.01745 -0.00600 -0.00539
242 14F+1 -0.01224 0.00658 0.01069 0.00216 -0.00876
243 14F-1 0.00847 -0.00658 -0.01069 -0.00216 0.00368
244 14F+2 0.01190 0.00000 0.00000 0.00000 0.00691
245 14F-2 -0.01524 -0.01524 0.03160 -0.00851 -0.00851
246 14F+3 -0.00363 0.01095 -0.01380 0.00849 0.00003
247 14F-3 0.01093 0.01095 -0.01380 0.00849 0.00474
248 15G 0 -0.00056 -0.00029 0.00100 -0.00004 -0.00062
249 15G+1 0.00006 0.00104 -0.00072 0.00004 0.00004
250 15G-1 0.00022 -0.00104 0.00072 -0.00004 -0.00004
251 15G+2 0.00024 0.00000 0.00000 0.00000 0.00052
252 15G-2 -0.00115 -0.00018 0.00202 -0.00013 -0.00012
253 15G+3 0.00016 0.00084 -0.00189 0.00011 0.00012
254 15G-3 0.00131 0.00084 -0.00189 0.00011 0.00011
255 15G+4 -0.00029 -0.00061 0.00084 -0.00081 -0.00013
256 15G-4 -0.00067 0.00000 0.00000 0.00000 0.00000
257 5 H 1S -0.00967 0.00967 -0.00241 0.00749 -0.00749
258 2S 0.03983 -0.03983 0.12407 -0.03375 0.03375
259 3S -0.48216 0.48216 -2.03936 1.50287 -1.50287
260 4S -3.02668 3.02668 -7.78078 7.40029 -7.40029
261 5S -1.82592 1.82592 -1.85425 -2.91559 2.91559
262 6PX 0.00047 -0.00047 -0.00074 0.00073 -0.00073
263 6PY 0.00234 0.00047 0.00074 -0.00073 -0.00141
264 6PZ 0.00047 0.00234 -0.00074 -0.00141 -0.00073
265 7PX 0.00653 -0.00653 0.01068 -0.01506 0.01506
266 7PY -0.01288 0.00653 -0.01068 0.01506 0.00321
267 7PZ 0.00653 -0.01288 0.01068 0.00321 0.01506
268 8PX -0.10982 0.10982 -0.41959 0.36879 -0.36879
269 8PY 0.11455 -0.10982 0.41959 -0.36879 0.29032
270 8PZ -0.10982 0.11455 -0.41959 0.29032 -0.36879
271 9PX -0.60879 0.60879 -1.57310 1.18479 -1.18479
272 9PY 0.37662 -0.60879 1.57310 -1.18479 0.97467
273 9PZ -0.60879 0.37662 -1.57310 0.97467 -1.18479
274 10D 0 0.00127 0.00254 0.00000 0.00013 0.00006
275 10D+1 0.00144 -0.00137 0.00206 -0.00193 -0.00080
276 10D-1 -0.00137 0.00137 -0.00206 0.00193 -0.00193
277 10D+2 0.00220 0.00000 0.00000 0.00000 0.00011
278 10D-2 -0.00137 0.00144 -0.00206 -0.00080 -0.00193
279 11D 0 -0.00651 -0.01303 0.00000 -0.00229 -0.00115
280 11D+1 -0.01116 0.00905 -0.03437 0.02997 -0.01883
281 11D-1 0.00905 -0.00905 0.03437 -0.02997 0.02997
282 11D+2 -0.01128 0.00000 0.00000 0.00000 -0.00199
283 11D-2 0.00905 -0.01116 0.03437 -0.01883 0.02997
284 12D 0 -0.01243 -0.02486 0.00000 -0.05571 -0.02786
285 12D+1 -0.11388 0.06374 -0.20709 0.10921 -0.20082
286 12D-1 0.06374 -0.06374 0.20709 -0.10921 0.10921
287 12D+2 -0.02153 0.00000 0.00000 0.00000 -0.04825
288 12D-2 0.06374 -0.11388 0.20709 -0.20082 0.10921
289 13F 0 0.00015 0.00006 0.00095 -0.00147 0.00114
290 13F+1 0.00045 0.00064 -0.00058 0.00078 -0.00062
291 13F-1 -0.00004 -0.00064 0.00058 -0.00078 0.00090
292 13F+2 0.00068 0.00000 0.00000 0.00000 0.00010
293 13F-2 0.00007 -0.00007 0.00286 -0.00245 0.00245
294 13F+3 0.00054 0.00030 0.00075 -0.00084 0.00096
295 13F-3 -0.00005 0.00030 0.00075 -0.00084 0.00116
296 14F 0 0.00463 -0.01383 0.01745 -0.00600 0.00539
297 14F+1 -0.01224 -0.00658 -0.01069 -0.00216 -0.00876
298 14F-1 0.00847 0.00658 0.01069 0.00216 0.00368
299 14F+2 -0.01190 0.00000 0.00000 0.00000 -0.00691
300 14F-2 0.01524 -0.01524 0.03160 -0.00851 0.00851
301 14F+3 -0.00363 -0.01095 0.01380 -0.00849 0.00003
302 14F-3 0.01093 -0.01095 0.01380 -0.00849 0.00474
303 15G 0 0.00056 -0.00029 0.00100 -0.00004 0.00062
304 15G+1 0.00006 -0.00104 0.00072 -0.00004 0.00004
305 15G-1 0.00022 0.00104 -0.00072 0.00004 -0.00004
306 15G+2 -0.00024 0.00000 0.00000 0.00000 -0.00052
307 15G-2 0.00115 -0.00018 0.00202 -0.00013 0.00012
308 15G+3 0.00016 -0.00084 0.00189 -0.00011 0.00012
309 15G-3 0.00131 -0.00084 0.00189 -0.00011 0.00011
310 15G+4 0.00029 -0.00061 0.00084 -0.00081 0.00013
311 15G-4 0.00067 0.00000 0.00000 0.00000 0.00000
16 17 18 19 20
(T2)--V (E)--V (E)--V (A1)--V (T2)--V
Eigenvalues -- 0.44880 0.46495 0.46495 0.50129 0.58908
1 1 C 1S 0.00000 0.00000 0.00000 -0.05167 0.00000
2 2S 0.00000 0.00000 0.00000 0.08384 0.00000
3 3S 0.00000 0.00000 0.00000 -0.05741 0.00000
4 4S 0.00000 0.00000 0.00000 -0.71238 0.00000
5 5S 0.00000 0.00000 0.00000 8.44021 0.00000
6 6S 0.00000 0.00000 0.00000 10.46275 0.00000
7 7PX 0.08566 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 0.02159
10 8PX -0.07223 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 -0.41866
13 9PX 2.40921 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 4.57448
16 10PX 10.18928 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 17.67555
19 11PX -2.37890 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 2.02229
22 12D 0 0.00000 0.00051 0.00005 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
24 12D-1 -0.00279 0.00000 0.00000 0.00000 0.00000
25 12D+2 0.00000 -0.00005 0.00051 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 -0.01149
27 13D 0 0.00000 -0.06982 -0.00711 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
29 13D-1 -0.03973 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00711 -0.06982 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.04346
32 14D 0 0.00000 0.88723 0.09032 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
34 14D-1 1.26110 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.00000 -0.09032 0.88723 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 2.46669
37 15D 0 0.00000 0.00488 0.00050 0.00000 0.00000
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
39 15D-1 2.36298 0.00000 0.00000 0.00000 0.00000
40 15D+2 0.00000 -0.00050 0.00488 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 0.00000 6.89293
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.01069
43 16F+1 -0.00659 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 -0.01113 0.00000
47 16F+3 0.00851 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 -0.23200
50 17F+1 0.07692 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 0.14766 0.00000
54 17F+3 -0.09930 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 -0.95129
57 18F+1 0.17471 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 0.40287 0.00000
61 18F+3 -0.22555 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 -0.00561 -0.00057 -0.00189 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 -0.00088 0.00869 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.01798
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
69 19G-3 0.00001 0.00000 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00664 0.00068 -0.00160 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 -0.04927 -0.00502 -0.03692 0.00000
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
74 20G-1 -0.05606 0.00000 0.00000 0.00000 0.00000
75 20G+2 0.00000 -0.00777 0.07633 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.24298
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
78 20G-3 0.14832 0.00000 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.05830 0.00594 -0.03121 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 -0.01313
82 21H+1 -0.01161 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 0.03900 0.00397 0.00000 0.00000
86 21H+3 -0.00845 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 -0.01881
89 21H-4 0.00000 -0.00397 0.03900 0.00000 0.00000
90 21H+5 -0.00744 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 -0.00749 0.00000 0.00000 -0.00620 0.00919
93 2S 0.03375 0.00000 0.00000 -0.03663 0.23739
94 3S -1.50287 0.00000 0.00000 -0.64458 -3.28555
95 4S -7.40029 0.00000 0.00000 -4.94614 -13.73711
96 5S 2.91559 0.00000 0.00000 -0.09366 0.58332
97 6PX -0.00141 -0.00198 0.00274 0.00369 -0.00308
98 6PY 0.00073 -0.00139 -0.00308 0.00369 -0.00308
99 6PZ 0.00073 0.00336 0.00034 0.00369 0.00306
100 7PX 0.00321 0.00908 -0.01259 -0.02837 -0.00008
101 7PY -0.01506 0.00636 0.01416 -0.02837 -0.00008
102 7PZ -0.01506 -0.01544 -0.00157 -0.02837 -0.03667
103 8PX 0.29032 0.05170 -0.07166 0.24817 0.65182
104 8PY 0.36879 0.03620 0.08061 0.24817 0.65182
105 8PZ 0.36879 -0.08791 -0.00895 0.24817 0.72670
106 9PX 0.97467 0.31517 -0.43679 0.49080 2.40617
107 9PY 1.18479 0.22068 0.49134 0.49080 2.40617
108 9PZ 1.18479 -0.53585 -0.05455 0.49080 2.02043
109 10D 0 0.00006 -0.00687 -0.00070 0.00000 -0.00530
110 10D+1 0.00193 -0.00161 -0.00358 0.00060 0.00686
111 10D-1 -0.00080 -0.00229 0.00318 0.00060 0.00686
112 10D+2 -0.00011 0.00070 -0.00687 0.00000 0.00000
113 10D-2 0.00193 0.00390 0.00040 0.00060 0.00435
114 11D 0 -0.00115 0.04515 0.00460 0.00000 0.03078
115 11D+1 -0.02997 0.01044 0.02324 -0.01390 -0.07010
116 11D-1 -0.01883 0.01491 -0.02066 -0.01390 -0.07010
117 11D+2 0.00199 -0.00460 0.04515 0.00000 0.00000
118 11D-2 -0.02997 -0.02534 -0.00258 -0.01390 -0.06276
119 12D 0 -0.02786 0.15700 0.01598 0.00000 0.01894
120 12D+1 -0.10921 0.04090 0.09105 -0.09151 -0.23631
121 12D-1 -0.20082 0.05841 -0.08095 -0.09151 -0.23631
122 12D+2 0.04825 -0.01598 0.15700 0.00000 0.00000
123 12D-2 -0.10921 -0.09930 -0.01011 -0.09151 -0.29529
124 13F 0 -0.00114 0.00081 0.00008 -0.00097 -0.00190
125 13F+1 0.00090 0.00105 0.00014 0.00060 0.00307
126 13F-1 0.00062 0.00106 0.00007 0.00060 0.00307
127 13F+2 0.00010 -0.00012 0.00118 0.00000 0.00000
128 13F-2 0.00245 0.00000 0.00000 0.00213 0.00304
129 13F+3 -0.00116 0.00021 0.00095 -0.00077 -0.00206
130 13F-3 0.00096 -0.00040 0.00089 0.00077 0.00206
131 14F 0 -0.00539 -0.02457 -0.00250 -0.00392 -0.02883
132 14F+1 0.00368 -0.04439 -0.01338 0.00240 -0.01157
133 14F-1 0.00876 -0.04618 0.00416 0.00240 -0.01157
134 14F+2 -0.00691 0.00562 -0.05516 0.00000 0.00000
135 14F-2 0.00851 0.00000 0.00000 0.00544 0.03860
136 14F+3 -0.00474 -0.01611 -0.03570 -0.00310 -0.01603
137 14F-3 0.00003 0.02297 -0.03172 0.00310 0.01603
138 15G 0 0.00062 -0.00164 -0.00017 0.00034 0.00023
139 15G+1 0.00004 0.00241 0.00008 0.00008 0.00163
140 15G-1 0.00004 0.00237 0.00041 0.00008 0.00163
141 15G+2 0.00052 -0.00026 0.00254 0.00000 0.00000
142 15G-2 -0.00012 0.00297 0.00030 -0.00023 -0.00074
143 15G+3 0.00011 0.00040 0.00288 0.00021 0.00146
144 15G-3 -0.00012 -0.00097 0.00274 -0.00021 -0.00146
145 15G+4 0.00013 0.00194 0.00020 0.00029 0.00134
146 15G-4 0.00000 -0.00023 0.00230 0.00000 0.00000
147 3 H 1S 0.00749 0.00000 0.00000 -0.00620 0.00919
148 2S -0.03375 0.00000 0.00000 -0.03663 0.23739
149 3S 1.50287 0.00000 0.00000 -0.64458 -3.28555
150 4S 7.40029 0.00000 0.00000 -4.94614 -13.73711
151 5S -2.91559 0.00000 0.00000 -0.09366 0.58332
152 6PX -0.00141 0.00198 -0.00274 -0.00369 0.00308
153 6PY 0.00073 0.00139 0.00308 -0.00369 0.00308
154 6PZ -0.00073 0.00336 0.00034 0.00369 0.00306
155 7PX 0.00321 -0.00908 0.01259 0.02837 0.00008
156 7PY -0.01506 -0.00636 -0.01416 0.02837 0.00008
157 7PZ 0.01506 -0.01544 -0.00157 -0.02837 -0.03667
158 8PX 0.29032 -0.05170 0.07166 -0.24817 -0.65182
159 8PY 0.36879 -0.03620 -0.08061 -0.24817 -0.65182
160 8PZ -0.36879 -0.08791 -0.00895 0.24817 0.72670
161 9PX 0.97467 -0.31517 0.43679 -0.49080 -2.40617
162 9PY 1.18479 -0.22068 -0.49134 -0.49080 -2.40617
163 9PZ -1.18479 -0.53585 -0.05455 0.49080 2.02043
164 10D 0 -0.00006 -0.00687 -0.00070 0.00000 -0.00530
165 10D+1 0.00193 0.00161 0.00358 -0.00060 -0.00686
166 10D-1 -0.00080 0.00229 -0.00318 -0.00060 -0.00686
167 10D+2 0.00011 0.00070 -0.00687 0.00000 0.00000
168 10D-2 -0.00193 0.00390 0.00040 0.00060 0.00435
169 11D 0 0.00115 0.04515 0.00460 0.00000 0.03078
170 11D+1 -0.02997 -0.01044 -0.02324 0.01390 0.07010
171 11D-1 -0.01883 -0.01491 0.02066 0.01390 0.07010
172 11D+2 -0.00199 -0.00460 0.04515 0.00000 0.00000
173 11D-2 0.02997 -0.02534 -0.00258 -0.01390 -0.06276
174 12D 0 0.02786 0.15700 0.01598 0.00000 0.01894
175 12D+1 -0.10921 -0.04090 -0.09105 0.09151 0.23631
176 12D-1 -0.20082 -0.05841 0.08095 0.09151 0.23631
177 12D+2 -0.04825 -0.01598 0.15700 0.00000 0.00000
178 12D-2 0.10921 -0.09930 -0.01011 -0.09151 -0.29529
179 13F 0 0.00114 0.00081 0.00008 -0.00097 -0.00190
180 13F+1 0.00090 -0.00105 -0.00014 -0.00060 -0.00307
181 13F-1 0.00062 -0.00106 -0.00007 -0.00060 -0.00307
182 13F+2 -0.00010 -0.00012 0.00118 0.00000 0.00000
183 13F-2 -0.00245 0.00000 0.00000 0.00213 0.00304
184 13F+3 -0.00116 -0.00021 -0.00095 0.00077 0.00206
185 13F-3 0.00096 0.00040 -0.00089 -0.00077 -0.00206
186 14F 0 0.00539 -0.02457 -0.00250 -0.00392 -0.02883
187 14F+1 0.00368 0.04439 0.01338 -0.00240 0.01157
188 14F-1 0.00876 0.04618 -0.00416 -0.00240 0.01157
189 14F+2 0.00691 0.00562 -0.05516 0.00000 0.00000
190 14F-2 -0.00851 0.00000 0.00000 0.00544 0.03860
191 14F+3 -0.00474 0.01611 0.03570 0.00310 0.01603
192 14F-3 0.00003 -0.02297 0.03172 -0.00310 -0.01603
193 15G 0 -0.00062 -0.00164 -0.00017 0.00034 0.00023
194 15G+1 0.00004 -0.00241 -0.00008 -0.00008 -0.00163
195 15G-1 0.00004 -0.00237 -0.00041 -0.00008 -0.00163
196 15G+2 -0.00052 -0.00026 0.00254 0.00000 0.00000
197 15G-2 0.00012 0.00297 0.00030 -0.00023 -0.00074
198 15G+3 0.00011 -0.00040 -0.00288 -0.00021 -0.00146
199 15G-3 -0.00012 0.00097 -0.00274 0.00021 0.00146
200 15G+4 -0.00013 0.00194 0.00020 0.00029 0.00134
201 15G-4 0.00000 -0.00023 0.00230 0.00000 0.00000
202 4 H 1S -0.00749 0.00000 0.00000 -0.00620 -0.00919
203 2S 0.03375 0.00000 0.00000 -0.03663 -0.23739
204 3S -1.50287 0.00000 0.00000 -0.64458 3.28555
205 4S -7.40029 0.00000 0.00000 -4.94614 13.73711
206 5S 2.91559 0.00000 0.00000 -0.09366 -0.58332
207 6PX -0.00141 -0.00198 0.00274 0.00369 0.00308
208 6PY -0.00073 0.00139 0.00308 -0.00369 -0.00308
209 6PZ -0.00073 -0.00336 -0.00034 -0.00369 0.00306
210 7PX 0.00321 0.00908 -0.01259 -0.02837 0.00008
211 7PY 0.01506 -0.00636 -0.01416 0.02837 -0.00008
212 7PZ 0.01506 0.01544 0.00157 0.02837 -0.03667
213 8PX 0.29032 0.05170 -0.07166 0.24817 -0.65182
214 8PY -0.36879 -0.03620 -0.08061 -0.24817 0.65182
215 8PZ -0.36879 0.08791 0.00895 -0.24817 0.72670
216 9PX 0.97467 0.31517 -0.43679 0.49080 -2.40617
217 9PY -1.18479 -0.22068 -0.49134 -0.49080 2.40617
218 9PZ -1.18479 0.53585 0.05455 -0.49080 2.02043
219 10D 0 0.00006 -0.00687 -0.00070 0.00000 0.00530
220 10D+1 -0.00193 0.00161 0.00358 -0.00060 0.00686
221 10D-1 -0.00080 -0.00229 0.00318 0.00060 -0.00686
222 10D+2 -0.00011 0.00070 -0.00687 0.00000 0.00000
223 10D-2 -0.00193 -0.00390 -0.00040 -0.00060 0.00435
224 11D 0 -0.00115 0.04515 0.00460 0.00000 -0.03078
225 11D+1 0.02997 -0.01044 -0.02324 0.01390 -0.07010
226 11D-1 -0.01883 0.01491 -0.02066 -0.01390 0.07010
227 11D+2 0.00199 -0.00460 0.04515 0.00000 0.00000
228 11D-2 0.02997 0.02534 0.00258 0.01390 -0.06276
229 12D 0 -0.02786 0.15700 0.01598 0.00000 -0.01894
230 12D+1 0.10921 -0.04090 -0.09105 0.09151 -0.23631
231 12D-1 -0.20082 0.05841 -0.08095 -0.09151 0.23631
232 12D+2 0.04825 -0.01598 0.15700 0.00000 0.00000
233 12D-2 0.10921 0.09930 0.01011 0.09151 -0.29529
234 13F 0 0.00114 -0.00081 -0.00008 0.00097 -0.00190
235 13F+1 0.00090 0.00105 0.00014 0.00060 -0.00307
236 13F-1 -0.00062 -0.00106 -0.00007 -0.00060 0.00307
237 13F+2 -0.00010 0.00012 -0.00118 0.00000 0.00000
238 13F-2 0.00245 0.00000 0.00000 0.00213 -0.00304
239 13F+3 -0.00116 0.00021 0.00095 -0.00077 0.00206
240 13F-3 -0.00096 0.00040 -0.00089 -0.00077 0.00206
241 14F 0 0.00539 0.02457 0.00250 0.00392 -0.02883
242 14F+1 0.00368 -0.04439 -0.01338 0.00240 0.01157
243 14F-1 -0.00876 0.04618 -0.00416 -0.00240 -0.01157
244 14F+2 0.00691 -0.00562 0.05516 0.00000 0.00000
245 14F-2 0.00851 0.00000 0.00000 0.00544 -0.03860
246 14F+3 -0.00474 -0.01611 -0.03570 -0.00310 0.01603
247 14F-3 -0.00003 -0.02297 0.03172 -0.00310 0.01603
248 15G 0 0.00062 -0.00164 -0.00017 0.00034 -0.00023
249 15G+1 -0.00004 -0.00241 -0.00008 -0.00008 0.00163
250 15G-1 0.00004 0.00237 0.00041 0.00008 -0.00163
251 15G+2 0.00052 -0.00026 0.00254 0.00000 0.00000
252 15G-2 0.00012 -0.00297 -0.00030 0.00023 -0.00074
253 15G+3 -0.00011 -0.00040 -0.00288 -0.00021 0.00146
254 15G-3 -0.00012 -0.00097 0.00274 -0.00021 0.00146
255 15G+4 0.00013 0.00194 0.00020 0.00029 -0.00134
256 15G-4 0.00000 0.00023 -0.00230 0.00000 0.00000
257 5 H 1S 0.00749 0.00000 0.00000 -0.00620 -0.00919
258 2S -0.03375 0.00000 0.00000 -0.03663 -0.23739
259 3S 1.50287 0.00000 0.00000 -0.64458 3.28555
260 4S 7.40029 0.00000 0.00000 -4.94614 13.73711
261 5S -2.91559 0.00000 0.00000 -0.09366 -0.58332
262 6PX -0.00141 0.00198 -0.00274 -0.00369 -0.00308
263 6PY -0.00073 -0.00139 -0.00308 0.00369 0.00308
264 6PZ 0.00073 -0.00336 -0.00034 -0.00369 0.00306
265 7PX 0.00321 -0.00908 0.01259 0.02837 -0.00008
266 7PY 0.01506 0.00636 0.01416 -0.02837 0.00008
267 7PZ -0.01506 0.01544 0.00157 0.02837 -0.03667
268 8PX 0.29032 -0.05170 0.07166 -0.24817 0.65182
269 8PY -0.36879 0.03620 0.08061 0.24817 -0.65182
270 8PZ 0.36879 0.08791 0.00895 -0.24817 0.72670
271 9PX 0.97467 -0.31517 0.43679 -0.49080 2.40617
272 9PY -1.18479 0.22068 0.49134 0.49080 -2.40617
273 9PZ 1.18479 0.53585 0.05455 -0.49080 2.02043
274 10D 0 -0.00006 -0.00687 -0.00070 0.00000 0.00530
275 10D+1 -0.00193 -0.00161 -0.00358 0.00060 -0.00686
276 10D-1 -0.00080 0.00229 -0.00318 -0.00060 0.00686
277 10D+2 0.00011 0.00070 -0.00687 0.00000 0.00000
278 10D-2 0.00193 -0.00390 -0.00040 -0.00060 0.00435
279 11D 0 0.00115 0.04515 0.00460 0.00000 -0.03078
280 11D+1 0.02997 0.01044 0.02324 -0.01390 0.07010
281 11D-1 -0.01883 -0.01491 0.02066 0.01390 -0.07010
282 11D+2 -0.00199 -0.00460 0.04515 0.00000 0.00000
283 11D-2 -0.02997 0.02534 0.00258 0.01390 -0.06276
284 12D 0 0.02786 0.15700 0.01598 0.00000 -0.01894
285 12D+1 0.10921 0.04090 0.09105 -0.09151 0.23631
286 12D-1 -0.20082 -0.05841 0.08095 0.09151 -0.23631
287 12D+2 -0.04825 -0.01598 0.15700 0.00000 0.00000
288 12D-2 -0.10921 0.09930 0.01011 0.09151 -0.29529
289 13F 0 -0.00114 -0.00081 -0.00008 0.00097 -0.00190
290 13F+1 0.00090 -0.00105 -0.00014 -0.00060 0.00307
291 13F-1 -0.00062 0.00106 0.00007 0.00060 -0.00307
292 13F+2 0.00010 0.00012 -0.00118 0.00000 0.00000
293 13F-2 -0.00245 0.00000 0.00000 0.00213 -0.00304
294 13F+3 -0.00116 -0.00021 -0.00095 0.00077 -0.00206
295 13F-3 -0.00096 -0.00040 0.00089 0.00077 -0.00206
296 14F 0 -0.00539 0.02457 0.00250 0.00392 -0.02883
297 14F+1 0.00368 0.04439 0.01338 -0.00240 -0.01157
298 14F-1 -0.00876 -0.04618 0.00416 0.00240 0.01157
299 14F+2 -0.00691 -0.00562 0.05516 0.00000 0.00000
300 14F-2 -0.00851 0.00000 0.00000 0.00544 -0.03860
301 14F+3 -0.00474 0.01611 0.03570 0.00310 -0.01603
302 14F-3 -0.00003 0.02297 -0.03172 0.00310 -0.01603
303 15G 0 -0.00062 -0.00164 -0.00017 0.00034 -0.00023
304 15G+1 -0.00004 0.00241 0.00008 0.00008 -0.00163
305 15G-1 0.00004 -0.00237 -0.00041 -0.00008 0.00163
306 15G+2 -0.00052 -0.00026 0.00254 0.00000 0.00000
307 15G-2 -0.00012 -0.00297 -0.00030 0.00023 -0.00074
308 15G+3 -0.00011 0.00040 0.00288 0.00021 -0.00146
309 15G-3 -0.00012 0.00097 -0.00274 0.00021 -0.00146
310 15G+4 -0.00013 0.00194 0.00020 0.00029 -0.00134
311 15G-4 0.00000 0.00023 -0.00230 0.00000 0.00000
21 22 23 24 25
(T2)--V (T2)--V (T1)--V (T1)--V (T1)--V
Eigenvalues -- 0.58908 0.58908 0.67154 0.67154 0.67154
1 1 C 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 0.02159 0.00000 0.00000 0.00000
8 7PY 0.02159 0.00000 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.41866 0.00000 0.00000 0.00000
11 8PY -0.41866 0.00000 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 4.57448 0.00000 0.00000 0.00000
14 9PY 4.57448 0.00000 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 17.67555 0.00000 0.00000 0.00000
17 10PY 17.67555 0.00000 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 2.02229 0.00000 0.00000 0.00000
20 11PY 2.02229 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 -0.01149 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 -0.01149 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 0.04346 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.04346 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 2.46669 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 2.46669 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 6.89293 0.00000 0.00000 0.00000 0.00000
39 15D-1 0.00000 6.89293 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 -0.00654 -0.02507 0.00000 0.00000
44 16F-1 -0.00654 0.00000 0.00000 -0.02507 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 -0.03171
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.00845 -0.01942 0.00000 0.00000
48 16F-3 -0.00845 0.00000 0.00000 0.01942 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.14207 0.26290 0.00000 0.00000
51 17F-1 0.14207 0.00000 0.00000 0.26290 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.33254
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.00000 -0.18341 0.20364 0.00000 0.00000
55 17F-3 0.18341 0.00000 0.00000 -0.20364 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.58254 1.19433 0.00000 0.00000
58 18F-1 0.58254 0.00000 0.00000 1.19433 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 1.51072
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.00000 -0.75206 0.92512 0.00000 0.00000
62 18F-3 0.75206 0.00000 0.00000 -0.92512 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 -0.00636 0.00000 0.00000 -0.00083 0.00000
65 19G-1 0.00000 -0.00636 -0.00083 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 -0.01682 0.00000 0.00000 0.00031 0.00000
69 19G-3 0.00000 0.01682 -0.00031 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 -0.00088
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
73 20G+1 -0.08591 0.00000 0.00000 0.23633 0.00000
74 20G-1 0.00000 -0.08591 0.23633 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 -0.22729 0.00000 0.00000 -0.08932 0.00000
78 20G-3 0.00000 0.22729 0.08932 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 0.25265
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.00000 -0.01713 0.00313 0.00000 0.00000
83 21H-1 -0.01713 0.00000 0.00000 0.00313 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 -0.00474
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.00000 -0.00809 -0.00145 0.00000 0.00000
87 21H-3 0.00809 0.00000 0.00000 0.00145 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 -0.01293 -0.00324 0.00000 0.00000
91 21H-5 -0.01293 0.00000 0.00000 -0.00324 0.00000
92 2 H 1S 0.00919 0.00919 0.00000 0.00000 0.00000
93 2S 0.23739 0.23739 0.00000 0.00000 0.00000
94 3S -3.28555 -3.28555 0.00000 0.00000 0.00000
95 4S -13.73711 -13.73711 0.00000 0.00000 0.00000
96 5S 0.58332 0.58332 0.00000 0.00000 0.00000
97 6PX -0.00308 0.00306 0.00000 0.00142 -0.00142
98 6PY 0.00306 -0.00308 0.00142 0.00000 0.00142
99 6PZ -0.00308 -0.00308 -0.00142 -0.00142 0.00000
100 7PX -0.00008 -0.03667 0.00000 -0.01509 0.01509
101 7PY -0.03667 -0.00008 -0.01509 0.00000 -0.01509
102 7PZ -0.00008 -0.00008 0.01509 0.01509 0.00000
103 8PX 0.65182 0.72670 0.00000 0.28988 -0.28988
104 8PY 0.72670 0.65182 0.28988 0.00000 0.28988
105 8PZ 0.65182 0.65182 -0.28988 -0.28988 0.00000
106 9PX 2.40617 2.02043 0.00000 1.26529 -1.26529
107 9PY 2.02043 2.40617 1.26529 0.00000 1.26529
108 9PZ 2.40617 2.40617 -1.26529 -1.26529 0.00000
109 10D 0 0.00265 0.00265 0.00041 0.00041 0.00000
110 10D+1 0.00435 0.00686 -0.00420 0.00000 -0.00420
111 10D-1 0.00686 0.00435 0.00000 -0.00420 0.00420
112 10D+2 0.00459 -0.00459 0.00024 -0.00024 0.00048
113 10D-2 0.00686 0.00686 0.00420 0.00420 0.00000
114 11D 0 -0.01539 -0.01539 0.00724 0.00724 0.00000
115 11D+1 -0.06276 -0.07010 0.02850 0.00000 0.02850
116 11D-1 -0.07010 -0.06276 0.00000 0.02850 -0.02850
117 11D+2 -0.02666 0.02666 0.00418 -0.00418 0.00836
118 11D-2 -0.07010 -0.07010 -0.02850 -0.02850 0.00000
119 12D 0 -0.00947 -0.00947 0.49135 0.49135 0.00000
120 12D+1 -0.29529 -0.23631 0.19444 0.00000 0.19444
121 12D-1 -0.23631 -0.29529 0.00000 0.19444 -0.19444
122 12D+2 -0.01640 0.01640 0.28368 -0.28368 0.56736
123 12D-2 -0.23631 -0.23631 -0.19444 -0.19444 0.00000
124 13F 0 -0.00351 -0.00351 0.00325 0.00325 0.00000
125 13F+1 0.00123 0.00116 0.00426 0.00098 -0.00299
126 13F-1 0.00116 0.00123 0.00098 0.00426 0.00299
127 13F+2 -0.00117 0.00117 -0.00127 0.00127 0.00538
128 13F-2 0.00304 0.00304 0.00000 0.00000 0.00000
129 13F+3 -0.00349 -0.00150 0.00330 -0.00335 0.00179
130 13F-3 0.00150 0.00349 0.00335 -0.00330 0.00179
131 14F 0 -0.00559 -0.00559 -0.03878 -0.03878 0.00000
132 14F+1 0.01841 0.01765 -0.08199 -0.05049 -0.00300
133 14F-1 0.01765 0.01841 -0.05049 -0.08199 0.00300
134 14F+2 0.01896 -0.01896 -0.03383 0.03383 -0.10371
135 14F-2 0.03860 0.03860 0.00000 0.00000 0.00000
136 14F+3 0.00719 -0.02279 -0.06351 0.00994 -0.05138
137 14F-3 0.02279 -0.00719 -0.00994 0.06351 -0.05138
138 15G 0 0.00107 0.00107 -0.00218 -0.00218 0.00000
139 15G+1 0.00026 -0.00026 0.00295 0.00338 -0.00010
140 15G-1 -0.00026 0.00026 0.00338 0.00295 0.00010
141 15G+2 -0.00076 0.00076 0.00195 -0.00195 0.00389
142 15G-2 -0.00194 -0.00194 0.00403 0.00403 0.00000
143 15G+3 0.00069 0.00217 0.00320 -0.00128 0.00435
144 15G-3 -0.00217 -0.00069 0.00128 -0.00320 0.00435
145 15G+4 0.00033 0.00033 0.00257 0.00257 0.00000
146 15G-4 -0.00101 0.00101 0.00163 -0.00163 0.00361
147 3 H 1S -0.00919 -0.00919 0.00000 0.00000 0.00000
148 2S -0.23739 -0.23739 0.00000 0.00000 0.00000
149 3S 3.28555 3.28555 0.00000 0.00000 0.00000
150 4S 13.73711 13.73711 0.00000 0.00000 0.00000
151 5S -0.58332 -0.58332 0.00000 0.00000 0.00000
152 6PX -0.00308 0.00306 0.00000 0.00142 0.00142
153 6PY 0.00306 -0.00308 0.00142 0.00000 -0.00142
154 6PZ 0.00308 0.00308 0.00142 0.00142 0.00000
155 7PX -0.00008 -0.03667 0.00000 -0.01509 -0.01509
156 7PY -0.03667 -0.00008 -0.01509 0.00000 0.01509
157 7PZ 0.00008 0.00008 -0.01509 -0.01509 0.00000
158 8PX 0.65182 0.72670 0.00000 0.28988 0.28988
159 8PY 0.72670 0.65182 0.28988 0.00000 -0.28988
160 8PZ -0.65182 -0.65182 0.28988 0.28988 0.00000
161 9PX 2.40617 2.02043 0.00000 1.26529 1.26529
162 9PY 2.02043 2.40617 1.26529 0.00000 -1.26529
163 9PZ -2.40617 -2.40617 1.26529 1.26529 0.00000
164 10D 0 -0.00265 -0.00265 -0.00041 -0.00041 0.00000
165 10D+1 0.00435 0.00686 -0.00420 0.00000 0.00420
166 10D-1 0.00686 0.00435 0.00000 -0.00420 -0.00420
167 10D+2 -0.00459 0.00459 -0.00024 0.00024 0.00048
168 10D-2 -0.00686 -0.00686 -0.00420 -0.00420 0.00000
169 11D 0 0.01539 0.01539 -0.00724 -0.00724 0.00000
170 11D+1 -0.06276 -0.07010 0.02850 0.00000 -0.02850
171 11D-1 -0.07010 -0.06276 0.00000 0.02850 0.02850
172 11D+2 0.02666 -0.02666 -0.00418 0.00418 0.00836
173 11D-2 0.07010 0.07010 0.02850 0.02850 0.00000
174 12D 0 0.00947 0.00947 -0.49135 -0.49135 0.00000
175 12D+1 -0.29529 -0.23631 0.19444 0.00000 -0.19444
176 12D-1 -0.23631 -0.29529 0.00000 0.19444 0.19444
177 12D+2 0.01640 -0.01640 -0.28368 0.28368 0.56736
178 12D-2 0.23631 0.23631 0.19444 0.19444 0.00000
179 13F 0 0.00351 0.00351 -0.00325 -0.00325 0.00000
180 13F+1 0.00123 0.00116 0.00426 0.00098 0.00299
181 13F-1 0.00116 0.00123 0.00098 0.00426 -0.00299
182 13F+2 0.00117 -0.00117 0.00127 -0.00127 0.00538
183 13F-2 -0.00304 -0.00304 0.00000 0.00000 0.00000
184 13F+3 -0.00349 -0.00150 0.00330 -0.00335 -0.00179
185 13F-3 0.00150 0.00349 0.00335 -0.00330 -0.00179
186 14F 0 0.00559 0.00559 0.03878 0.03878 0.00000
187 14F+1 0.01841 0.01765 -0.08199 -0.05049 0.00300
188 14F-1 0.01765 0.01841 -0.05049 -0.08199 -0.00300
189 14F+2 -0.01896 0.01896 0.03383 -0.03383 -0.10371
190 14F-2 -0.03860 -0.03860 0.00000 0.00000 0.00000
191 14F+3 0.00719 -0.02279 -0.06351 0.00994 0.05138
192 14F-3 0.02279 -0.00719 -0.00994 0.06351 0.05138
193 15G 0 -0.00107 -0.00107 0.00218 0.00218 0.00000
194 15G+1 0.00026 -0.00026 0.00295 0.00338 0.00010
195 15G-1 -0.00026 0.00026 0.00338 0.00295 -0.00010
196 15G+2 0.00076 -0.00076 -0.00195 0.00195 0.00389
197 15G-2 0.00194 0.00194 -0.00403 -0.00403 0.00000
198 15G+3 0.00069 0.00217 0.00320 -0.00128 -0.00435
199 15G-3 -0.00217 -0.00069 0.00128 -0.00320 -0.00435
200 15G+4 -0.00033 -0.00033 -0.00257 -0.00257 0.00000
201 15G-4 0.00101 -0.00101 -0.00163 0.00163 0.00361
202 4 H 1S -0.00919 0.00919 0.00000 0.00000 0.00000
203 2S -0.23739 0.23739 0.00000 0.00000 0.00000
204 3S 3.28555 -3.28555 0.00000 0.00000 0.00000
205 4S 13.73711 -13.73711 0.00000 0.00000 0.00000
206 5S -0.58332 0.58332 0.00000 0.00000 0.00000
207 6PX 0.00308 0.00306 0.00000 -0.00142 0.00142
208 6PY 0.00306 0.00308 -0.00142 0.00000 0.00142
209 6PZ -0.00308 0.00308 0.00142 -0.00142 0.00000
210 7PX 0.00008 -0.03667 0.00000 0.01509 -0.01509
211 7PY -0.03667 0.00008 0.01509 0.00000 -0.01509
212 7PZ -0.00008 0.00008 -0.01509 0.01509 0.00000
213 8PX -0.65182 0.72670 0.00000 -0.28988 0.28988
214 8PY 0.72670 -0.65182 -0.28988 0.00000 0.28988
215 8PZ 0.65182 -0.65182 0.28988 -0.28988 0.00000
216 9PX -2.40617 2.02043 0.00000 -1.26529 1.26529
217 9PY 2.02043 -2.40617 -1.26529 0.00000 1.26529
218 9PZ 2.40617 -2.40617 1.26529 -1.26529 0.00000
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226 11D-1 0.07010 -0.06276 0.00000 -0.02850 0.02850
227 11D+2 0.02666 0.02666 0.00418 0.00418 -0.00836
228 11D-2 -0.07010 0.07010 0.02850 -0.02850 0.00000
229 12D 0 0.00947 -0.00947 0.49135 -0.49135 0.00000
230 12D+1 -0.29529 0.23631 -0.19444 0.00000 0.19444
231 12D-1 0.23631 -0.29529 0.00000 -0.19444 0.19444
232 12D+2 0.01640 0.01640 0.28368 0.28368 -0.56736
233 12D-2 -0.23631 0.23631 0.19444 -0.19444 0.00000
234 13F 0 -0.00351 0.00351 -0.00325 0.00325 0.00000
235 13F+1 -0.00123 0.00116 0.00426 -0.00098 0.00299
236 13F-1 0.00116 -0.00123 -0.00098 0.00426 0.00299
237 13F+2 -0.00117 -0.00117 0.00127 0.00127 0.00538
238 13F-2 -0.00304 0.00304 0.00000 0.00000 0.00000
239 13F+3 0.00349 -0.00150 0.00330 0.00335 -0.00179
240 13F-3 0.00150 -0.00349 -0.00335 -0.00330 0.00179
241 14F 0 -0.00559 0.00559 0.03878 -0.03878 0.00000
242 14F+1 -0.01841 0.01765 -0.08199 0.05049 0.00300
243 14F-1 0.01765 -0.01841 0.05049 -0.08199 0.00300
244 14F+2 0.01896 0.01896 0.03383 0.03383 -0.10371
245 14F-2 -0.03860 0.03860 0.00000 0.00000 0.00000
246 14F+3 -0.00719 -0.02279 -0.06351 -0.00994 0.05138
247 14F-3 0.02279 0.00719 0.00994 0.06351 -0.05138
248 15G 0 -0.00107 0.00107 -0.00218 0.00218 0.00000
249 15G+1 0.00026 0.00026 -0.00295 0.00338 -0.00010
250 15G-1 0.00026 0.00026 0.00338 -0.00295 -0.00010
251 15G+2 0.00076 0.00076 0.00195 0.00195 -0.00389
252 15G-2 -0.00194 0.00194 -0.00403 0.00403 0.00000
253 15G+3 0.00069 -0.00217 -0.00320 -0.00128 0.00435
254 15G-3 0.00217 -0.00069 0.00128 0.00320 -0.00435
255 15G+4 -0.00033 0.00033 0.00257 -0.00257 0.00000
256 15G-4 -0.00101 -0.00101 -0.00163 -0.00163 0.00361
257 5 H 1S 0.00919 -0.00919 0.00000 0.00000 0.00000
258 2S 0.23739 -0.23739 0.00000 0.00000 0.00000
259 3S -3.28555 3.28555 0.00000 0.00000 0.00000
260 4S -13.73711 13.73711 0.00000 0.00000 0.00000
261 5S 0.58332 -0.58332 0.00000 0.00000 0.00000
262 6PX 0.00308 0.00306 0.00000 -0.00142 -0.00142
263 6PY 0.00306 0.00308 -0.00142 0.00000 -0.00142
264 6PZ 0.00308 -0.00308 -0.00142 0.00142 0.00000
265 7PX 0.00008 -0.03667 0.00000 0.01509 0.01509
266 7PY -0.03667 0.00008 0.01509 0.00000 0.01509
267 7PZ 0.00008 -0.00008 0.01509 -0.01509 0.00000
268 8PX -0.65182 0.72670 0.00000 -0.28988 -0.28988
269 8PY 0.72670 -0.65182 -0.28988 0.00000 -0.28988
270 8PZ -0.65182 0.65182 -0.28988 0.28988 0.00000
271 9PX -2.40617 2.02043 0.00000 -1.26529 -1.26529
272 9PY 2.02043 -2.40617 -1.26529 0.00000 -1.26529
273 9PZ -2.40617 2.40617 -1.26529 1.26529 0.00000
274 10D 0 0.00265 -0.00265 -0.00041 0.00041 0.00000
275 10D+1 0.00435 -0.00686 0.00420 0.00000 0.00420
276 10D-1 -0.00686 0.00435 0.00000 0.00420 0.00420
277 10D+2 0.00459 0.00459 -0.00024 -0.00024 -0.00048
278 10D-2 -0.00686 0.00686 0.00420 -0.00420 0.00000
279 11D 0 -0.01539 0.01539 -0.00724 0.00724 0.00000
280 11D+1 -0.06276 0.07010 -0.02850 0.00000 -0.02850
281 11D-1 0.07010 -0.06276 0.00000 -0.02850 -0.02850
282 11D+2 -0.02666 -0.02666 -0.00418 -0.00418 -0.00836
283 11D-2 0.07010 -0.07010 -0.02850 0.02850 0.00000
284 12D 0 -0.00947 0.00947 -0.49135 0.49135 0.00000
285 12D+1 -0.29529 0.23631 -0.19444 0.00000 -0.19444
286 12D-1 0.23631 -0.29529 0.00000 -0.19444 -0.19444
287 12D+2 -0.01640 -0.01640 -0.28368 -0.28368 -0.56736
288 12D-2 0.23631 -0.23631 -0.19444 0.19444 0.00000
289 13F 0 0.00351 -0.00351 0.00325 -0.00325 0.00000
290 13F+1 -0.00123 0.00116 0.00426 -0.00098 -0.00299
291 13F-1 0.00116 -0.00123 -0.00098 0.00426 -0.00299
292 13F+2 0.00117 0.00117 -0.00127 -0.00127 0.00538
293 13F-2 0.00304 -0.00304 0.00000 0.00000 0.00000
294 13F+3 0.00349 -0.00150 0.00330 0.00335 0.00179
295 13F-3 0.00150 -0.00349 -0.00335 -0.00330 -0.00179
296 14F 0 0.00559 -0.00559 -0.03878 0.03878 0.00000
297 14F+1 -0.01841 0.01765 -0.08199 0.05049 -0.00300
298 14F-1 0.01765 -0.01841 0.05049 -0.08199 -0.00300
299 14F+2 -0.01896 -0.01896 -0.03383 -0.03383 -0.10371
300 14F-2 0.03860 -0.03860 0.00000 0.00000 0.00000
301 14F+3 -0.00719 -0.02279 -0.06351 -0.00994 -0.05138
302 14F-3 0.02279 0.00719 0.00994 0.06351 0.05138
303 15G 0 0.00107 -0.00107 0.00218 -0.00218 0.00000
304 15G+1 0.00026 0.00026 -0.00295 0.00338 0.00010
305 15G-1 0.00026 0.00026 0.00338 -0.00295 0.00010
306 15G+2 -0.00076 -0.00076 -0.00195 -0.00195 -0.00389
307 15G-2 0.00194 -0.00194 0.00403 -0.00403 0.00000
308 15G+3 0.00069 -0.00217 -0.00320 -0.00128 -0.00435
309 15G-3 0.00217 -0.00069 0.00128 0.00320 0.00435
310 15G+4 0.00033 -0.00033 -0.00257 0.00257 0.00000
311 15G-4 0.00101 0.00101 0.00163 0.00163 0.00361
26 27 28 29 30
(T2)--V (T2)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 0.71077 0.71077 0.71077 0.93091 0.93091
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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 0.01852 0.00000 0.00000 0.00000 0.00000
8 7PY 0.00000 0.01852 0.00000 0.00000 -0.04781
9 7PZ 0.00000 0.00000 0.01852 -0.04781 0.00000
10 8PX 0.09736 0.00000 0.00000 0.00000 0.00000
11 8PY 0.00000 0.09736 0.00000 0.00000 -0.45304
12 8PZ 0.00000 0.00000 0.09736 -0.45304 0.00000
13 9PX 1.04793 0.00000 0.00000 0.00000 0.00000
14 9PY 0.00000 1.04793 0.00000 0.00000 7.46895
15 9PZ 0.00000 0.00000 1.04793 7.46895 0.00000
16 10PX 4.77919 0.00000 0.00000 0.00000 0.00000
17 10PY 0.00000 4.77919 0.00000 0.00000 15.72351
18 10PZ 0.00000 0.00000 4.77919 15.72351 0.00000
19 11PX 0.86722 0.00000 0.00000 0.00000 0.00000
20 11PY 0.00000 0.86722 0.00000 0.00000 -0.97908
21 11PZ 0.00000 0.00000 0.86722 -0.97908 0.00000
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23 12D+1 0.00000 -0.00926 0.00000 0.00000 -0.03165
24 12D-1 -0.00926 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 -0.00926 -0.03165 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.16103 0.00000 0.00000 0.12853
29 13D-1 0.16103 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 0.16103 0.12853 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 -2.07257 0.00000 0.00000 4.38728
34 14D-1 -2.07257 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 -2.07257 4.38728 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 -3.22486 0.00000 0.00000 4.59406
39 15D-1 -3.22486 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 -3.22486 4.59406 0.00000
42 16F 0 0.00000 0.00000 -0.02578 0.03144 0.00000
43 16F+1 0.01578 0.00000 0.00000 0.00000 0.00000
44 16F-1 0.00000 0.01578 0.00000 0.00000 -0.01925
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 -0.02038 0.00000 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.02038 0.00000 0.00000 -0.02486
49 17F 0 0.00000 0.00000 0.24715 -0.53102 0.00000
50 17F+1 -0.15135 0.00000 0.00000 0.00000 0.00000
51 17F-1 0.00000 -0.15135 0.00000 0.00000 0.32518
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 0.19539 0.00000 0.00000 0.00000 0.00000
55 17F-3 0.00000 -0.19539 0.00000 0.00000 0.41981
56 18F 0 0.00000 0.00000 1.75194 -0.83510 0.00000
57 18F+1 -1.07284 0.00000 0.00000 0.00000 0.00000
58 18F-1 0.00000 -1.07284 0.00000 0.00000 0.51139
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 1.38503 0.00000 0.00000 0.00000 0.00000
62 18F-3 0.00000 -1.38503 0.00000 0.00000 0.66021
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 -0.00195 0.00000 0.00000 -0.00824
65 19G-1 -0.00195 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 0.00551 0.02332 0.00000
68 19G+3 0.00000 -0.00515 0.00000 0.00000 -0.02181
69 19G-3 0.00515 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 -0.04165 0.00000 0.00000 -0.05073
74 20G-1 -0.04165 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 0.11781 0.14347 0.00000
77 20G+3 0.00000 -0.11020 0.00000 0.00000 -0.13421
78 20G-3 0.11020 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 -0.03524 0.00648 0.00000
82 21H+1 0.00204 0.00000 0.00000 0.00000 0.00000
83 21H-1 0.00000 0.00204 0.00000 0.00000 -0.01167
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 0.04496 0.00000 0.00000 0.00000 0.00000
87 21H-3 0.00000 -0.04496 0.00000 0.00000 0.02396
88 21H+4 0.00000 0.00000 0.03335 -0.02586 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 -0.01813 0.00000 0.00000 0.00000 0.00000
91 21H-5 0.00000 -0.01813 0.00000 0.00000 -0.00056
92 2 H 1S 0.00144 0.00144 0.00144 0.00224 0.00224
93 2S 0.01759 0.01759 0.01759 0.35947 0.35947
94 3S 2.08698 2.08698 2.08698 -3.82138 -3.82138
95 4S -2.81939 -2.81939 -2.81939 -14.58462 -14.58462
96 5S 0.07555 0.07555 0.07555 1.62152 1.62152
97 6PX -0.00142 0.00567 0.00567 0.00619 0.00619
98 6PY 0.00567 -0.00142 0.00567 0.00619 0.00070
99 6PZ 0.00567 0.00567 -0.00142 0.00070 0.00619
100 7PX 0.01765 -0.03749 -0.03749 -0.05874 -0.05874
101 7PY -0.03749 0.01765 -0.03749 -0.05874 -0.03685
102 7PZ -0.03749 -0.03749 0.01765 -0.03685 -0.05874
103 8PX -0.63370 -0.06795 -0.06795 1.08316 1.08316
104 8PY -0.06795 -0.63370 -0.06795 1.08316 1.09206
105 8PZ -0.06795 -0.06795 -0.63370 1.09206 1.08316
106 9PX -1.05851 1.81618 1.81618 3.30960 3.30960
107 9PY 1.81618 -1.05851 1.81618 3.30960 4.44040
108 9PZ 1.81618 1.81618 -1.05851 4.44040 3.30960
109 10D 0 0.00256 0.00256 -0.00513 0.00095 -0.00047
110 10D+1 -0.00417 -0.00164 -0.00417 0.00739 0.00683
111 10D-1 -0.00164 -0.00417 -0.00417 0.00739 0.00739
112 10D+2 -0.00444 0.00444 0.00000 0.00000 -0.00082
113 10D-2 -0.00417 -0.00417 -0.00164 0.00683 0.00739
114 11D 0 -0.01930 -0.01930 0.03860 -0.00709 0.00355
115 11D+1 0.05040 0.03025 0.05040 -0.08093 -0.07802
116 11D-1 0.03025 0.05040 0.05040 -0.08093 -0.08093
117 11D+2 0.03343 -0.03343 0.00000 0.00000 0.00614
118 11D-2 0.05040 0.05040 0.03025 -0.07802 -0.08093
119 12D 0 -0.23321 -0.23321 0.46642 -0.17237 0.08618
120 12D+1 0.07805 -0.54700 0.07805 -0.74045 -0.56649
121 12D-1 -0.54700 0.07805 0.07805 -0.74045 -0.74045
122 12D+2 0.40393 -0.40393 0.00000 0.00000 0.14927
123 12D-2 0.07805 0.07805 -0.54700 -0.56649 -0.74045
124 13F 0 0.00454 0.00454 0.00045 -0.00092 0.00031
125 13F+1 -0.00028 -0.00546 -0.00009 -0.00115 0.00077
126 13F-1 -0.00546 -0.00028 -0.00009 -0.00115 0.00056
127 13F+2 0.00339 -0.00339 0.00000 0.00000 0.00121
128 13F-2 -0.00032 -0.00032 -0.00032 0.00215 0.00215
129 13F+3 0.00036 0.00151 0.00567 -0.00049 0.00099
130 13F-3 -0.00151 -0.00036 -0.00567 0.00049 0.00072
131 14F 0 -0.01141 -0.01141 -0.04155 -0.04137 -0.06467
132 14F+1 0.02545 0.07875 -0.06478 0.06522 0.01399
133 14F-1 0.07875 0.02545 -0.06478 0.06522 0.02533
134 14F+2 -0.09078 0.09078 0.00000 0.00000 -0.03240
135 14F-2 0.00335 0.00335 0.00335 0.10245 0.10245
136 14F+3 -0.03285 0.04657 -0.06461 -0.03129 -0.07097
137 14F-3 -0.04657 0.03285 0.06461 0.03129 0.03270
138 15G 0 0.00287 0.00287 0.00018 0.00442 0.00237
139 15G+1 -0.00225 -0.00117 0.00472 0.00008 0.00221
140 15G-1 -0.00117 -0.00225 0.00472 0.00008 0.00186
141 15G+2 0.00240 -0.00240 0.00000 0.00000 0.00183
142 15G-2 -0.00350 -0.00350 0.00330 -0.00624 -0.00275
143 15G+3 0.00459 -0.00308 0.00196 0.00290 0.00584
144 15G-3 0.00308 -0.00459 -0.00196 -0.00290 -0.00223
145 15G+4 0.00061 0.00061 0.00379 0.00096 0.00339
146 15G-4 0.00373 -0.00373 0.00000 0.00000 0.00095
147 3 H 1S -0.00144 -0.00144 0.00144 0.00224 -0.00224
148 2S -0.01759 -0.01759 0.01759 0.35947 -0.35947
149 3S -2.08698 -2.08698 2.08698 -3.82138 3.82138
150 4S 2.81939 2.81939 -2.81939 -14.58462 14.58462
151 5S -0.07555 -0.07555 0.07555 1.62152 -1.62152
152 6PX -0.00142 0.00567 -0.00567 -0.00619 0.00619
153 6PY 0.00567 -0.00142 -0.00567 -0.00619 0.00070
154 6PZ -0.00567 -0.00567 -0.00142 0.00070 -0.00619
155 7PX 0.01765 -0.03749 0.03749 0.05874 -0.05874
156 7PY -0.03749 0.01765 0.03749 0.05874 -0.03685
157 7PZ 0.03749 0.03749 0.01765 -0.03685 0.05874
158 8PX -0.63370 -0.06795 0.06795 -1.08316 1.08316
159 8PY -0.06795 -0.63370 0.06795 -1.08316 1.09206
160 8PZ 0.06795 0.06795 -0.63370 1.09206 -1.08316
161 9PX -1.05851 1.81618 -1.81618 -3.30960 3.30960
162 9PY 1.81618 -1.05851 -1.81618 -3.30960 4.44040
163 9PZ -1.81618 -1.81618 -1.05851 4.44040 -3.30960
164 10D 0 -0.00256 -0.00256 -0.00513 0.00095 0.00047
165 10D+1 -0.00417 -0.00164 0.00417 -0.00739 0.00683
166 10D-1 -0.00164 -0.00417 0.00417 -0.00739 0.00739
167 10D+2 0.00444 -0.00444 0.00000 0.00000 0.00082
168 10D-2 0.00417 0.00417 -0.00164 0.00683 -0.00739
169 11D 0 0.01930 0.01930 0.03860 -0.00709 -0.00355
170 11D+1 0.05040 0.03025 -0.05040 0.08093 -0.07802
171 11D-1 0.03025 0.05040 -0.05040 0.08093 -0.08093
172 11D+2 -0.03343 0.03343 0.00000 0.00000 -0.00614
173 11D-2 -0.05040 -0.05040 0.03025 -0.07802 0.08093
174 12D 0 0.23321 0.23321 0.46642 -0.17237 -0.08618
175 12D+1 0.07805 -0.54700 -0.07805 0.74045 -0.56649
176 12D-1 -0.54700 0.07805 -0.07805 0.74045 -0.74045
177 12D+2 -0.40393 0.40393 0.00000 0.00000 -0.14927
178 12D-2 -0.07805 -0.07805 -0.54700 -0.56649 0.74045
179 13F 0 -0.00454 -0.00454 0.00045 -0.00092 -0.00031
180 13F+1 -0.00028 -0.00546 0.00009 0.00115 0.00077
181 13F-1 -0.00546 -0.00028 0.00009 0.00115 0.00056
182 13F+2 -0.00339 0.00339 0.00000 0.00000 -0.00121
183 13F-2 0.00032 0.00032 -0.00032 0.00215 -0.00215
184 13F+3 0.00036 0.00151 -0.00567 0.00049 0.00099
185 13F-3 -0.00151 -0.00036 0.00567 -0.00049 0.00072
186 14F 0 0.01141 0.01141 -0.04155 -0.04137 0.06467
187 14F+1 0.02545 0.07875 0.06478 -0.06522 0.01399
188 14F-1 0.07875 0.02545 0.06478 -0.06522 0.02533
189 14F+2 0.09078 -0.09078 0.00000 0.00000 0.03240
190 14F-2 -0.00335 -0.00335 0.00335 0.10245 -0.10245
191 14F+3 -0.03285 0.04657 0.06461 0.03129 -0.07097
192 14F-3 -0.04657 0.03285 -0.06461 -0.03129 0.03270
193 15G 0 -0.00287 -0.00287 0.00018 0.00442 -0.00237
194 15G+1 -0.00225 -0.00117 -0.00472 -0.00008 0.00221
195 15G-1 -0.00117 -0.00225 -0.00472 -0.00008 0.00186
196 15G+2 -0.00240 0.00240 0.00000 0.00000 -0.00183
197 15G-2 0.00350 0.00350 0.00330 -0.00624 0.00275
198 15G+3 0.00459 -0.00308 -0.00196 -0.00290 0.00584
199 15G-3 0.00308 -0.00459 0.00196 0.00290 -0.00223
200 15G+4 -0.00061 -0.00061 0.00379 0.00096 -0.00339
201 15G-4 -0.00373 0.00373 0.00000 0.00000 -0.00095
202 4 H 1S 0.00144 -0.00144 -0.00144 -0.00224 -0.00224
203 2S 0.01759 -0.01759 -0.01759 -0.35947 -0.35947
204 3S 2.08698 -2.08698 -2.08698 3.82138 3.82138
205 4S -2.81939 2.81939 2.81939 14.58462 14.58462
206 5S 0.07555 -0.07555 -0.07555 -1.62152 -1.62152
207 6PX -0.00142 -0.00567 -0.00567 -0.00619 -0.00619
208 6PY -0.00567 -0.00142 0.00567 0.00619 0.00070
209 6PZ -0.00567 0.00567 -0.00142 0.00070 0.00619
210 7PX 0.01765 0.03749 0.03749 0.05874 0.05874
211 7PY 0.03749 0.01765 -0.03749 -0.05874 -0.03685
212 7PZ 0.03749 -0.03749 0.01765 -0.03685 -0.05874
213 8PX -0.63370 0.06795 0.06795 -1.08316 -1.08316
214 8PY 0.06795 -0.63370 -0.06795 1.08316 1.09206
215 8PZ 0.06795 -0.06795 -0.63370 1.09206 1.08316
216 9PX -1.05851 -1.81618 -1.81618 -3.30960 -3.30960
217 9PY -1.81618 -1.05851 1.81618 3.30960 4.44040
218 9PZ -1.81618 1.81618 -1.05851 4.44040 3.30960
219 10D 0 0.00256 -0.00256 0.00513 -0.00095 0.00047
220 10D+1 0.00417 -0.00164 -0.00417 0.00739 0.00683
221 10D-1 -0.00164 0.00417 0.00417 -0.00739 -0.00739
222 10D+2 -0.00444 -0.00444 0.00000 0.00000 0.00082
223 10D-2 0.00417 -0.00417 -0.00164 0.00683 0.00739
224 11D 0 -0.01930 0.01930 -0.03860 0.00709 -0.00355
225 11D+1 -0.05040 0.03025 0.05040 -0.08093 -0.07802
226 11D-1 0.03025 -0.05040 -0.05040 0.08093 0.08093
227 11D+2 0.03343 0.03343 0.00000 0.00000 -0.00614
228 11D-2 -0.05040 0.05040 0.03025 -0.07802 -0.08093
229 12D 0 -0.23321 0.23321 -0.46642 0.17237 -0.08618
230 12D+1 -0.07805 -0.54700 0.07805 -0.74045 -0.56649
231 12D-1 -0.54700 -0.07805 -0.07805 0.74045 0.74045
232 12D+2 0.40393 0.40393 0.00000 0.00000 -0.14927
233 12D-2 -0.07805 0.07805 -0.54700 -0.56649 -0.74045
234 13F 0 -0.00454 0.00454 0.00045 -0.00092 0.00031
235 13F+1 -0.00028 0.00546 0.00009 0.00115 -0.00077
236 13F-1 0.00546 -0.00028 -0.00009 -0.00115 0.00056
237 13F+2 -0.00339 -0.00339 0.00000 0.00000 0.00121
238 13F-2 -0.00032 0.00032 0.00032 -0.00215 -0.00215
239 13F+3 0.00036 -0.00151 -0.00567 0.00049 -0.00099
240 13F-3 0.00151 -0.00036 -0.00567 0.00049 0.00072
241 14F 0 0.01141 -0.01141 -0.04155 -0.04137 -0.06467
242 14F+1 0.02545 -0.07875 0.06478 -0.06522 -0.01399
243 14F-1 -0.07875 0.02545 -0.06478 0.06522 0.02533
244 14F+2 0.09078 0.09078 0.00000 0.00000 -0.03240
245 14F-2 0.00335 -0.00335 -0.00335 -0.10245 -0.10245
246 14F+3 -0.03285 -0.04657 0.06461 0.03129 0.07097
247 14F-3 0.04657 0.03285 0.06461 0.03129 0.03270
248 15G 0 0.00287 -0.00287 -0.00018 -0.00442 -0.00237
249 15G+1 0.00225 -0.00117 0.00472 0.00008 0.00221
250 15G-1 -0.00117 0.00225 -0.00472 -0.00008 -0.00186
251 15G+2 0.00240 0.00240 0.00000 0.00000 -0.00183
252 15G-2 0.00350 -0.00350 0.00330 -0.00624 -0.00275
253 15G+3 -0.00459 -0.00308 0.00196 0.00290 0.00584
254 15G-3 0.00308 0.00459 0.00196 0.00290 0.00223
255 15G+4 0.00061 -0.00061 -0.00379 -0.00096 -0.00339
256 15G-4 -0.00373 -0.00373 0.00000 0.00000 0.00095
257 5 H 1S -0.00144 0.00144 -0.00144 -0.00224 0.00224
258 2S -0.01759 0.01759 -0.01759 -0.35947 0.35947
259 3S -2.08698 2.08698 -2.08698 3.82138 -3.82138
260 4S 2.81939 -2.81939 2.81939 14.58462 -14.58462
261 5S -0.07555 0.07555 -0.07555 -1.62152 1.62152
262 6PX -0.00142 -0.00567 0.00567 0.00619 -0.00619
263 6PY -0.00567 -0.00142 -0.00567 -0.00619 0.00070
264 6PZ 0.00567 -0.00567 -0.00142 0.00070 -0.00619
265 7PX 0.01765 0.03749 -0.03749 -0.05874 0.05874
266 7PY 0.03749 0.01765 0.03749 0.05874 -0.03685
267 7PZ -0.03749 0.03749 0.01765 -0.03685 0.05874
268 8PX -0.63370 0.06795 -0.06795 1.08316 -1.08316
269 8PY 0.06795 -0.63370 0.06795 -1.08316 1.09206
270 8PZ -0.06795 0.06795 -0.63370 1.09206 -1.08316
271 9PX -1.05851 -1.81618 1.81618 3.30960 -3.30960
272 9PY -1.81618 -1.05851 -1.81618 -3.30960 4.44040
273 9PZ 1.81618 -1.81618 -1.05851 4.44040 -3.30960
274 10D 0 -0.00256 0.00256 0.00513 -0.00095 -0.00047
275 10D+1 0.00417 -0.00164 0.00417 -0.00739 0.00683
276 10D-1 -0.00164 0.00417 -0.00417 0.00739 -0.00739
277 10D+2 0.00444 0.00444 0.00000 0.00000 -0.00082
278 10D-2 -0.00417 0.00417 -0.00164 0.00683 -0.00739
279 11D 0 0.01930 -0.01930 -0.03860 0.00709 0.00355
280 11D+1 -0.05040 0.03025 -0.05040 0.08093 -0.07802
281 11D-1 0.03025 -0.05040 0.05040 -0.08093 0.08093
282 11D+2 -0.03343 -0.03343 0.00000 0.00000 0.00614
283 11D-2 0.05040 -0.05040 0.03025 -0.07802 0.08093
284 12D 0 0.23321 -0.23321 -0.46642 0.17237 0.08618
285 12D+1 -0.07805 -0.54700 -0.07805 0.74045 -0.56649
286 12D-1 -0.54700 -0.07805 0.07805 -0.74045 0.74045
287 12D+2 -0.40393 -0.40393 0.00000 0.00000 0.14927
288 12D-2 0.07805 -0.07805 -0.54700 -0.56649 0.74045
289 13F 0 0.00454 -0.00454 0.00045 -0.00092 -0.00031
290 13F+1 -0.00028 0.00546 -0.00009 -0.00115 -0.00077
291 13F-1 0.00546 -0.00028 0.00009 0.00115 0.00056
292 13F+2 0.00339 0.00339 0.00000 0.00000 -0.00121
293 13F-2 0.00032 -0.00032 0.00032 -0.00215 0.00215
294 13F+3 0.00036 -0.00151 0.00567 -0.00049 -0.00099
295 13F-3 0.00151 -0.00036 0.00567 -0.00049 0.00072
296 14F 0 -0.01141 0.01141 -0.04155 -0.04137 0.06467
297 14F+1 0.02545 -0.07875 -0.06478 0.06522 -0.01399
298 14F-1 -0.07875 0.02545 0.06478 -0.06522 0.02533
299 14F+2 -0.09078 -0.09078 0.00000 0.00000 0.03240
300 14F-2 -0.00335 0.00335 -0.00335 -0.10245 0.10245
301 14F+3 -0.03285 -0.04657 -0.06461 -0.03129 0.07097
302 14F-3 0.04657 0.03285 -0.06461 -0.03129 0.03270
303 15G 0 -0.00287 0.00287 -0.00018 -0.00442 0.00237
304 15G+1 0.00225 -0.00117 -0.00472 -0.00008 0.00221
305 15G-1 -0.00117 0.00225 0.00472 0.00008 -0.00186
306 15G+2 -0.00240 -0.00240 0.00000 0.00000 0.00183
307 15G-2 -0.00350 0.00350 0.00330 -0.00624 0.00275
308 15G+3 -0.00459 -0.00308 -0.00196 -0.00290 0.00584
309 15G-3 0.00308 0.00459 -0.00196 -0.00290 0.00223
310 15G+4 -0.00061 0.00061 -0.00379 -0.00096 0.00339
311 15G-4 0.00373 0.00373 0.00000 0.00000 -0.00095
31 32 33 34 35
(T2)--V (A1)--V (E)--V (E)--V (T2)--V
Eigenvalues -- 0.93091 0.96966 0.97215 0.97215 1.06280
1 1 C 1S 0.00000 -0.05673 0.00000 0.00000 0.00000
2 2S 0.00000 -0.00963 0.00000 0.00000 0.00000
3 3S 0.00000 -0.57264 0.00000 0.00000 0.00000
4 4S 0.00000 -2.26262 0.00000 0.00000 0.00000
5 5S 0.00000 40.47802 0.00000 0.00000 0.00000
6 6S 0.00000 27.60537 0.00000 0.00000 0.00000
7 7PX -0.04781 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 -0.10964
10 8PX -0.45304 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 -0.66099
13 9PX 7.46895 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 1.03816
16 10PX 15.72351 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 16.65865
19 11PX -0.97908 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 -1.56584
22 12D 0 0.00000 0.00000 0.00374 -0.00034 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
24 12D-1 -0.03165 0.00000 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00034 0.00374 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.02011
27 13D 0 0.00000 0.00000 -0.08806 0.00794 0.00000
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.12853 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00000 -0.00794 -0.08806 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 -0.17095
32 14D 0 0.00000 0.00000 2.92754 -0.26391 0.00000
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
34 14D-1 4.38728 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.26391 2.92754 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.80469
37 15D 0 0.00000 0.00000 9.34642 -0.84257 0.00000
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
39 15D-1 4.59406 0.00000 0.00000 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.84257 9.34642 0.00000
41 15D-2 0.00000 0.00000 0.00000 0.00000 2.55691
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.01280
43 16F+1 -0.01925 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 -0.03250 0.00000 0.00000 0.00000
47 16F+3 0.02486 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 -0.03349
50 17F+1 0.32518 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 0.78272 0.00000 0.00000 0.00000
54 17F+3 -0.41981 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 -0.07382
57 18F+1 0.51139 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 1.40750 0.00000 0.00000 0.00000
61 18F+3 -0.66021 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 -0.02110 -0.01009 0.00091 0.00000
64 19G+1 0.00000 0.00000 0.00000 0.00000 0.00000
65 19G-1 -0.00824 0.00000 0.00000 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00141 0.01563 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00000 -0.01501
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
69 19G-3 0.02181 0.00000 0.00000 0.00000 0.00000
70 19G+4 0.00000 -0.01783 0.01193 -0.00108 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 -0.16483 -0.07226 0.00651 0.00000
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.00000
74 20G-1 -0.05073 0.00000 0.00000 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.01009 0.11194 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.42213
77 20G+3 0.00000 0.00000 0.00000 0.00000 0.00000
78 20G-3 0.13421 0.00000 0.00000 0.00000 0.00000
79 20G+4 0.00000 -0.13931 0.08550 -0.00771 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 -0.02848
82 21H+1 -0.01167 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 0.06342 -0.00572 0.00000
86 21H+3 -0.02396 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 -0.02987
89 21H-4 0.00000 0.00000 0.00572 0.06342 0.00000
90 21H+5 -0.00056 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 0.00224 0.00513 0.00000 0.00000 0.01665
93 2S 0.35947 0.32158 0.00000 0.00000 -0.02712
94 3S -3.82138 -3.66533 0.00000 0.00000 -1.61596
95 4S -14.58462 -14.10941 0.00000 0.00000 -8.10101
96 5S 1.62152 -1.25739 0.00000 0.00000 1.99415
97 6PX 0.00070 0.00349 0.00182 -0.00392 -0.00013
98 6PY 0.00619 0.00349 0.00249 0.00353 -0.00013
99 6PZ 0.00619 0.00349 -0.00430 0.00039 -0.00689
100 7PX -0.03685 -0.04771 -0.01814 0.03916 0.01624
101 7PY -0.05874 -0.04771 -0.02485 -0.03529 0.01624
102 7PZ -0.05874 -0.04771 0.04298 -0.00387 0.05864
103 8PX 1.09206 0.94903 0.14648 -0.31630 0.41383
104 8PY 1.08316 0.94903 0.20068 0.28500 0.41383
105 8PZ 1.08316 0.94903 -0.34716 0.03130 0.03662
106 9PX 4.44040 3.30358 1.69932 -3.66945 1.54380
107 9PY 3.30960 3.30358 2.32818 3.30638 1.54380
108 9PZ 3.30960 3.30358 -4.02750 0.36308 -0.27598
109 10D 0 -0.00047 0.00000 -0.00141 0.00013 0.00155
110 10D+1 0.00739 0.00699 0.00138 0.00197 -0.00024
111 10D-1 0.00683 0.00699 0.00101 -0.00218 -0.00024
112 10D+2 0.00082 0.00000 -0.00013 -0.00141 0.00000
113 10D-2 0.00739 0.00699 -0.00239 0.00022 -0.00456
114 11D 0 0.00355 0.00000 0.01852 -0.00167 0.01028
115 11D+1 -0.08093 -0.08349 -0.00910 -0.01292 -0.03359
116 11D-1 -0.07802 -0.08349 -0.00664 0.01434 -0.03359
117 11D+2 -0.00614 0.00000 0.00167 0.01852 0.00000
118 11D-2 -0.08093 -0.08349 0.01574 -0.00142 -0.02423
119 12D 0 0.08618 0.00000 0.79857 -0.07199 0.39184
120 12D+1 -0.74045 -0.51014 0.40608 0.57670 0.20360
121 12D-1 -0.56649 -0.51014 0.29640 -0.64003 0.20360
122 12D+2 -0.14927 0.00000 0.07199 0.79857 0.00000
123 12D-2 -0.74045 -0.51014 -0.70248 0.06333 -0.23574
124 13F 0 0.00031 -0.00333 -0.00154 0.00014 -0.00416
125 13F+1 0.00056 0.00204 0.00512 0.00341 0.00281
126 13F-1 0.00077 0.00204 0.00442 -0.00427 0.00281
127 13F+2 -0.00121 0.00000 0.00069 0.00766 0.00000
128 13F-2 0.00215 0.00592 0.00000 0.00000 0.00654
129 13F+3 -0.00072 -0.00263 0.00479 0.00087 -0.00168
130 13F-3 -0.00099 0.00263 -0.00455 0.00171 0.00168
131 14F 0 -0.06467 -0.04274 -0.02766 0.00249 0.00534
132 14F+1 0.02533 0.02617 -0.12626 -0.03973 -0.05887
133 14F-1 0.01399 0.02617 -0.11712 0.06167 -0.05887
134 14F+2 0.03240 0.00000 -0.01491 -0.16537 0.00000
135 14F-2 0.10245 0.08676 0.00000 0.00000 -0.04768
136 14F+3 -0.03270 -0.03379 -0.08304 -0.06265 -0.01140
137 14F-3 0.07097 0.03379 0.07049 -0.07650 0.01140
138 15G 0 0.00237 0.00370 -0.00457 0.00041 -0.00267
139 15G+1 0.00186 0.00166 0.00479 -0.00023 0.00064
140 15G-1 0.00221 0.00166 0.00475 -0.00063 0.00064
141 15G+2 -0.00183 0.00000 0.00064 0.00708 0.00000
142 15G-2 -0.00275 -0.00470 0.00723 -0.00065 0.00423
143 15G+3 0.00223 0.00440 0.00266 0.00644 -0.00162
144 15G-3 -0.00584 -0.00440 -0.00147 0.00681 0.00162
145 15G+4 0.00339 0.00313 0.00541 -0.00049 0.00209
146 15G-4 -0.00095 0.00000 0.00039 0.00431 0.00000
147 3 H 1S -0.00224 0.00513 0.00000 0.00000 0.01665
148 2S -0.35947 0.32158 0.00000 0.00000 -0.02712
149 3S 3.82138 -3.66533 0.00000 0.00000 -1.61596
150 4S 14.58462 -14.10941 0.00000 0.00000 -8.10101
151 5S -1.62152 -1.25739 0.00000 0.00000 1.99415
152 6PX 0.00070 -0.00349 -0.00182 0.00392 0.00013
153 6PY 0.00619 -0.00349 -0.00249 -0.00353 0.00013
154 6PZ -0.00619 0.00349 -0.00430 0.00039 -0.00689
155 7PX -0.03685 0.04771 0.01814 -0.03916 -0.01624
156 7PY -0.05874 0.04771 0.02485 0.03529 -0.01624
157 7PZ 0.05874 -0.04771 0.04298 -0.00387 0.05864
158 8PX 1.09206 -0.94903 -0.14648 0.31630 -0.41383
159 8PY 1.08316 -0.94903 -0.20068 -0.28500 -0.41383
160 8PZ -1.08316 0.94903 -0.34716 0.03130 0.03662
161 9PX 4.44040 -3.30358 -1.69932 3.66945 -1.54380
162 9PY 3.30960 -3.30358 -2.32818 -3.30638 -1.54380
163 9PZ -3.30960 3.30358 -4.02750 0.36308 -0.27598
164 10D 0 0.00047 0.00000 -0.00141 0.00013 0.00155
165 10D+1 0.00739 -0.00699 -0.00138 -0.00197 0.00024
166 10D-1 0.00683 -0.00699 -0.00101 0.00218 0.00024
167 10D+2 -0.00082 0.00000 -0.00013 -0.00141 0.00000
168 10D-2 -0.00739 0.00699 -0.00239 0.00022 -0.00456
169 11D 0 -0.00355 0.00000 0.01852 -0.00167 0.01028
170 11D+1 -0.08093 0.08349 0.00910 0.01292 0.03359
171 11D-1 -0.07802 0.08349 0.00664 -0.01434 0.03359
172 11D+2 0.00614 0.00000 0.00167 0.01852 0.00000
173 11D-2 0.08093 -0.08349 0.01574 -0.00142 -0.02423
174 12D 0 -0.08618 0.00000 0.79857 -0.07199 0.39184
175 12D+1 -0.74045 0.51014 -0.40608 -0.57670 -0.20360
176 12D-1 -0.56649 0.51014 -0.29640 0.64003 -0.20360
177 12D+2 0.14927 0.00000 0.07199 0.79857 0.00000
178 12D-2 0.74045 -0.51014 -0.70248 0.06333 -0.23574
179 13F 0 -0.00031 -0.00333 -0.00154 0.00014 -0.00416
180 13F+1 0.00056 -0.00204 -0.00512 -0.00341 -0.00281
181 13F-1 0.00077 -0.00204 -0.00442 0.00427 -0.00281
182 13F+2 0.00121 0.00000 0.00069 0.00766 0.00000
183 13F-2 -0.00215 0.00592 0.00000 0.00000 0.00654
184 13F+3 -0.00072 0.00263 -0.00479 -0.00087 0.00168
185 13F-3 -0.00099 -0.00263 0.00455 -0.00171 -0.00168
186 14F 0 0.06467 -0.04274 -0.02766 0.00249 0.00534
187 14F+1 0.02533 -0.02617 0.12626 0.03973 0.05887
188 14F-1 0.01399 -0.02617 0.11712 -0.06167 0.05887
189 14F+2 -0.03240 0.00000 -0.01491 -0.16537 0.00000
190 14F-2 -0.10245 0.08676 0.00000 0.00000 -0.04768
191 14F+3 -0.03270 0.03379 0.08304 0.06265 0.01140
192 14F-3 0.07097 -0.03379 -0.07049 0.07650 -0.01140
193 15G 0 -0.00237 0.00370 -0.00457 0.00041 -0.00267
194 15G+1 0.00186 -0.00166 -0.00479 0.00023 -0.00064
195 15G-1 0.00221 -0.00166 -0.00475 0.00063 -0.00064
196 15G+2 0.00183 0.00000 0.00064 0.00708 0.00000
197 15G-2 0.00275 -0.00470 0.00723 -0.00065 0.00423
198 15G+3 0.00223 -0.00440 -0.00266 -0.00644 0.00162
199 15G-3 -0.00584 0.00440 0.00147 -0.00681 -0.00162
200 15G+4 -0.00339 0.00313 0.00541 -0.00049 0.00209
201 15G-4 0.00095 0.00000 0.00039 0.00431 0.00000
202 4 H 1S 0.00224 0.00513 0.00000 0.00000 -0.01665
203 2S 0.35947 0.32158 0.00000 0.00000 0.02712
204 3S -3.82138 -3.66533 0.00000 0.00000 1.61596
205 4S -14.58462 -14.10941 0.00000 0.00000 8.10101
206 5S 1.62152 -1.25739 0.00000 0.00000 -1.99415
207 6PX 0.00070 0.00349 0.00182 -0.00392 0.00013
208 6PY -0.00619 -0.00349 -0.00249 -0.00353 -0.00013
209 6PZ -0.00619 -0.00349 0.00430 -0.00039 -0.00689
210 7PX -0.03685 -0.04771 -0.01814 0.03916 -0.01624
211 7PY 0.05874 0.04771 0.02485 0.03529 0.01624
212 7PZ 0.05874 0.04771 -0.04298 0.00387 0.05864
213 8PX 1.09206 0.94903 0.14648 -0.31630 -0.41383
214 8PY -1.08316 -0.94903 -0.20068 -0.28500 0.41383
215 8PZ -1.08316 -0.94903 0.34716 -0.03130 0.03662
216 9PX 4.44040 3.30358 1.69932 -3.66945 -1.54380
217 9PY -3.30960 -3.30358 -2.32818 -3.30638 1.54380
218 9PZ -3.30960 -3.30358 4.02750 -0.36308 -0.27598
219 10D 0 -0.00047 0.00000 -0.00141 0.00013 -0.00155
220 10D+1 -0.00739 -0.00699 -0.00138 -0.00197 -0.00024
221 10D-1 0.00683 0.00699 0.00101 -0.00218 0.00024
222 10D+2 0.00082 0.00000 -0.00013 -0.00141 0.00000
223 10D-2 -0.00739 -0.00699 0.00239 -0.00022 -0.00456
224 11D 0 0.00355 0.00000 0.01852 -0.00167 -0.01028
225 11D+1 0.08093 0.08349 0.00910 0.01292 -0.03359
226 11D-1 -0.07802 -0.08349 -0.00664 0.01434 0.03359
227 11D+2 -0.00614 0.00000 0.00167 0.01852 0.00000
228 11D-2 0.08093 0.08349 -0.01574 0.00142 -0.02423
229 12D 0 0.08618 0.00000 0.79857 -0.07199 -0.39184
230 12D+1 0.74045 0.51014 -0.40608 -0.57670 0.20360
231 12D-1 -0.56649 -0.51014 0.29640 -0.64003 -0.20360
232 12D+2 -0.14927 0.00000 0.07199 0.79857 0.00000
233 12D-2 0.74045 0.51014 0.70248 -0.06333 -0.23574
234 13F 0 -0.00031 0.00333 0.00154 -0.00014 -0.00416
235 13F+1 0.00056 0.00204 0.00512 0.00341 -0.00281
236 13F-1 -0.00077 -0.00204 -0.00442 0.00427 0.00281
237 13F+2 0.00121 0.00000 -0.00069 -0.00766 0.00000
238 13F-2 0.00215 0.00592 0.00000 0.00000 -0.00654
239 13F+3 -0.00072 -0.00263 0.00479 0.00087 0.00168
240 13F-3 0.00099 -0.00263 0.00455 -0.00171 0.00168
241 14F 0 0.06467 0.04274 0.02766 -0.00249 0.00534
242 14F+1 0.02533 0.02617 -0.12626 -0.03973 0.05887
243 14F-1 -0.01399 -0.02617 0.11712 -0.06167 -0.05887
244 14F+2 -0.03240 0.00000 0.01491 0.16537 0.00000
245 14F-2 0.10245 0.08676 0.00000 0.00000 0.04768
246 14F+3 -0.03270 -0.03379 -0.08304 -0.06265 0.01140
247 14F-3 -0.07097 -0.03379 -0.07049 0.07650 0.01140
248 15G 0 0.00237 0.00370 -0.00457 0.00041 0.00267
249 15G+1 -0.00186 -0.00166 -0.00479 0.00023 0.00064
250 15G-1 0.00221 0.00166 0.00475 -0.00063 -0.00064
251 15G+2 -0.00183 0.00000 0.00064 0.00708 0.00000
252 15G-2 0.00275 0.00470 -0.00723 0.00065 0.00423
253 15G+3 -0.00223 -0.00440 -0.00266 -0.00644 -0.00162
254 15G-3 -0.00584 -0.00440 -0.00147 0.00681 -0.00162
255 15G+4 0.00339 0.00313 0.00541 -0.00049 -0.00209
256 15G-4 0.00095 0.00000 -0.00039 -0.00431 0.00000
257 5 H 1S -0.00224 0.00513 0.00000 0.00000 -0.01665
258 2S -0.35947 0.32158 0.00000 0.00000 0.02712
259 3S 3.82138 -3.66533 0.00000 0.00000 1.61596
260 4S 14.58462 -14.10941 0.00000 0.00000 8.10101
261 5S -1.62152 -1.25739 0.00000 0.00000 -1.99415
262 6PX 0.00070 -0.00349 -0.00182 0.00392 -0.00013
263 6PY -0.00619 0.00349 0.00249 0.00353 0.00013
264 6PZ 0.00619 -0.00349 0.00430 -0.00039 -0.00689
265 7PX -0.03685 0.04771 0.01814 -0.03916 0.01624
266 7PY 0.05874 -0.04771 -0.02485 -0.03529 -0.01624
267 7PZ -0.05874 0.04771 -0.04298 0.00387 0.05864
268 8PX 1.09206 -0.94903 -0.14648 0.31630 0.41383
269 8PY -1.08316 0.94903 0.20068 0.28500 -0.41383
270 8PZ 1.08316 -0.94903 0.34716 -0.03130 0.03662
271 9PX 4.44040 -3.30358 -1.69932 3.66945 1.54380
272 9PY -3.30960 3.30358 2.32818 3.30638 -1.54380
273 9PZ 3.30960 -3.30358 4.02750 -0.36308 -0.27598
274 10D 0 0.00047 0.00000 -0.00141 0.00013 -0.00155
275 10D+1 -0.00739 0.00699 0.00138 0.00197 0.00024
276 10D-1 0.00683 -0.00699 -0.00101 0.00218 -0.00024
277 10D+2 -0.00082 0.00000 -0.00013 -0.00141 0.00000
278 10D-2 0.00739 -0.00699 0.00239 -0.00022 -0.00456
279 11D 0 -0.00355 0.00000 0.01852 -0.00167 -0.01028
280 11D+1 0.08093 -0.08349 -0.00910 -0.01292 0.03359
281 11D-1 -0.07802 0.08349 0.00664 -0.01434 -0.03359
282 11D+2 0.00614 0.00000 0.00167 0.01852 0.00000
283 11D-2 -0.08093 0.08349 -0.01574 0.00142 -0.02423
284 12D 0 -0.08618 0.00000 0.79857 -0.07199 -0.39184
285 12D+1 0.74045 -0.51014 0.40608 0.57670 -0.20360
286 12D-1 -0.56649 0.51014 -0.29640 0.64003 0.20360
287 12D+2 0.14927 0.00000 0.07199 0.79857 0.00000
288 12D-2 -0.74045 0.51014 0.70248 -0.06333 -0.23574
289 13F 0 0.00031 0.00333 0.00154 -0.00014 -0.00416
290 13F+1 0.00056 -0.00204 -0.00512 -0.00341 0.00281
291 13F-1 -0.00077 0.00204 0.00442 -0.00427 -0.00281
292 13F+2 -0.00121 0.00000 -0.00069 -0.00766 0.00000
293 13F-2 -0.00215 0.00592 0.00000 0.00000 -0.00654
294 13F+3 -0.00072 0.00263 -0.00479 -0.00087 -0.00168
295 13F-3 0.00099 0.00263 -0.00455 0.00171 -0.00168
296 14F 0 -0.06467 0.04274 0.02766 -0.00249 0.00534
297 14F+1 0.02533 -0.02617 0.12626 0.03973 -0.05887
298 14F-1 -0.01399 0.02617 -0.11712 0.06167 0.05887
299 14F+2 0.03240 0.00000 0.01491 0.16537 0.00000
300 14F-2 -0.10245 0.08676 0.00000 0.00000 0.04768
301 14F+3 -0.03270 0.03379 0.08304 0.06265 -0.01140
302 14F-3 -0.07097 0.03379 0.07049 -0.07650 -0.01140
303 15G 0 -0.00237 0.00370 -0.00457 0.00041 0.00267
304 15G+1 -0.00186 0.00166 0.00479 -0.00023 -0.00064
305 15G-1 0.00221 -0.00166 -0.00475 0.00063 0.00064
306 15G+2 0.00183 0.00000 0.00064 0.00708 0.00000
307 15G-2 -0.00275 0.00470 -0.00723 0.00065 0.00423
308 15G+3 -0.00223 0.00440 0.00266 0.00644 0.00162
309 15G-3 -0.00584 0.00440 0.00147 -0.00681 0.00162
310 15G+4 -0.00339 0.00313 0.00541 -0.00049 -0.00209
311 15G-4 -0.00095 0.00000 -0.00039 -0.00431 0.00000
36 37 38 39 40
(T2)--V (T2)--V (A1)--V (T2)--V (T2)--V
Eigenvalues -- 1.06280 1.06280 1.15631 1.29202 1.29202
1 1 C 1S 0.00000 0.00000 -0.08093 0.00000 0.00000
2 2S 0.00000 0.00000 0.10766 0.00000 0.00000
3 3S 0.00000 0.00000 -0.22081 0.00000 0.00000
4 4S 0.00000 0.00000 0.87096 0.00000 0.00000
5 5S 0.00000 0.00000 4.15281 0.00000 0.00000
6 6S 0.00000 0.00000 1.92768 0.00000 0.00000
7 7PX 0.00000 -0.10964 0.00000 0.00000 0.00000
8 7PY -0.10964 0.00000 0.00000 0.00000 0.04845
9 7PZ 0.00000 0.00000 0.00000 0.04845 0.00000
10 8PX 0.00000 -0.66099 0.00000 0.00000 0.00000
11 8PY -0.66099 0.00000 0.00000 0.00000 -0.75196
12 8PZ 0.00000 0.00000 0.00000 -0.75196 0.00000
13 9PX 0.00000 1.03816 0.00000 0.00000 0.00000
14 9PY 1.03816 0.00000 0.00000 0.00000 7.46932
15 9PZ 0.00000 0.00000 0.00000 7.46932 0.00000
16 10PX 0.00000 16.65865 0.00000 0.00000 0.00000
17 10PY 16.65865 0.00000 0.00000 0.00000 29.05974
18 10PZ 0.00000 0.00000 0.00000 29.05974 0.00000
19 11PX 0.00000 -1.56584 0.00000 0.00000 0.00000
20 11PY -1.56584 0.00000 0.00000 0.00000 1.31506
21 11PZ 0.00000 0.00000 0.00000 1.31506 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.02011 0.00000 0.00000 0.00000 -0.03600
24 12D-1 0.00000 0.02011 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 -0.03600 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 -0.17095 0.00000 0.00000 0.00000 -0.01228
29 13D-1 0.00000 -0.17095 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 -0.01228 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.80469 0.00000 0.00000 0.00000 3.55319
34 14D-1 0.00000 0.80469 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 3.55319 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 2.55691 0.00000 0.00000 0.00000 8.20219
39 15D-1 0.00000 2.55691 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 8.20219 0.00000
42 16F 0 0.00000 0.00000 0.00000 0.03085 0.00000
43 16F+1 0.00000 -0.00784 0.00000 0.00000 0.00000
44 16F-1 -0.00784 0.00000 0.00000 0.00000 -0.01889
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-2 0.00000 0.00000 -0.00038 0.00000 0.00000
47 16F+3 0.00000 0.01012 0.00000 0.00000 0.00000
48 16F-3 -0.01012 0.00000 0.00000 0.00000 -0.02439
49 17F 0 0.00000 0.00000 0.00000 -0.40855 0.00000
50 17F+1 0.00000 0.02051 0.00000 0.00000 0.00000
51 17F-1 0.02051 0.00000 0.00000 0.00000 0.25018
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.06888 0.00000 0.00000
54 17F+3 0.00000 -0.02647 0.00000 0.00000 0.00000
55 17F-3 0.02647 0.00000 0.00000 0.00000 0.32299
56 18F 0 0.00000 0.00000 0.00000 -1.20781 0.00000
57 18F+1 0.00000 0.04521 0.00000 0.00000 0.00000
58 18F-1 0.04521 0.00000 0.00000 0.00000 0.73963
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
60 18F-2 0.00000 0.00000 -0.19302 0.00000 0.00000
61 18F+3 0.00000 -0.05836 0.00000 0.00000 0.00000
62 18F-3 0.05836 0.00000 0.00000 0.00000 0.95486
63 19G 0 0.00000 0.00000 -0.00574 0.00000 0.00000
64 19G+1 0.00531 0.00000 0.00000 0.00000 -0.01146
65 19G-1 0.00000 0.00531 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 0.03242 0.00000
68 19G+3 0.01404 0.00000 0.00000 0.00000 -0.03033
69 19G-3 0.00000 -0.01404 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 -0.00485 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 -0.01167 0.00000 0.00000
73 20G+1 -0.14924 0.00000 0.00000 0.00000 -0.17235
74 20G-1 0.00000 -0.14924 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 0.48747 0.00000
77 20G+3 -0.39486 0.00000 0.00000 0.00000 -0.45599
78 20G-3 0.00000 0.39486 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 -0.00986 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 -0.03236 0.00000
82 21H+1 0.00000 -0.03090 0.00000 0.00000 0.00000
83 21H-1 -0.03090 0.00000 0.00000 0.00000 -0.04179
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 -0.00887 0.00000 0.00000 0.00000
87 21H-3 0.00887 0.00000 0.00000 0.00000 0.01936
88 21H+4 0.00000 0.00000 0.00000 -0.04561 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00000 -0.02588 0.00000 0.00000 0.00000
91 21H-5 -0.02588 0.00000 0.00000 0.00000 -0.03172
92 2 H 1S 0.01665 0.01665 -0.04791 -0.03234 -0.03234
93 2S -0.02712 -0.02712 0.09237 0.29869 0.29869
94 3S -1.61596 -1.61596 -1.19082 -6.12499 -6.12499
95 4S -8.10101 -8.10101 -0.10119 -18.72948 -18.72948
96 5S 1.99415 1.99415 -0.52719 0.55876 0.55876
97 6PX -0.00013 -0.00689 -0.00923 -0.01177 -0.01177
98 6PY -0.00689 -0.00013 -0.00923 -0.01177 -0.00045
99 6PZ -0.00013 -0.00013 -0.00923 -0.00045 -0.01177
100 7PX 0.01624 0.05864 0.03493 0.04051 0.04051
101 7PY 0.05864 0.01624 0.03493 0.04051 -0.00524
102 7PZ 0.01624 0.01624 0.03493 -0.00524 0.04051
103 8PX 0.41383 0.03662 -0.09538 0.96528 0.96528
104 8PY 0.03662 0.41383 -0.09538 0.96528 1.04242
105 8PZ 0.41383 0.41383 -0.09538 1.04242 0.96528
106 9PX 1.54380 -0.27598 0.64465 4.36051 4.36051
107 9PY -0.27598 1.54380 0.64465 4.36051 2.84035
108 9PZ 1.54380 1.54380 0.64465 2.84035 4.36051
109 10D 0 -0.00078 -0.00078 0.00000 -0.00603 0.00302
110 10D+1 -0.00456 -0.00024 0.00229 0.00947 0.01457
111 10D-1 -0.00024 -0.00456 0.00229 0.00947 0.00947
112 10D+2 -0.00134 0.00134 0.00000 0.00000 0.00522
113 10D-2 -0.00024 -0.00024 0.00229 0.01457 0.00947
114 11D 0 -0.00514 -0.00514 0.00000 0.03713 -0.01857
115 11D+1 -0.02423 -0.03359 -0.01422 -0.11904 -0.14838
116 11D-1 -0.03359 -0.02423 -0.01422 -0.11904 -0.11904
117 11D+2 -0.00890 0.00890 0.00000 0.00000 -0.03216
118 11D-2 -0.03359 -0.03359 -0.01422 -0.14838 -0.11904
119 12D 0 -0.19592 -0.19592 0.00000 0.17488 -0.08744
120 12D+1 -0.23574 0.20360 -0.06585 -0.28832 -0.39608
121 12D-1 0.20360 -0.23574 -0.06585 -0.28832 -0.28832
122 12D+2 -0.33934 0.33934 0.00000 0.00000 -0.15145
123 12D-2 0.20360 0.20360 -0.06585 -0.39608 -0.28832
124 13F 0 -0.00305 -0.00305 0.00037 -0.00417 -0.00596
125 13F+1 0.00092 0.00255 -0.00023 0.00608 0.00122
126 13F-1 0.00255 0.00092 -0.00023 0.00608 0.00255
127 13F+2 -0.00119 0.00119 0.00000 0.00000 -0.00307
128 13F-2 0.00654 0.00654 -0.00135 0.00736 0.00736
129 13F+3 -0.00314 -0.00329 0.00029 -0.00283 -0.00659
130 13F-3 0.00329 0.00314 -0.00029 0.00283 0.00330
131 14F 0 0.02704 0.02704 -0.01416 -0.04750 -0.00739
132 14F+1 0.02576 -0.00327 0.00867 -0.03382 0.04287
133 14F-1 -0.00327 0.02576 0.00867 -0.03382 0.02909
134 14F+2 0.05352 -0.05352 0.00000 0.00000 0.04850
135 14F-2 -0.04768 -0.04768 0.03332 0.05220 0.05220
136 14F+3 0.05415 0.00422 -0.01120 -0.03554 0.02386
137 14F-3 -0.00422 -0.05415 0.01120 0.03554 0.03755
138 15G 0 0.00055 0.00055 0.00107 0.00062 0.00219
139 15G+1 -0.00150 -0.00155 0.00070 0.00305 0.00028
140 15G-1 -0.00155 -0.00150 0.00070 0.00305 -0.00081
141 15G+2 -0.00287 0.00287 0.00000 0.00000 -0.00141
142 15G-2 0.00129 0.00129 -0.00197 -0.00078 -0.00318
143 15G+3 -0.00396 -0.00080 0.00184 0.00224 0.00073
144 15G-3 0.00080 0.00396 -0.00184 -0.00224 -0.00370
145 15G+4 -0.00171 -0.00171 0.00091 0.00265 0.00079
146 15G-4 -0.00117 0.00117 0.00000 0.00000 -0.00206
147 3 H 1S -0.01665 -0.01665 -0.04791 -0.03234 0.03234
148 2S 0.02712 0.02712 0.09237 0.29869 -0.29869
149 3S 1.61596 1.61596 -1.19082 -6.12499 6.12499
150 4S 8.10101 8.10101 -0.10119 -18.72948 18.72948
151 5S -1.99415 -1.99415 -0.52719 0.55876 -0.55876
152 6PX -0.00013 -0.00689 0.00923 0.01177 -0.01177
153 6PY -0.00689 -0.00013 0.00923 0.01177 -0.00045
154 6PZ 0.00013 0.00013 -0.00923 -0.00045 0.01177
155 7PX 0.01624 0.05864 -0.03493 -0.04051 0.04051
156 7PY 0.05864 0.01624 -0.03493 -0.04051 -0.00524
157 7PZ -0.01624 -0.01624 0.03493 -0.00524 -0.04051
158 8PX 0.41383 0.03662 0.09538 -0.96528 0.96528
159 8PY 0.03662 0.41383 0.09538 -0.96528 1.04242
160 8PZ -0.41383 -0.41383 -0.09538 1.04242 -0.96528
161 9PX 1.54380 -0.27598 -0.64465 -4.36051 4.36051
162 9PY -0.27598 1.54380 -0.64465 -4.36051 2.84035
163 9PZ -1.54380 -1.54380 0.64465 2.84035 -4.36051
164 10D 0 0.00078 0.00078 0.00000 -0.00603 -0.00302
165 10D+1 -0.00456 -0.00024 -0.00229 -0.00947 0.01457
166 10D-1 -0.00024 -0.00456 -0.00229 -0.00947 0.00947
167 10D+2 0.00134 -0.00134 0.00000 0.00000 -0.00522
168 10D-2 0.00024 0.00024 0.00229 0.01457 -0.00947
169 11D 0 0.00514 0.00514 0.00000 0.03713 0.01857
170 11D+1 -0.02423 -0.03359 0.01422 0.11904 -0.14838
171 11D-1 -0.03359 -0.02423 0.01422 0.11904 -0.11904
172 11D+2 0.00890 -0.00890 0.00000 0.00000 0.03216
173 11D-2 0.03359 0.03359 -0.01422 -0.14838 0.11904
174 12D 0 0.19592 0.19592 0.00000 0.17488 0.08744
175 12D+1 -0.23574 0.20360 0.06585 0.28832 -0.39608
176 12D-1 0.20360 -0.23574 0.06585 0.28832 -0.28832
177 12D+2 0.33934 -0.33934 0.00000 0.00000 0.15145
178 12D-2 -0.20360 -0.20360 -0.06585 -0.39608 0.28832
179 13F 0 0.00305 0.00305 0.00037 -0.00417 0.00596
180 13F+1 0.00092 0.00255 0.00023 -0.00608 0.00122
181 13F-1 0.00255 0.00092 0.00023 -0.00608 0.00255
182 13F+2 0.00119 -0.00119 0.00000 0.00000 0.00307
183 13F-2 -0.00654 -0.00654 -0.00135 0.00736 -0.00736
184 13F+3 -0.00314 -0.00329 -0.00029 0.00283 -0.00659
185 13F-3 0.00329 0.00314 0.00029 -0.00283 0.00330
186 14F 0 -0.02704 -0.02704 -0.01416 -0.04750 0.00739
187 14F+1 0.02576 -0.00327 -0.00867 0.03382 0.04287
188 14F-1 -0.00327 0.02576 -0.00867 0.03382 0.02909
189 14F+2 -0.05352 0.05352 0.00000 0.00000 -0.04850
190 14F-2 0.04768 0.04768 0.03332 0.05220 -0.05220
191 14F+3 0.05415 0.00422 0.01120 0.03554 0.02386
192 14F-3 -0.00422 -0.05415 -0.01120 -0.03554 0.03755
193 15G 0 -0.00055 -0.00055 0.00107 0.00062 -0.00219
194 15G+1 -0.00150 -0.00155 -0.00070 -0.00305 0.00028
195 15G-1 -0.00155 -0.00150 -0.00070 -0.00305 -0.00081
196 15G+2 0.00287 -0.00287 0.00000 0.00000 0.00141
197 15G-2 -0.00129 -0.00129 -0.00197 -0.00078 0.00318
198 15G+3 -0.00396 -0.00080 -0.00184 -0.00224 0.00073
199 15G-3 0.00080 0.00396 0.00184 0.00224 -0.00370
200 15G+4 0.00171 0.00171 0.00091 0.00265 -0.00079
201 15G-4 0.00117 -0.00117 0.00000 0.00000 0.00206
202 4 H 1S -0.01665 0.01665 -0.04791 0.03234 0.03234
203 2S 0.02712 -0.02712 0.09237 -0.29869 -0.29869
204 3S 1.61596 -1.61596 -1.19082 6.12499 6.12499
205 4S 8.10101 -8.10101 -0.10119 18.72948 18.72948
206 5S -1.99415 1.99415 -0.52719 -0.55876 -0.55876
207 6PX 0.00013 -0.00689 -0.00923 0.01177 0.01177
208 6PY -0.00689 0.00013 0.00923 -0.01177 -0.00045
209 6PZ -0.00013 0.00013 0.00923 -0.00045 -0.01177
210 7PX -0.01624 0.05864 0.03493 -0.04051 -0.04051
211 7PY 0.05864 -0.01624 -0.03493 0.04051 -0.00524
212 7PZ 0.01624 -0.01624 -0.03493 -0.00524 0.04051
213 8PX -0.41383 0.03662 -0.09538 -0.96528 -0.96528
214 8PY 0.03662 -0.41383 0.09538 0.96528 1.04242
215 8PZ 0.41383 -0.41383 0.09538 1.04242 0.96528
216 9PX -1.54380 -0.27598 0.64465 -4.36051 -4.36051
217 9PY -0.27598 -1.54380 -0.64465 4.36051 2.84035
218 9PZ 1.54380 -1.54380 -0.64465 2.84035 4.36051
219 10D 0 0.00078 -0.00078 0.00000 0.00603 -0.00302
220 10D+1 -0.00456 0.00024 -0.00229 0.00947 0.01457
221 10D-1 0.00024 -0.00456 0.00229 -0.00947 -0.00947
222 10D+2 0.00134 0.00134 0.00000 0.00000 -0.00522
223 10D-2 -0.00024 0.00024 -0.00229 0.01457 0.00947
224 11D 0 0.00514 -0.00514 0.00000 -0.03713 0.01857
225 11D+1 -0.02423 0.03359 0.01422 -0.11904 -0.14838
226 11D-1 0.03359 -0.02423 -0.01422 0.11904 0.11904
227 11D+2 0.00890 0.00890 0.00000 0.00000 0.03216
228 11D-2 -0.03359 0.03359 0.01422 -0.14838 -0.11904
229 12D 0 0.19592 -0.19592 0.00000 -0.17488 0.08744
230 12D+1 -0.23574 -0.20360 0.06585 -0.28832 -0.39608
231 12D-1 -0.20360 -0.23574 -0.06585 0.28832 0.28832
232 12D+2 0.33934 0.33934 0.00000 0.00000 0.15145
233 12D-2 0.20360 -0.20360 0.06585 -0.39608 -0.28832
234 13F 0 -0.00305 0.00305 -0.00037 -0.00417 -0.00596
235 13F+1 -0.00092 0.00255 -0.00023 -0.00608 -0.00122
236 13F-1 0.00255 -0.00092 0.00023 0.00608 0.00255
237 13F+2 -0.00119 -0.00119 0.00000 0.00000 -0.00307
238 13F-2 -0.00654 0.00654 -0.00135 -0.00736 -0.00736
239 13F+3 0.00314 -0.00329 0.00029 0.00283 0.00659
240 13F-3 0.00329 -0.00314 0.00029 0.00283 0.00330
241 14F 0 0.02704 -0.02704 0.01416 -0.04750 -0.00739
242 14F+1 -0.02576 -0.00327 0.00867 0.03382 -0.04287
243 14F-1 -0.00327 -0.02576 -0.00867 -0.03382 0.02909
244 14F+2 0.05352 0.05352 0.00000 0.00000 0.04850
245 14F-2 0.04768 -0.04768 0.03332 -0.05220 -0.05220
246 14F+3 -0.05415 0.00422 -0.01120 0.03554 -0.02386
247 14F-3 -0.00422 0.05415 -0.01120 0.03554 0.03755
248 15G 0 -0.00055 0.00055 0.00107 -0.00062 -0.00219
249 15G+1 -0.00150 0.00155 -0.00070 0.00305 0.00028
250 15G-1 0.00155 -0.00150 0.00070 -0.00305 0.00081
251 15G+2 0.00287 0.00287 0.00000 0.00000 0.00141
252 15G-2 0.00129 -0.00129 0.00197 -0.00078 -0.00318
253 15G+3 -0.00396 0.00080 -0.00184 0.00224 0.00073
254 15G-3 -0.00080 0.00396 -0.00184 0.00224 0.00370
255 15G+4 0.00171 -0.00171 0.00091 -0.00265 -0.00079
256 15G-4 -0.00117 -0.00117 0.00000 0.00000 -0.00206
257 5 H 1S 0.01665 -0.01665 -0.04791 0.03234 -0.03234
258 2S -0.02712 0.02712 0.09237 -0.29869 0.29869
259 3S -1.61596 1.61596 -1.19082 6.12499 -6.12499
260 4S -8.10101 8.10101 -0.10119 18.72948 -18.72948
261 5S 1.99415 -1.99415 -0.52719 -0.55876 0.55876
262 6PX 0.00013 -0.00689 0.00923 -0.01177 0.01177
263 6PY -0.00689 0.00013 -0.00923 0.01177 -0.00045
264 6PZ 0.00013 -0.00013 0.00923 -0.00045 0.01177
265 7PX -0.01624 0.05864 -0.03493 0.04051 -0.04051
266 7PY 0.05864 -0.01624 0.03493 -0.04051 -0.00524
267 7PZ -0.01624 0.01624 -0.03493 -0.00524 -0.04051
268 8PX -0.41383 0.03662 0.09538 0.96528 -0.96528
269 8PY 0.03662 -0.41383 -0.09538 -0.96528 1.04242
270 8PZ -0.41383 0.41383 0.09538 1.04242 -0.96528
271 9PX -1.54380 -0.27598 -0.64465 4.36051 -4.36051
272 9PY -0.27598 -1.54380 0.64465 -4.36051 2.84035
273 9PZ -1.54380 1.54380 -0.64465 2.84035 -4.36051
274 10D 0 -0.00078 0.00078 0.00000 0.00603 0.00302
275 10D+1 -0.00456 0.00024 0.00229 -0.00947 0.01457
276 10D-1 0.00024 -0.00456 -0.00229 0.00947 -0.00947
277 10D+2 -0.00134 -0.00134 0.00000 0.00000 0.00522
278 10D-2 0.00024 -0.00024 -0.00229 0.01457 -0.00947
279 11D 0 -0.00514 0.00514 0.00000 -0.03713 -0.01857
280 11D+1 -0.02423 0.03359 -0.01422 0.11904 -0.14838
281 11D-1 0.03359 -0.02423 0.01422 -0.11904 0.11904
282 11D+2 -0.00890 -0.00890 0.00000 0.00000 -0.03216
283 11D-2 0.03359 -0.03359 0.01422 -0.14838 0.11904
284 12D 0 -0.19592 0.19592 0.00000 -0.17488 -0.08744
285 12D+1 -0.23574 -0.20360 -0.06585 0.28832 -0.39608
286 12D-1 -0.20360 -0.23574 0.06585 -0.28832 0.28832
287 12D+2 -0.33934 -0.33934 0.00000 0.00000 -0.15145
288 12D-2 -0.20360 0.20360 0.06585 -0.39608 0.28832
289 13F 0 0.00305 -0.00305 -0.00037 -0.00417 0.00596
290 13F+1 -0.00092 0.00255 0.00023 0.00608 -0.00122
291 13F-1 0.00255 -0.00092 -0.00023 -0.00608 0.00255
292 13F+2 0.00119 0.00119 0.00000 0.00000 0.00307
293 13F-2 0.00654 -0.00654 -0.00135 -0.00736 0.00736
294 13F+3 0.00314 -0.00329 -0.00029 -0.00283 0.00659
295 13F-3 0.00329 -0.00314 -0.00029 -0.00283 0.00330
296 14F 0 -0.02704 0.02704 0.01416 -0.04750 0.00739
297 14F+1 -0.02576 -0.00327 -0.00867 -0.03382 -0.04287
298 14F-1 -0.00327 -0.02576 0.00867 0.03382 0.02909
299 14F+2 -0.05352 -0.05352 0.00000 0.00000 -0.04850
300 14F-2 -0.04768 0.04768 0.03332 -0.05220 0.05220
301 14F+3 -0.05415 0.00422 0.01120 -0.03554 -0.02386
302 14F-3 -0.00422 0.05415 0.01120 -0.03554 0.03755
303 15G 0 0.00055 -0.00055 0.00107 -0.00062 0.00219
304 15G+1 -0.00150 0.00155 0.00070 -0.00305 0.00028
305 15G-1 0.00155 -0.00150 -0.00070 0.00305 0.00081
306 15G+2 -0.00287 -0.00287 0.00000 0.00000 -0.00141
307 15G-2 -0.00129 0.00129 0.00197 -0.00078 0.00318
308 15G+3 -0.00396 0.00080 0.00184 -0.00224 0.00073
309 15G-3 -0.00080 0.00396 0.00184 -0.00224 0.00370
310 15G+4 -0.00171 0.00171 0.00091 -0.00265 0.00079
311 15G-4 0.00117 0.00117 0.00000 0.00000 0.00206
41 42 43 44 45
(T2)--V (E)--V (E)--V (T1)--V (T1)--V
Eigenvalues -- 1.29202 1.45259 1.45259 1.47901 1.47901
1 1 C 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 0.04845 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 -0.75196 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 7.46932 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 29.05974 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 1.31506 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 0.02692 -0.00458 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
24 12D-1 -0.03600 0.00000 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.00458 0.02692 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 -0.08253 0.01405 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
29 13D-1 -0.01228 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.00000 -0.01405 -0.08253 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 2.14284 -0.36470 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
34 14D-1 3.55319 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.36470 2.14284 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15D 0 0.00000 -2.08651 0.35511 0.00000 0.00000
38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
39 15D-1 8.20219 0.00000 0.00000 0.00000 0.00000
40 15D+2 0.00000 -0.35511 -2.08651 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 -0.01889 0.00000 0.00000 -0.04621 0.00000
44 16F-1 0.00000 0.00000 0.00000 0.00000 -0.04621
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 0.02439 0.00000 0.00000 -0.03579 0.00000
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.03579
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.25018 0.00000 0.00000 0.53713 0.00000
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.53713
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 -0.32299 0.00000 0.00000 0.41606 0.00000
55 17F-3 0.00000 0.00000 0.00000 0.00000 -0.41606
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.73963 0.00000 0.00000 2.96627 0.00000
58 18F-1 0.00000 0.00000 0.00000 0.00000 2.96627
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 -0.95486 0.00000 0.00000 2.29766 0.00000
62 18F-3 0.00000 0.00000 0.00000 0.00000 -2.29766
63 19G 0 0.00000 -0.01038 0.00177 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 0.00000 -0.01901
65 19G-1 -0.01146 0.00000 0.00000 -0.01901 0.00000
66 19G+2 0.00000 0.00274 0.01608 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 0.00719
69 19G-3 0.03033 0.00000 0.00000 -0.00719 0.00000
70 19G+4 0.00000 0.01228 -0.00209 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 -0.14943 0.02543 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.67162
74 20G-1 -0.17235 0.00000 0.00000 0.67162 0.00000
75 20G+2 0.00000 0.03940 0.23149 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 -0.25385
78 20G-3 0.45599 0.00000 0.00000 0.25385 0.00000
79 20G+4 0.00000 0.17680 -0.03009 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 -0.04179 0.00000 0.00000 0.01044 0.00000
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.01044
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 21H-2 0.00000 0.09482 -0.01614 0.00000 0.00000
86 21H+3 -0.01936 0.00000 0.00000 -0.00483 0.00000
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.00483
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
89 21H-4 0.00000 0.01614 0.09482 0.00000 0.00000
90 21H+5 -0.03172 0.00000 0.00000 -0.01081 0.00000
91 21H-5 0.00000 0.00000 0.00000 0.00000 -0.01081
92 2 H 1S -0.03234 0.00000 0.00000 0.00000 0.00000
93 2S 0.29869 0.00000 0.00000 0.00000 0.00000
94 3S -6.12499 0.00000 0.00000 0.00000 0.00000
95 4S -18.72948 0.00000 0.00000 0.00000 0.00000
96 5S 0.55876 0.00000 0.00000 0.00000 0.00000
97 6PX -0.00045 -0.00587 0.01584 0.00000 0.00762
98 6PY -0.01177 -0.01078 -0.01300 0.00762 0.00000
99 6PZ -0.01177 0.01665 -0.00283 -0.00762 -0.00762
100 7PX -0.00524 0.01621 -0.04372 0.00000 -0.08417
101 7PY 0.04051 0.02976 0.03590 -0.08417 0.00000
102 7PZ 0.04051 -0.04597 0.00782 0.08417 0.08417
103 8PX 1.04242 0.01329 -0.03585 0.00000 0.85670
104 8PY 0.96528 0.02440 0.02943 0.85670 0.00000
105 8PZ 0.96528 -0.03769 0.00641 -0.85670 -0.85670
106 9PX 2.84035 -0.10680 0.28808 0.00000 1.41181
107 9PY 4.36051 -0.19608 -0.23653 1.41181 0.00000
108 9PZ 4.36051 0.30288 -0.05155 -1.41181 -1.41181
109 10D 0 0.00302 -0.01910 0.00325 -0.01254 -0.01254
110 10D+1 0.00947 -0.00932 -0.01124 -0.00686 0.00000
111 10D-1 0.01457 -0.00508 0.01369 0.00000 -0.00686
112 10D+2 -0.00522 -0.00325 -0.01910 -0.00724 0.00724
113 10D-2 0.00947 0.01440 -0.00245 0.00686 0.00686
114 11D 0 -0.01857 0.12530 -0.02132 0.08633 0.08633
115 11D+1 -0.11904 0.05547 0.06692 0.06426 0.00000
116 11D-1 -0.14838 0.03021 -0.08150 0.00000 0.06426
117 11D+2 0.03216 0.02132 0.12530 0.04985 -0.04985
118 11D-2 -0.11904 -0.08569 0.01458 -0.06426 -0.06426
119 12D 0 -0.08744 0.21553 -0.03668 0.87815 0.87815
120 12D+1 -0.28832 -0.00540 -0.00652 0.48551 0.00000
121 12D-1 -0.39608 -0.00294 0.00794 0.00000 0.48551
122 12D+2 0.15145 0.03668 0.21553 0.50700 -0.50700
123 12D-2 -0.28832 0.00835 -0.00142 -0.48551 -0.48551
124 13F 0 -0.00596 0.00302 -0.00051 0.00534 0.00534
125 13F+1 0.00255 0.00117 -0.00156 0.00090 0.00155
126 13F-1 0.00122 0.00162 0.00109 0.00155 0.00090
127 13F+2 0.00307 0.00012 0.00069 -0.00218 0.00218
128 13F-2 0.00736 0.00000 0.00000 0.00000 0.00000
129 13F+3 -0.00330 -0.00044 0.00242 0.00070 -0.00556
130 13F-3 0.00659 0.00121 0.00214 0.00556 -0.00070
131 14F 0 -0.00739 -0.07322 0.01246 -0.06072 -0.06072
132 14F+1 0.02909 -0.09457 0.01345 -0.13749 -0.10113
133 14F-1 0.04287 -0.09369 0.01859 -0.10113 -0.13749
134 14F+2 -0.04850 -0.01783 -0.10474 -0.08089 0.08089
135 14F-2 0.05220 0.00000 0.00000 0.00000 0.00000
136 14F+3 -0.03755 -0.04060 -0.07767 -0.10650 -0.00154
137 14F-3 -0.02386 0.01262 -0.08673 0.00154 0.10650
138 15G 0 0.00219 -0.00254 0.00043 -0.00494 -0.00494
139 15G+1 -0.00081 0.00540 -0.00173 0.00267 0.00461
140 15G-1 0.00028 0.00566 -0.00015 0.00461 0.00267
141 15G+2 0.00141 0.00067 0.00393 0.00442 -0.00442
142 15G-2 -0.00318 0.00589 -0.00100 0.00742 0.00742
143 15G+3 0.00370 0.00204 0.00557 0.00692 -0.00174
144 15G-3 -0.00073 -0.00008 0.00593 0.00174 -0.00692
145 15G+4 0.00079 0.00300 -0.00051 0.00585 0.00585
146 15G-4 0.00206 0.00094 0.00554 0.00005 -0.00005
147 3 H 1S 0.03234 0.00000 0.00000 0.00000 0.00000
148 2S -0.29869 0.00000 0.00000 0.00000 0.00000
149 3S 6.12499 0.00000 0.00000 0.00000 0.00000
150 4S 18.72948 0.00000 0.00000 0.00000 0.00000
151 5S -0.55876 0.00000 0.00000 0.00000 0.00000
152 6PX -0.00045 0.00587 -0.01584 0.00000 0.00762
153 6PY -0.01177 0.01078 0.01300 0.00762 0.00000
154 6PZ 0.01177 0.01665 -0.00283 0.00762 0.00762
155 7PX -0.00524 -0.01621 0.04372 0.00000 -0.08417
156 7PY 0.04051 -0.02976 -0.03590 -0.08417 0.00000
157 7PZ -0.04051 -0.04597 0.00782 -0.08417 -0.08417
158 8PX 1.04242 -0.01329 0.03585 0.00000 0.85670
159 8PY 0.96528 -0.02440 -0.02943 0.85670 0.00000
160 8PZ -0.96528 -0.03769 0.00641 0.85670 0.85670
161 9PX 2.84035 0.10680 -0.28808 0.00000 1.41181
162 9PY 4.36051 0.19608 0.23653 1.41181 0.00000
163 9PZ -4.36051 0.30288 -0.05155 1.41181 1.41181
164 10D 0 -0.00302 -0.01910 0.00325 0.01254 0.01254
165 10D+1 0.00947 0.00932 0.01124 -0.00686 0.00000
166 10D-1 0.01457 0.00508 -0.01369 0.00000 -0.00686
167 10D+2 0.00522 -0.00325 -0.01910 0.00724 -0.00724
168 10D-2 -0.00947 0.01440 -0.00245 -0.00686 -0.00686
169 11D 0 0.01857 0.12530 -0.02132 -0.08633 -0.08633
170 11D+1 -0.11904 -0.05547 -0.06692 0.06426 0.00000
171 11D-1 -0.14838 -0.03021 0.08150 0.00000 0.06426
172 11D+2 -0.03216 0.02132 0.12530 -0.04985 0.04985
173 11D-2 0.11904 -0.08569 0.01458 0.06426 0.06426
174 12D 0 0.08744 0.21553 -0.03668 -0.87815 -0.87815
175 12D+1 -0.28832 0.00540 0.00652 0.48551 0.00000
176 12D-1 -0.39608 0.00294 -0.00794 0.00000 0.48551
177 12D+2 -0.15145 0.03668 0.21553 -0.50700 0.50700
178 12D-2 0.28832 0.00835 -0.00142 0.48551 0.48551
179 13F 0 0.00596 0.00302 -0.00051 -0.00534 -0.00534
180 13F+1 0.00255 -0.00117 0.00156 0.00090 0.00155
181 13F-1 0.00122 -0.00162 -0.00109 0.00155 0.00090
182 13F+2 -0.00307 0.00012 0.00069 0.00218 -0.00218
183 13F-2 -0.00736 0.00000 0.00000 0.00000 0.00000
184 13F+3 -0.00330 0.00044 -0.00242 0.00070 -0.00556
185 13F-3 0.00659 -0.00121 -0.00214 0.00556 -0.00070
186 14F 0 0.00739 -0.07322 0.01246 0.06072 0.06072
187 14F+1 0.02909 0.09457 -0.01345 -0.13749 -0.10113
188 14F-1 0.04287 0.09369 -0.01859 -0.10113 -0.13749
189 14F+2 0.04850 -0.01783 -0.10474 0.08089 -0.08089
190 14F-2 -0.05220 0.00000 0.00000 0.00000 0.00000
191 14F+3 -0.03755 0.04060 0.07767 -0.10650 -0.00154
192 14F-3 -0.02386 -0.01262 0.08673 0.00154 0.10650
193 15G 0 -0.00219 -0.00254 0.00043 0.00494 0.00494
194 15G+1 -0.00081 -0.00540 0.00173 0.00267 0.00461
195 15G-1 0.00028 -0.00566 0.00015 0.00461 0.00267
196 15G+2 -0.00141 0.00067 0.00393 -0.00442 0.00442
197 15G-2 0.00318 0.00589 -0.00100 -0.00742 -0.00742
198 15G+3 0.00370 -0.00204 -0.00557 0.00692 -0.00174
199 15G-3 -0.00073 0.00008 -0.00593 0.00174 -0.00692
200 15G+4 -0.00079 0.00300 -0.00051 -0.00585 -0.00585
201 15G-4 -0.00206 0.00094 0.00554 -0.00005 0.00005
202 4 H 1S -0.03234 0.00000 0.00000 0.00000 0.00000
203 2S 0.29869 0.00000 0.00000 0.00000 0.00000
204 3S -6.12499 0.00000 0.00000 0.00000 0.00000
205 4S -18.72948 0.00000 0.00000 0.00000 0.00000
206 5S 0.55876 0.00000 0.00000 0.00000 0.00000
207 6PX -0.00045 -0.00587 0.01584 0.00000 -0.00762
208 6PY 0.01177 0.01078 0.01300 -0.00762 0.00000
209 6PZ 0.01177 -0.01665 0.00283 0.00762 -0.00762
210 7PX -0.00524 0.01621 -0.04372 0.00000 0.08417
211 7PY -0.04051 -0.02976 -0.03590 0.08417 0.00000
212 7PZ -0.04051 0.04597 -0.00782 -0.08417 0.08417
213 8PX 1.04242 0.01329 -0.03585 0.00000 -0.85670
214 8PY -0.96528 -0.02440 -0.02943 -0.85670 0.00000
215 8PZ -0.96528 0.03769 -0.00641 0.85670 -0.85670
216 9PX 2.84035 -0.10680 0.28808 0.00000 -1.41181
217 9PY -4.36051 0.19608 0.23653 -1.41181 0.00000
218 9PZ -4.36051 -0.30288 0.05155 1.41181 -1.41181
219 10D 0 0.00302 -0.01910 0.00325 -0.01254 0.01254
220 10D+1 -0.00947 0.00932 0.01124 0.00686 0.00000
221 10D-1 0.01457 -0.00508 0.01369 0.00000 0.00686
222 10D+2 -0.00522 -0.00325 -0.01910 -0.00724 -0.00724
223 10D-2 -0.00947 -0.01440 0.00245 -0.00686 0.00686
224 11D 0 -0.01857 0.12530 -0.02132 0.08633 -0.08633
225 11D+1 0.11904 -0.05547 -0.06692 -0.06426 0.00000
226 11D-1 -0.14838 0.03021 -0.08150 0.00000 -0.06426
227 11D+2 0.03216 0.02132 0.12530 0.04985 0.04985
228 11D-2 0.11904 0.08569 -0.01458 0.06426 -0.06426
229 12D 0 -0.08744 0.21553 -0.03668 0.87815 -0.87815
230 12D+1 0.28832 0.00540 0.00652 -0.48551 0.00000
231 12D-1 -0.39608 -0.00294 0.00794 0.00000 -0.48551
232 12D+2 0.15145 0.03668 0.21553 0.50700 0.50700
233 12D-2 0.28832 -0.00835 0.00142 0.48551 -0.48551
234 13F 0 0.00596 -0.00302 0.00051 -0.00534 0.00534
235 13F+1 0.00255 0.00117 -0.00156 0.00090 -0.00155
236 13F-1 -0.00122 -0.00162 -0.00109 -0.00155 0.00090
237 13F+2 -0.00307 -0.00012 -0.00069 0.00218 0.00218
238 13F-2 0.00736 0.00000 0.00000 0.00000 0.00000
239 13F+3 -0.00330 -0.00044 0.00242 0.00070 0.00556
240 13F-3 -0.00659 -0.00121 -0.00214 -0.00556 -0.00070
241 14F 0 0.00739 0.07322 -0.01246 0.06072 -0.06072
242 14F+1 0.02909 -0.09457 0.01345 -0.13749 0.10113
243 14F-1 -0.04287 0.09369 -0.01859 0.10113 -0.13749
244 14F+2 0.04850 0.01783 0.10474 0.08089 0.08089
245 14F-2 0.05220 0.00000 0.00000 0.00000 0.00000
246 14F+3 -0.03755 -0.04060 -0.07767 -0.10650 0.00154
247 14F-3 0.02386 -0.01262 0.08673 -0.00154 0.10650
248 15G 0 0.00219 -0.00254 0.00043 -0.00494 0.00494
249 15G+1 0.00081 -0.00540 0.00173 -0.00267 0.00461
250 15G-1 0.00028 0.00566 -0.00015 0.00461 -0.00267
251 15G+2 0.00141 0.00067 0.00393 0.00442 0.00442
252 15G-2 0.00318 -0.00589 0.00100 -0.00742 0.00742
253 15G+3 -0.00370 -0.00204 -0.00557 -0.00692 -0.00174
254 15G-3 -0.00073 -0.00008 0.00593 0.00174 0.00692
255 15G+4 0.00079 0.00300 -0.00051 0.00585 -0.00585
256 15G-4 -0.00206 -0.00094 -0.00554 -0.00005 -0.00005
257 5 H 1S 0.03234 0.00000 0.00000 0.00000 0.00000
258 2S -0.29869 0.00000 0.00000 0.00000 0.00000
259 3S 6.12499 0.00000 0.00000 0.00000 0.00000
260 4S 18.72948 0.00000 0.00000 0.00000 0.00000
261 5S -0.55876 0.00000 0.00000 0.00000 0.00000
262 6PX -0.00045 0.00587 -0.01584 0.00000 -0.00762
263 6PY 0.01177 -0.01078 -0.01300 -0.00762 0.00000
264 6PZ -0.01177 -0.01665 0.00283 -0.00762 0.00762
265 7PX -0.00524 -0.01621 0.04372 0.00000 0.08417
266 7PY -0.04051 0.02976 0.03590 0.08417 0.00000
267 7PZ 0.04051 0.04597 -0.00782 0.08417 -0.08417
268 8PX 1.04242 -0.01329 0.03585 0.00000 -0.85670
269 8PY -0.96528 0.02440 0.02943 -0.85670 0.00000
270 8PZ 0.96528 0.03769 -0.00641 -0.85670 0.85670
271 9PX 2.84035 0.10680 -0.28808 0.00000 -1.41181
272 9PY -4.36051 -0.19608 -0.23653 -1.41181 0.00000
273 9PZ 4.36051 -0.30288 0.05155 -1.41181 1.41181
274 10D 0 -0.00302 -0.01910 0.00325 0.01254 -0.01254
275 10D+1 -0.00947 -0.00932 -0.01124 0.00686 0.00000
276 10D-1 0.01457 0.00508 -0.01369 0.00000 0.00686
277 10D+2 0.00522 -0.00325 -0.01910 0.00724 0.00724
278 10D-2 0.00947 -0.01440 0.00245 0.00686 -0.00686
279 11D 0 0.01857 0.12530 -0.02132 -0.08633 0.08633
280 11D+1 0.11904 0.05547 0.06692 -0.06426 0.00000
281 11D-1 -0.14838 -0.03021 0.08150 0.00000 -0.06426
282 11D+2 -0.03216 0.02132 0.12530 -0.04985 -0.04985
283 11D-2 -0.11904 0.08569 -0.01458 -0.06426 0.06426
284 12D 0 0.08744 0.21553 -0.03668 -0.87815 0.87815
285 12D+1 0.28832 -0.00540 -0.00652 -0.48551 0.00000
286 12D-1 -0.39608 0.00294 -0.00794 0.00000 -0.48551
287 12D+2 -0.15145 0.03668 0.21553 -0.50700 -0.50700
288 12D-2 -0.28832 -0.00835 0.00142 -0.48551 0.48551
289 13F 0 -0.00596 -0.00302 0.00051 0.00534 -0.00534
290 13F+1 0.00255 -0.00117 0.00156 0.00090 -0.00155
291 13F-1 -0.00122 0.00162 0.00109 -0.00155 0.00090
292 13F+2 0.00307 -0.00012 -0.00069 -0.00218 -0.00218
293 13F-2 -0.00736 0.00000 0.00000 0.00000 0.00000
294 13F+3 -0.00330 0.00044 -0.00242 0.00070 0.00556
295 13F-3 -0.00659 0.00121 0.00214 -0.00556 -0.00070
296 14F 0 -0.00739 0.07322 -0.01246 -0.06072 0.06072
297 14F+1 0.02909 0.09457 -0.01345 -0.13749 0.10113
298 14F-1 -0.04287 -0.09369 0.01859 0.10113 -0.13749
299 14F+2 -0.04850 0.01783 0.10474 -0.08089 -0.08089
300 14F-2 -0.05220 0.00000 0.00000 0.00000 0.00000
301 14F+3 -0.03755 0.04060 0.07767 -0.10650 0.00154
302 14F-3 0.02386 0.01262 -0.08673 -0.00154 0.10650
303 15G 0 -0.00219 -0.00254 0.00043 0.00494 -0.00494
304 15G+1 0.00081 0.00540 -0.00173 -0.00267 0.00461
305 15G-1 0.00028 -0.00566 0.00015 0.00461 -0.00267
306 15G+2 -0.00141 0.00067 0.00393 -0.00442 -0.00442
307 15G-2 -0.00318 -0.00589 0.00100 0.00742 -0.00742
308 15G+3 -0.00370 0.00204 0.00557 -0.00692 -0.00174
309 15G-3 -0.00073 0.00008 -0.00593 0.00174 0.00692
310 15G+4 -0.00079 0.00300 -0.00051 -0.00585 0.00585
311 15G-4 0.00206 -0.00094 -0.00554 0.00005 0.00005
46 47 48 49 50
(T1)--V (A1)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 1.47901 1.58476 1.62207 1.62207 1.62207
1 1 C 1S 0.00000 -0.03671 0.00000 0.00000 0.00000
2 2S 0.00000 0.12906 0.00000 0.00000 0.00000
3 3S 0.00000 0.50930 0.00000 0.00000 0.00000
4 4S 0.00000 -5.50019 0.00000 0.00000 0.00000
5 5S 0.00000 9.02092 0.00000 0.00000 0.00000
6 6S 0.00000 -0.19631 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 -0.01666 0.00000
8 7PY 0.00000 0.00000 -0.01666 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.01666
10 8PX 0.00000 0.00000 0.00000 0.36595 0.00000
11 8PY 0.00000 0.00000 0.36595 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.36595
13 9PX 0.00000 0.00000 0.00000 -2.72770 0.00000
14 9PY 0.00000 0.00000 -2.72770 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 -2.72770
16 10PX 0.00000 0.00000 0.00000 0.85391 0.00000
17 10PY 0.00000 0.00000 0.85391 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.85391
19 11PX 0.00000 0.00000 0.00000 -0.04954 0.00000
20 11PY 0.00000 0.00000 -0.04954 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.04954
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00347 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00347 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 0.00347
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.17611 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.17611 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 0.17611
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 -4.56811 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 -4.56811 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 -4.56811
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 -4.43403 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 -4.43403 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 -4.43403
42 16F 0 0.00000 0.00000 0.00000 0.00000 -0.01545
43 16F+1 0.00000 0.00000 0.00000 0.00946 0.00000
44 16F-1 0.00000 0.00000 0.00946 0.00000 0.00000
45 16F+2 -0.05845 0.00000 0.00000 0.00000 0.00000
46 16F-2 0.00000 -0.03276 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.00000 0.00000 -0.01221 0.00000
48 16F-3 0.00000 0.00000 0.01221 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.43382
50 17F+1 0.00000 0.00000 0.00000 -0.26566 0.00000
51 17F-1 0.00000 0.00000 -0.26566 0.00000 0.00000
52 17F+2 0.67942 0.00000 0.00000 0.00000 0.00000
53 17F-2 0.00000 0.13136 0.00000 0.00000 0.00000
54 17F+3 0.00000 0.00000 0.00000 0.34297 0.00000
55 17F-3 0.00000 0.00000 -0.34297 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 3.41413
57 18F+1 0.00000 0.00000 0.00000 -2.09072 0.00000
58 18F-1 0.00000 0.00000 -2.09072 0.00000 0.00000
59 18F+2 3.75206 0.00000 0.00000 0.00000 0.00000
60 18F-2 0.00000 4.51534 0.00000 0.00000 0.00000
61 18F+3 0.00000 0.00000 0.00000 2.69910 0.00000
62 18F-3 0.00000 0.00000 -2.69910 0.00000 0.00000
63 19G 0 0.00000 0.04398 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00353 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00353 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 -0.00999
68 19G+3 0.00000 0.00000 0.00935 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 -0.00935 0.00000
70 19G+4 0.00000 0.03717 0.00000 0.00000 0.00000
71 19G-4 -0.02032 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 -0.42922 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 -0.02214 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.00000 -0.02214 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 0.06262
77 20G+3 0.00000 0.00000 -0.05857 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.05857 0.00000
79 20G+4 0.00000 -0.36276 0.00000 0.00000 0.00000
80 20G-4 0.71799 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 -0.04774
82 21H+1 0.00000 0.00000 0.00000 0.00064 0.00000
83 21H-1 0.00000 0.00000 0.00064 0.00000 0.00000
84 21H+2 -0.01578 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 0.05795 0.00000
87 21H-3 0.00000 0.00000 -0.05795 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.04146
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00000 0.00000 0.00000 -0.02530 0.00000
91 21H-5 0.00000 0.00000 -0.02530 0.00000 0.00000
92 2 H 1S 0.00000 0.00954 -0.01305 -0.01305 -0.01305
93 2S 0.00000 -0.09662 -0.14759 -0.14759 -0.14759
94 3S 0.00000 -5.22238 4.64453 4.64453 4.64453
95 4S 0.00000 1.81565 0.18727 0.18727 0.18727
96 5S 0.00000 -0.21888 0.04149 0.04149 0.04149
97 6PX -0.00762 -0.00587 0.00275 -0.01248 0.00275
98 6PY 0.00762 -0.00587 -0.01248 0.00275 0.00275
99 6PZ 0.00000 -0.00587 0.00275 0.00275 -0.01248
100 7PX 0.08417 0.04403 -0.01315 0.10758 -0.01315
101 7PY -0.08417 0.04403 0.10758 -0.01315 -0.01315
102 7PZ 0.00000 0.04403 -0.01315 -0.01315 0.10758
103 8PX -0.85670 0.46114 -0.67877 -1.61069 -0.67877
104 8PY 0.85670 0.46114 -1.61069 -0.67877 -0.67877
105 8PZ 0.00000 0.46114 -0.67877 -0.67877 -1.61069
106 9PX -1.41181 -0.52005 1.10067 -1.33684 1.10067
107 9PY 1.41181 -0.52005 -1.33684 1.10067 1.10067
108 9PZ 0.00000 -0.52005 1.10067 1.10067 -1.33684
109 10D 0 0.00000 0.00000 -0.00161 -0.00161 0.00322
110 10D+1 -0.00686 -0.00148 0.00235 -0.01491 -0.01491
111 10D-1 0.00686 -0.00148 -0.01491 0.00235 -0.01491
112 10D+2 -0.01448 0.00000 -0.00279 0.00279 0.00000
113 10D-2 0.00000 -0.00148 -0.01491 -0.01491 0.00235
114 11D 0 0.00000 0.00000 -0.00570 -0.00570 0.01140
115 11D+1 0.06426 -0.02870 0.04183 0.12662 0.12662
116 11D-1 -0.06426 -0.02870 0.12662 0.04183 0.12662
117 11D+2 0.09969 0.00000 -0.00987 0.00987 0.00000
118 11D-2 0.00000 -0.02870 0.12662 0.12662 0.04183
119 12D 0 0.00000 0.00000 -0.36881 -0.36881 0.73762
120 12D+1 0.48551 0.22553 -0.32705 0.29439 0.29439
121 12D-1 -0.48551 0.22553 0.29439 -0.32705 0.29439
122 12D+2 1.01400 0.00000 -0.63880 0.63880 0.00000
123 12D-2 0.00000 0.22553 0.29439 0.29439 -0.32705
124 13F 0 0.00000 0.00051 0.00775 0.00775 -0.00090
125 13F+1 -0.00499 -0.00031 -0.00732 0.00055 -0.00217
126 13F-1 0.00499 -0.00031 0.00055 -0.00732 -0.00217
127 13F+2 0.00114 0.00000 -0.00325 0.00325 0.00000
128 13F-2 0.00000 0.00633 -0.00151 -0.00151 -0.00151
129 13F+3 0.00289 0.00041 0.00413 -0.00071 0.00812
130 13F-3 0.00289 -0.00041 0.00071 -0.00413 -0.00812
131 14F 0 0.00000 0.02674 -0.00459 -0.00459 -0.02019
132 14F+1 -0.02677 -0.01638 0.08498 0.01236 -0.07936
133 14F-1 0.02677 -0.01638 0.01236 0.08498 -0.07936
134 14F+2 -0.17391 0.00000 0.10393 -0.10393 0.00000
135 14F-2 0.00000 -0.07003 -0.03347 -0.03347 -0.03347
136 14F+3 -0.09754 0.02114 0.06002 -0.01596 -0.06728
137 14F-3 -0.09754 -0.02114 0.01596 -0.06002 0.06728
138 15G 0 0.00000 -0.00601 0.00255 0.00255 0.00064
139 15G+1 0.00258 -0.00088 -0.00156 -0.00307 0.00478
140 15G-1 -0.00258 -0.00088 -0.00307 -0.00156 0.00478
141 15G+2 0.00884 0.00000 -0.00171 0.00171 0.00000
142 15G-2 0.00000 0.00250 -0.00242 -0.00242 0.00440
143 15G+3 0.00695 -0.00234 -0.00412 0.00374 0.00078
144 15G-3 0.00695 0.00234 -0.00374 0.00412 -0.00078
145 15G+4 0.00000 -0.00508 0.00086 0.00086 0.00312
146 15G-4 0.00493 0.00000 -0.00419 0.00419 0.00000
147 3 H 1S 0.00000 0.00954 0.01305 0.01305 -0.01305
148 2S 0.00000 -0.09662 0.14759 0.14759 -0.14759
149 3S 0.00000 -5.22238 -4.64453 -4.64453 4.64453
150 4S 0.00000 1.81565 -0.18727 -0.18727 0.18727
151 5S 0.00000 -0.21888 -0.04149 -0.04149 0.04149
152 6PX 0.00762 0.00587 0.00275 -0.01248 -0.00275
153 6PY -0.00762 0.00587 -0.01248 0.00275 -0.00275
154 6PZ 0.00000 -0.00587 -0.00275 -0.00275 -0.01248
155 7PX -0.08417 -0.04403 -0.01315 0.10758 0.01315
156 7PY 0.08417 -0.04403 0.10758 -0.01315 0.01315
157 7PZ 0.00000 0.04403 0.01315 0.01315 0.10758
158 8PX 0.85670 -0.46114 -0.67877 -1.61069 0.67877
159 8PY -0.85670 -0.46114 -1.61069 -0.67877 0.67877
160 8PZ 0.00000 0.46114 0.67877 0.67877 -1.61069
161 9PX 1.41181 0.52005 1.10067 -1.33684 -1.10067
162 9PY -1.41181 0.52005 -1.33684 1.10067 -1.10067
163 9PZ 0.00000 -0.52005 -1.10067 -1.10067 -1.33684
164 10D 0 0.00000 0.00000 0.00161 0.00161 0.00322
165 10D+1 0.00686 0.00148 0.00235 -0.01491 0.01491
166 10D-1 -0.00686 0.00148 -0.01491 0.00235 0.01491
167 10D+2 -0.01448 0.00000 0.00279 -0.00279 0.00000
168 10D-2 0.00000 -0.00148 0.01491 0.01491 0.00235
169 11D 0 0.00000 0.00000 0.00570 0.00570 0.01140
170 11D+1 -0.06426 0.02870 0.04183 0.12662 -0.12662
171 11D-1 0.06426 0.02870 0.12662 0.04183 -0.12662
172 11D+2 0.09969 0.00000 0.00987 -0.00987 0.00000
173 11D-2 0.00000 -0.02870 -0.12662 -0.12662 0.04183
174 12D 0 0.00000 0.00000 0.36881 0.36881 0.73762
175 12D+1 -0.48551 -0.22553 -0.32705 0.29439 -0.29439
176 12D-1 0.48551 -0.22553 0.29439 -0.32705 -0.29439
177 12D+2 1.01400 0.00000 0.63880 -0.63880 0.00000
178 12D-2 0.00000 0.22553 -0.29439 -0.29439 -0.32705
179 13F 0 0.00000 0.00051 -0.00775 -0.00775 -0.00090
180 13F+1 0.00499 0.00031 -0.00732 0.00055 0.00217
181 13F-1 -0.00499 0.00031 0.00055 -0.00732 0.00217
182 13F+2 0.00114 0.00000 0.00325 -0.00325 0.00000
183 13F-2 0.00000 0.00633 0.00151 0.00151 -0.00151
184 13F+3 -0.00289 -0.00041 0.00413 -0.00071 -0.00812
185 13F-3 -0.00289 0.00041 0.00071 -0.00413 0.00812
186 14F 0 0.00000 0.02674 0.00459 0.00459 -0.02019
187 14F+1 0.02677 0.01638 0.08498 0.01236 0.07936
188 14F-1 -0.02677 0.01638 0.01236 0.08498 0.07936
189 14F+2 -0.17391 0.00000 -0.10393 0.10393 0.00000
190 14F-2 0.00000 -0.07003 0.03347 0.03347 -0.03347
191 14F+3 0.09754 -0.02114 0.06002 -0.01596 0.06728
192 14F-3 0.09754 0.02114 0.01596 -0.06002 -0.06728
193 15G 0 0.00000 -0.00601 -0.00255 -0.00255 0.00064
194 15G+1 -0.00258 0.00088 -0.00156 -0.00307 -0.00478
195 15G-1 0.00258 0.00088 -0.00307 -0.00156 -0.00478
196 15G+2 0.00884 0.00000 0.00171 -0.00171 0.00000
197 15G-2 0.00000 0.00250 0.00242 0.00242 0.00440
198 15G+3 -0.00695 0.00234 -0.00412 0.00374 -0.00078
199 15G-3 -0.00695 -0.00234 -0.00374 0.00412 0.00078
200 15G+4 0.00000 -0.00508 -0.00086 -0.00086 0.00312
201 15G-4 0.00493 0.00000 0.00419 -0.00419 0.00000
202 4 H 1S 0.00000 0.00954 0.01305 -0.01305 0.01305
203 2S 0.00000 -0.09662 0.14759 -0.14759 0.14759
204 3S 0.00000 -5.22238 -4.64453 4.64453 -4.64453
205 4S 0.00000 1.81565 -0.18727 0.18727 -0.18727
206 5S 0.00000 -0.21888 -0.04149 0.04149 -0.04149
207 6PX 0.00762 -0.00587 -0.00275 -0.01248 -0.00275
208 6PY 0.00762 0.00587 -0.01248 -0.00275 0.00275
209 6PZ 0.00000 0.00587 0.00275 -0.00275 -0.01248
210 7PX -0.08417 0.04403 0.01315 0.10758 0.01315
211 7PY -0.08417 -0.04403 0.10758 0.01315 -0.01315
212 7PZ 0.00000 -0.04403 -0.01315 0.01315 0.10758
213 8PX 0.85670 0.46114 0.67877 -1.61069 0.67877
214 8PY 0.85670 -0.46114 -1.61069 0.67877 -0.67877
215 8PZ 0.00000 -0.46114 -0.67877 0.67877 -1.61069
216 9PX 1.41181 -0.52005 -1.10067 -1.33684 -1.10067
217 9PY 1.41181 0.52005 -1.33684 -1.10067 1.10067
218 9PZ 0.00000 0.52005 1.10067 -1.10067 -1.33684
219 10D 0 0.00000 0.00000 0.00161 -0.00161 -0.00322
220 10D+1 -0.00686 0.00148 0.00235 0.01491 -0.01491
221 10D-1 -0.00686 -0.00148 0.01491 0.00235 0.01491
222 10D+2 0.01448 0.00000 0.00279 0.00279 0.00000
223 10D-2 0.00000 0.00148 -0.01491 0.01491 0.00235
224 11D 0 0.00000 0.00000 0.00570 -0.00570 -0.01140
225 11D+1 0.06426 0.02870 0.04183 -0.12662 0.12662
226 11D-1 0.06426 -0.02870 -0.12662 0.04183 -0.12662
227 11D+2 -0.09969 0.00000 0.00987 0.00987 0.00000
228 11D-2 0.00000 0.02870 0.12662 -0.12662 0.04183
229 12D 0 0.00000 0.00000 0.36881 -0.36881 -0.73762
230 12D+1 0.48551 -0.22553 -0.32705 -0.29439 0.29439
231 12D-1 0.48551 0.22553 -0.29439 -0.32705 -0.29439
232 12D+2 -1.01400 0.00000 0.63880 0.63880 0.00000
233 12D-2 0.00000 -0.22553 0.29439 -0.29439 -0.32705
234 13F 0 0.00000 -0.00051 0.00775 -0.00775 -0.00090
235 13F+1 0.00499 -0.00031 0.00732 0.00055 0.00217
236 13F-1 0.00499 0.00031 0.00055 0.00732 -0.00217
237 13F+2 0.00114 0.00000 -0.00325 -0.00325 0.00000
238 13F-2 0.00000 0.00633 0.00151 -0.00151 0.00151
239 13F+3 -0.00289 0.00041 -0.00413 -0.00071 -0.00812
240 13F-3 0.00289 0.00041 0.00071 0.00413 -0.00812
241 14F 0 0.00000 -0.02674 -0.00459 0.00459 -0.02019
242 14F+1 0.02677 -0.01638 -0.08498 0.01236 0.07936
243 14F-1 0.02677 0.01638 0.01236 -0.08498 -0.07936
244 14F+2 -0.17391 0.00000 0.10393 0.10393 0.00000
245 14F-2 0.00000 -0.07003 0.03347 -0.03347 0.03347
246 14F+3 0.09754 0.02114 -0.06002 -0.01596 0.06728
247 14F-3 -0.09754 0.02114 0.01596 0.06002 0.06728
248 15G 0 0.00000 -0.00601 -0.00255 0.00255 -0.00064
249 15G+1 0.00258 0.00088 -0.00156 0.00307 0.00478
250 15G-1 0.00258 -0.00088 0.00307 -0.00156 -0.00478
251 15G+2 -0.00884 0.00000 0.00171 0.00171 0.00000
252 15G-2 0.00000 -0.00250 -0.00242 0.00242 0.00440
253 15G+3 0.00695 0.00234 -0.00412 -0.00374 0.00078
254 15G-3 -0.00695 0.00234 0.00374 0.00412 0.00078
255 15G+4 0.00000 -0.00508 -0.00086 0.00086 -0.00312
256 15G-4 0.00493 0.00000 -0.00419 -0.00419 0.00000
257 5 H 1S 0.00000 0.00954 -0.01305 0.01305 0.01305
258 2S 0.00000 -0.09662 -0.14759 0.14759 0.14759
259 3S 0.00000 -5.22238 4.64453 -4.64453 -4.64453
260 4S 0.00000 1.81565 0.18727 -0.18727 -0.18727
261 5S 0.00000 -0.21888 0.04149 -0.04149 -0.04149
262 6PX -0.00762 0.00587 -0.00275 -0.01248 0.00275
263 6PY -0.00762 -0.00587 -0.01248 -0.00275 -0.00275
264 6PZ 0.00000 0.00587 -0.00275 0.00275 -0.01248
265 7PX 0.08417 -0.04403 0.01315 0.10758 -0.01315
266 7PY 0.08417 0.04403 0.10758 0.01315 0.01315
267 7PZ 0.00000 -0.04403 0.01315 -0.01315 0.10758
268 8PX -0.85670 -0.46114 0.67877 -1.61069 -0.67877
269 8PY -0.85670 0.46114 -1.61069 0.67877 0.67877
270 8PZ 0.00000 -0.46114 0.67877 -0.67877 -1.61069
271 9PX -1.41181 0.52005 -1.10067 -1.33684 1.10067
272 9PY -1.41181 -0.52005 -1.33684 -1.10067 -1.10067
273 9PZ 0.00000 0.52005 -1.10067 1.10067 -1.33684
274 10D 0 0.00000 0.00000 -0.00161 0.00161 -0.00322
275 10D+1 0.00686 -0.00148 0.00235 0.01491 0.01491
276 10D-1 0.00686 0.00148 0.01491 0.00235 -0.01491
277 10D+2 0.01448 0.00000 -0.00279 -0.00279 0.00000
278 10D-2 0.00000 0.00148 0.01491 -0.01491 0.00235
279 11D 0 0.00000 0.00000 -0.00570 0.00570 -0.01140
280 11D+1 -0.06426 -0.02870 0.04183 -0.12662 -0.12662
281 11D-1 -0.06426 0.02870 -0.12662 0.04183 0.12662
282 11D+2 -0.09969 0.00000 -0.00987 -0.00987 0.00000
283 11D-2 0.00000 0.02870 -0.12662 0.12662 0.04183
284 12D 0 0.00000 0.00000 -0.36881 0.36881 -0.73762
285 12D+1 -0.48551 0.22553 -0.32705 -0.29439 -0.29439
286 12D-1 -0.48551 -0.22553 -0.29439 -0.32705 0.29439
287 12D+2 -1.01400 0.00000 -0.63880 -0.63880 0.00000
288 12D-2 0.00000 -0.22553 -0.29439 0.29439 -0.32705
289 13F 0 0.00000 -0.00051 -0.00775 0.00775 -0.00090
290 13F+1 -0.00499 0.00031 0.00732 0.00055 -0.00217
291 13F-1 -0.00499 -0.00031 0.00055 0.00732 0.00217
292 13F+2 0.00114 0.00000 0.00325 0.00325 0.00000
293 13F-2 0.00000 0.00633 -0.00151 0.00151 0.00151
294 13F+3 0.00289 -0.00041 -0.00413 -0.00071 0.00812
295 13F-3 -0.00289 -0.00041 0.00071 0.00413 0.00812
296 14F 0 0.00000 -0.02674 0.00459 -0.00459 -0.02019
297 14F+1 -0.02677 0.01638 -0.08498 0.01236 -0.07936
298 14F-1 -0.02677 -0.01638 0.01236 -0.08498 0.07936
299 14F+2 -0.17391 0.00000 -0.10393 -0.10393 0.00000
300 14F-2 0.00000 -0.07003 -0.03347 0.03347 0.03347
301 14F+3 -0.09754 -0.02114 -0.06002 -0.01596 -0.06728
302 14F-3 0.09754 -0.02114 0.01596 0.06002 -0.06728
303 15G 0 0.00000 -0.00601 0.00255 -0.00255 -0.00064
304 15G+1 -0.00258 -0.00088 -0.00156 0.00307 -0.00478
305 15G-1 -0.00258 0.00088 0.00307 -0.00156 0.00478
306 15G+2 -0.00884 0.00000 -0.00171 -0.00171 0.00000
307 15G-2 0.00000 -0.00250 0.00242 -0.00242 0.00440
308 15G+3 -0.00695 -0.00234 -0.00412 -0.00374 -0.00078
309 15G-3 0.00695 -0.00234 0.00374 0.00412 -0.00078
310 15G+4 0.00000 -0.00508 0.00086 -0.00086 -0.00312
311 15G-4 0.00493 0.00000 0.00419 0.00419 0.00000
51 52 53 54 55
(T1)--V (T1)--V (T1)--V (E)--V (E)--V
Eigenvalues -- 1.78243 1.78243 1.78243 1.88171 1.88171
1 1 C 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 0.00000 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 0.01033 -0.00144
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 0.00144 0.01033
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.03369 -0.00470
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 0.00470 0.03369
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 -1.15032 0.16063
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 -0.16063 -1.15032
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 3.11075 -0.43438
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 0.43438 3.11075
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 -0.02105 0.00000 0.00000 0.00000 0.00000
44 16F-1 0.00000 -0.02105 0.00000 0.00000 0.00000
45 16F+2 0.00000 0.00000 -0.02663 0.00000 0.00000
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 -0.01631 0.00000 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.01631 0.00000 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.22756 0.00000 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.22756 0.00000 0.00000 0.00000
52 17F+2 0.00000 0.00000 0.28784 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.17627 0.00000 0.00000 0.00000 0.00000
55 17F-3 0.00000 -0.17627 0.00000 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.63660 0.00000 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.63660 0.00000 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.80524 0.00000 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.49311 0.00000 0.00000 0.00000 0.00000
62 18F-3 0.00000 -0.49311 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 -0.03038 0.00424
64 19G+1 0.00000 0.02456 0.00000 0.00000 0.00000
65 19G-1 0.02456 0.00000 0.00000 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00657 0.04706
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
68 19G+3 0.00000 -0.00928 0.00000 0.00000 0.00000
69 19G-3 0.00928 0.00000 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 0.03594 -0.00502
71 19G-4 0.00000 0.00000 0.02626 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 0.44465 -0.06209
73 20G+1 0.00000 -0.06899 0.00000 0.00000 0.00000
74 20G-1 -0.06899 0.00000 0.00000 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 -0.09619 -0.68884
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
77 20G+3 0.00000 0.02607 0.00000 0.00000 0.00000
78 20G-3 -0.02607 0.00000 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 -0.52611 0.07347
80 20G-4 0.00000 0.00000 -0.07375 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 -0.00400 0.00000 0.00000 0.00000 0.00000
83 21H-1 0.00000 -0.00400 0.00000 0.00000 0.00000
84 21H+2 0.00000 0.00000 0.00604 0.00000 0.00000
85 21H-2 0.00000 0.00000 0.00000 -0.07185 0.01003
86 21H+3 0.00185 0.00000 0.00000 0.00000 0.00000
87 21H-3 0.00000 -0.00185 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 -0.01003 -0.07185
90 21H+5 0.00414 0.00000 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.00414 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 -0.00520 0.00520 -0.00056 0.00139
98 6PY -0.00520 0.00000 -0.00520 -0.00092 -0.00118
99 6PZ 0.00520 0.00520 0.00000 0.00148 -0.00021
100 7PX 0.00000 0.00893 -0.00893 0.00718 -0.01773
101 7PY 0.00893 0.00000 0.00893 0.01176 0.01508
102 7PZ -0.00893 -0.00893 0.00000 -0.01894 0.00265
103 8PX 0.00000 -0.06884 0.06884 -0.16403 0.40496
104 8PY -0.06884 0.00000 -0.06884 -0.26869 -0.34453
105 8PZ 0.06884 0.06884 0.00000 0.43272 -0.06042
106 9PX 0.00000 0.66102 -0.66102 0.36003 -0.88883
107 9PY 0.66102 0.00000 0.66102 0.58974 0.75621
108 9PZ -0.66102 -0.66102 0.00000 -0.94977 0.13262
109 10D 0 0.02909 0.02909 0.00000 -0.01224 0.00171
110 10D+1 -0.01063 0.00000 -0.01063 0.01340 0.01719
111 10D-1 0.00000 -0.01063 0.01063 0.00818 -0.02020
112 10D+2 0.01679 -0.01679 0.03359 -0.00171 -0.01224
113 10D-2 0.01063 0.01063 0.00000 -0.02159 0.00301
114 11D 0 -0.14238 -0.14238 0.00000 -0.00225 0.00031
115 11D+1 0.04166 0.00000 0.04166 -0.07993 -0.10249
116 11D-1 0.00000 0.04166 -0.04166 -0.04880 0.12047
117 11D+2 -0.08220 0.08220 -0.16441 -0.00031 -0.00225
118 11D-2 -0.04166 -0.04166 0.00000 0.12873 -0.01797
119 12D 0 0.84130 0.84130 0.00000 -0.84356 0.11779
120 12D+1 -0.05352 0.00000 -0.05352 0.27431 0.35174
121 12D-1 0.00000 -0.05352 0.05352 0.16746 -0.41343
122 12D+2 0.48573 -0.48573 0.97145 -0.11779 -0.84356
123 12D-2 0.05352 0.05352 0.00000 -0.44177 0.06169
124 13F 0 0.00153 0.00153 0.00000 -0.00187 0.00026
125 13F+1 0.00930 0.00015 -0.00173 0.00460 0.00311
126 13F-1 0.00015 0.00930 0.00173 0.00357 -0.00425
127 13F+2 -0.00100 0.00100 0.01176 0.00095 0.00681
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
129 13F+3 0.00720 -0.00182 0.00060 0.00446 0.00019
130 13F-3 0.00182 -0.00720 0.00060 -0.00424 0.00141
131 14F 0 -0.04292 -0.04292 0.00000 0.13000 -0.01815
132 14F+1 -0.08210 -0.03311 0.01945 0.04925 -0.06678
133 14F-1 -0.03311 -0.08210 -0.01945 0.06566 0.05073
134 14F+2 -0.00864 0.00864 -0.10386 0.00360 0.02577
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
136 14F+3 -0.06360 0.02864 -0.03922 -0.02419 0.10216
137 14F-3 -0.02864 0.06360 -0.03922 0.05125 0.09163
138 15G 0 -0.00013 -0.00013 0.00000 -0.00478 0.00067
139 15G+1 0.00649 0.00510 -0.00403 -0.00800 0.00433
140 15G-1 0.00510 0.00649 0.00403 -0.00888 -0.00197
141 15G+2 0.00012 -0.00012 0.00024 0.00104 0.00741
142 15G-2 0.00347 0.00347 0.00000 -0.00422 0.00059
143 15G+3 0.00126 -0.00193 0.00523 0.00022 -0.00523
144 15G-3 0.00193 -0.00126 0.00523 -0.00165 -0.00497
145 15G+4 0.00016 0.00016 0.00000 0.00566 -0.00079
146 15G-4 0.00562 -0.00562 0.00545 -0.00133 -0.00950
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 -0.00520 -0.00520 0.00056 -0.00139
153 6PY -0.00520 0.00000 0.00520 0.00092 0.00118
154 6PZ -0.00520 -0.00520 0.00000 0.00148 -0.00021
155 7PX 0.00000 0.00893 0.00893 -0.00718 0.01773
156 7PY 0.00893 0.00000 -0.00893 -0.01176 -0.01508
157 7PZ 0.00893 0.00893 0.00000 -0.01894 0.00265
158 8PX 0.00000 -0.06884 -0.06884 0.16403 -0.40496
159 8PY -0.06884 0.00000 0.06884 0.26869 0.34453
160 8PZ -0.06884 -0.06884 0.00000 0.43272 -0.06042
161 9PX 0.00000 0.66102 0.66102 -0.36003 0.88883
162 9PY 0.66102 0.00000 -0.66102 -0.58974 -0.75621
163 9PZ 0.66102 0.66102 0.00000 -0.94977 0.13262
164 10D 0 -0.02909 -0.02909 0.00000 -0.01224 0.00171
165 10D+1 -0.01063 0.00000 0.01063 -0.01340 -0.01719
166 10D-1 0.00000 -0.01063 -0.01063 -0.00818 0.02020
167 10D+2 -0.01679 0.01679 0.03359 -0.00171 -0.01224
168 10D-2 -0.01063 -0.01063 0.00000 -0.02159 0.00301
169 11D 0 0.14238 0.14238 0.00000 -0.00225 0.00031
170 11D+1 0.04166 0.00000 -0.04166 0.07993 0.10249
171 11D-1 0.00000 0.04166 0.04166 0.04880 -0.12047
172 11D+2 0.08220 -0.08220 -0.16441 -0.00031 -0.00225
173 11D-2 0.04166 0.04166 0.00000 0.12873 -0.01797
174 12D 0 -0.84130 -0.84130 0.00000 -0.84356 0.11779
175 12D+1 -0.05352 0.00000 0.05352 -0.27431 -0.35174
176 12D-1 0.00000 -0.05352 -0.05352 -0.16746 0.41343
177 12D+2 -0.48573 0.48573 0.97145 -0.11779 -0.84356
178 12D-2 -0.05352 -0.05352 0.00000 -0.44177 0.06169
179 13F 0 -0.00153 -0.00153 0.00000 -0.00187 0.00026
180 13F+1 0.00930 0.00015 0.00173 -0.00460 -0.00311
181 13F-1 0.00015 0.00930 -0.00173 -0.00357 0.00425
182 13F+2 0.00100 -0.00100 0.01176 0.00095 0.00681
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
184 13F+3 0.00720 -0.00182 -0.00060 -0.00446 -0.00019
185 13F-3 0.00182 -0.00720 -0.00060 0.00424 -0.00141
186 14F 0 0.04292 0.04292 0.00000 0.13000 -0.01815
187 14F+1 -0.08210 -0.03311 -0.01945 -0.04925 0.06678
188 14F-1 -0.03311 -0.08210 0.01945 -0.06566 -0.05073
189 14F+2 0.00864 -0.00864 -0.10386 0.00360 0.02577
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
191 14F+3 -0.06360 0.02864 0.03922 0.02419 -0.10216
192 14F-3 -0.02864 0.06360 0.03922 -0.05125 -0.09163
193 15G 0 0.00013 0.00013 0.00000 -0.00478 0.00067
194 15G+1 0.00649 0.00510 0.00403 0.00800 -0.00433
195 15G-1 0.00510 0.00649 -0.00403 0.00888 0.00197
196 15G+2 -0.00012 0.00012 0.00024 0.00104 0.00741
197 15G-2 -0.00347 -0.00347 0.00000 -0.00422 0.00059
198 15G+3 0.00126 -0.00193 -0.00523 -0.00022 0.00523
199 15G-3 0.00193 -0.00126 -0.00523 0.00165 0.00497
200 15G+4 -0.00016 -0.00016 0.00000 0.00566 -0.00079
201 15G-4 -0.00562 0.00562 0.00545 -0.00133 -0.00950
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 0.00520 -0.00520 -0.00056 0.00139
208 6PY 0.00520 0.00000 -0.00520 0.00092 0.00118
209 6PZ -0.00520 0.00520 0.00000 -0.00148 0.00021
210 7PX 0.00000 -0.00893 0.00893 0.00718 -0.01773
211 7PY -0.00893 0.00000 0.00893 -0.01176 -0.01508
212 7PZ 0.00893 -0.00893 0.00000 0.01894 -0.00265
213 8PX 0.00000 0.06884 -0.06884 -0.16403 0.40496
214 8PY 0.06884 0.00000 -0.06884 0.26869 0.34453
215 8PZ -0.06884 0.06884 0.00000 -0.43272 0.06042
216 9PX 0.00000 -0.66102 0.66102 0.36003 -0.88883
217 9PY -0.66102 0.00000 0.66102 -0.58974 -0.75621
218 9PZ 0.66102 -0.66102 0.00000 0.94977 -0.13262
219 10D 0 0.02909 -0.02909 0.00000 -0.01224 0.00171
220 10D+1 0.01063 0.00000 -0.01063 -0.01340 -0.01719
221 10D-1 0.00000 0.01063 -0.01063 0.00818 -0.02020
222 10D+2 0.01679 0.01679 -0.03359 -0.00171 -0.01224
223 10D-2 -0.01063 0.01063 0.00000 0.02159 -0.00301
224 11D 0 -0.14238 0.14238 0.00000 -0.00225 0.00031
225 11D+1 -0.04166 0.00000 0.04166 0.07993 0.10249
226 11D-1 0.00000 -0.04166 0.04166 -0.04880 0.12047
227 11D+2 -0.08220 -0.08220 0.16441 -0.00031 -0.00225
228 11D-2 0.04166 -0.04166 0.00000 -0.12873 0.01797
229 12D 0 0.84130 -0.84130 0.00000 -0.84356 0.11779
230 12D+1 0.05352 0.00000 -0.05352 -0.27431 -0.35174
231 12D-1 0.00000 0.05352 -0.05352 0.16746 -0.41343
232 12D+2 0.48573 0.48573 -0.97145 -0.11779 -0.84356
233 12D-2 -0.05352 0.05352 0.00000 0.44177 -0.06169
234 13F 0 -0.00153 0.00153 0.00000 0.00187 -0.00026
235 13F+1 0.00930 -0.00015 0.00173 0.00460 0.00311
236 13F-1 -0.00015 0.00930 0.00173 -0.00357 0.00425
237 13F+2 0.00100 0.00100 0.01176 -0.00095 -0.00681
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
239 13F+3 0.00720 0.00182 -0.00060 0.00446 0.00019
240 13F-3 -0.00182 -0.00720 0.00060 0.00424 -0.00141
241 14F 0 0.04292 -0.04292 0.00000 -0.13000 0.01815
242 14F+1 -0.08210 0.03311 -0.01945 0.04925 -0.06678
243 14F-1 0.03311 -0.08210 -0.01945 -0.06566 -0.05073
244 14F+2 0.00864 0.00864 -0.10386 -0.00360 -0.02577
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
246 14F+3 -0.06360 -0.02864 0.03922 -0.02419 0.10216
247 14F-3 0.02864 0.06360 -0.03922 -0.05125 -0.09163
248 15G 0 -0.00013 0.00013 0.00000 -0.00478 0.00067
249 15G+1 -0.00649 0.00510 -0.00403 0.00800 -0.00433
250 15G-1 0.00510 -0.00649 -0.00403 -0.00888 -0.00197
251 15G+2 0.00012 0.00012 -0.00024 0.00104 0.00741
252 15G-2 -0.00347 0.00347 0.00000 0.00422 -0.00059
253 15G+3 -0.00126 -0.00193 0.00523 -0.00022 0.00523
254 15G-3 0.00193 0.00126 -0.00523 -0.00165 -0.00497
255 15G+4 0.00016 -0.00016 0.00000 0.00566 -0.00079
256 15G-4 -0.00562 -0.00562 0.00545 0.00133 0.00950
257 5 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
258 2S 0.00000 0.00000 0.00000 0.00000 0.00000
259 3S 0.00000 0.00000 0.00000 0.00000 0.00000
260 4S 0.00000 0.00000 0.00000 0.00000 0.00000
261 5S 0.00000 0.00000 0.00000 0.00000 0.00000
262 6PX 0.00000 0.00520 0.00520 0.00056 -0.00139
263 6PY 0.00520 0.00000 0.00520 -0.00092 -0.00118
264 6PZ 0.00520 -0.00520 0.00000 -0.00148 0.00021
265 7PX 0.00000 -0.00893 -0.00893 -0.00718 0.01773
266 7PY -0.00893 0.00000 -0.00893 0.01176 0.01508
267 7PZ -0.00893 0.00893 0.00000 0.01894 -0.00265
268 8PX 0.00000 0.06884 0.06884 0.16403 -0.40496
269 8PY 0.06884 0.00000 0.06884 -0.26869 -0.34453
270 8PZ 0.06884 -0.06884 0.00000 -0.43272 0.06042
271 9PX 0.00000 -0.66102 -0.66102 -0.36003 0.88883
272 9PY -0.66102 0.00000 -0.66102 0.58974 0.75621
273 9PZ -0.66102 0.66102 0.00000 0.94977 -0.13262
274 10D 0 -0.02909 0.02909 0.00000 -0.01224 0.00171
275 10D+1 0.01063 0.00000 0.01063 0.01340 0.01719
276 10D-1 0.00000 0.01063 0.01063 -0.00818 0.02020
277 10D+2 -0.01679 -0.01679 -0.03359 -0.00171 -0.01224
278 10D-2 0.01063 -0.01063 0.00000 0.02159 -0.00301
279 11D 0 0.14238 -0.14238 0.00000 -0.00225 0.00031
280 11D+1 -0.04166 0.00000 -0.04166 -0.07993 -0.10249
281 11D-1 0.00000 -0.04166 -0.04166 0.04880 -0.12047
282 11D+2 0.08220 0.08220 0.16441 -0.00031 -0.00225
283 11D-2 -0.04166 0.04166 0.00000 -0.12873 0.01797
284 12D 0 -0.84130 0.84130 0.00000 -0.84356 0.11779
285 12D+1 0.05352 0.00000 0.05352 0.27431 0.35174
286 12D-1 0.00000 0.05352 0.05352 -0.16746 0.41343
287 12D+2 -0.48573 -0.48573 -0.97145 -0.11779 -0.84356
288 12D-2 0.05352 -0.05352 0.00000 0.44177 -0.06169
289 13F 0 0.00153 -0.00153 0.00000 0.00187 -0.00026
290 13F+1 0.00930 -0.00015 -0.00173 -0.00460 -0.00311
291 13F-1 -0.00015 0.00930 -0.00173 0.00357 -0.00425
292 13F+2 -0.00100 -0.00100 0.01176 -0.00095 -0.00681
293 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
294 13F+3 0.00720 0.00182 0.00060 -0.00446 -0.00019
295 13F-3 -0.00182 -0.00720 -0.00060 -0.00424 0.00141
296 14F 0 -0.04292 0.04292 0.00000 -0.13000 0.01815
297 14F+1 -0.08210 0.03311 0.01945 -0.04925 0.06678
298 14F-1 0.03311 -0.08210 0.01945 0.06566 0.05073
299 14F+2 -0.00864 -0.00864 -0.10386 -0.00360 -0.02577
300 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
301 14F+3 -0.06360 -0.02864 -0.03922 0.02419 -0.10216
302 14F-3 0.02864 0.06360 0.03922 0.05125 0.09163
303 15G 0 0.00013 -0.00013 0.00000 -0.00478 0.00067
304 15G+1 -0.00649 0.00510 0.00403 -0.00800 0.00433
305 15G-1 0.00510 -0.00649 0.00403 0.00888 0.00197
306 15G+2 -0.00012 -0.00012 -0.00024 0.00104 0.00741
307 15G-2 0.00347 -0.00347 0.00000 0.00422 -0.00059
308 15G+3 -0.00126 -0.00193 -0.00523 0.00022 -0.00523
309 15G-3 0.00193 0.00126 0.00523 0.00165 0.00497
310 15G+4 -0.00016 0.00016 0.00000 0.00566 -0.00079
311 15G-4 0.00562 0.00562 0.00545 0.00133 0.00950
56 57 58 59 60
(T2)--V (T2)--V (T2)--V (A1)--V (E)--V
Eigenvalues -- 1.90418 1.90418 1.90418 2.08268 2.08593
1 1 C 1S 0.00000 0.00000 0.00000 0.05391 0.00000
2 2S 0.00000 0.00000 0.00000 -0.32656 0.00000
3 3S 0.00000 0.00000 0.00000 -0.96463 0.00000
4 4S 0.00000 0.00000 0.00000 -6.46198 0.00000
5 5S 0.00000 0.00000 0.00000 67.14189 0.00000
6 6S 0.00000 0.00000 0.00000 23.08612 0.00000
7 7PX 0.00000 0.00000 0.03388 0.00000 0.00000
8 7PY 0.00000 0.03388 0.00000 0.00000 0.00000
9 7PZ 0.03388 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 -0.42466 0.00000 0.00000
11 8PY 0.00000 -0.42466 0.00000 0.00000 0.00000
12 8PZ -0.42466 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 7.71354 0.00000 0.00000
14 9PY 0.00000 7.71354 0.00000 0.00000 0.00000
15 9PZ 7.71354 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 12.42682 0.00000 0.00000
17 10PY 0.00000 12.42682 0.00000 0.00000 0.00000
18 10PZ 12.42682 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 -1.20873 0.00000 0.00000
20 11PY 0.00000 -1.20873 0.00000 0.00000 0.00000
21 11PZ -1.20873 0.00000 0.00000 0.00000 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00462
23 12D+1 0.00000 -0.00463 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 -0.00463 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00015
26 12D-2 -0.00463 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.30422
28 13D+1 0.00000 -0.09751 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 -0.09751 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 -0.00963
31 13D-2 -0.09751 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 6.66694
33 14D+1 0.00000 8.45062 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 8.45062 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.21104
36 14D-2 8.45062 0.00000 0.00000 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 7.73497
38 15D+1 0.00000 4.38788 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.00000 4.38788 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.24485
41 15D-2 4.38788 0.00000 0.00000 0.00000 0.00000
42 16F 0 0.09244 0.00000 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 -0.05661 0.00000 0.00000
44 16F-1 0.00000 -0.05661 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 -0.08529 0.00000
47 16F+3 0.00000 0.00000 0.07308 0.00000 0.00000
48 16F-3 0.00000 -0.07308 0.00000 0.00000 0.00000
49 17F 0 -1.05644 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.64694 0.00000 0.00000
51 17F-1 0.00000 0.64694 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 1.63589 0.00000
54 17F+3 0.00000 0.00000 -0.83519 0.00000 0.00000
55 17F-3 0.00000 0.83519 0.00000 0.00000 0.00000
56 18F 0 -2.73436 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 1.67445 0.00000 0.00000
58 18F-1 0.00000 1.67445 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 3.84444 0.00000
61 18F+3 0.00000 0.00000 -2.16170 0.00000 0.00000
62 18F-3 0.00000 2.16170 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 -0.02953 -0.01815
64 19G+1 0.00000 -0.00253 0.00000 0.00000 0.00000
65 19G-1 0.00000 0.00000 -0.00253 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00089
67 19G-2 0.00715 0.00000 0.00000 0.00000 0.00000
68 19G+3 0.00000 -0.00669 0.00000 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00669 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 -0.02496 0.02147
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 -0.45598 -0.28486
73 20G+1 0.00000 -0.04347 0.00000 0.00000 0.00000
74 20G-1 0.00000 0.00000 -0.04347 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.01397
76 20G-2 0.12294 0.00000 0.00000 0.00000 0.00000
77 20G+3 0.00000 -0.11500 0.00000 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.11500 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 -0.38538 0.33705
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.04372 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 -0.03161 0.00000 0.00000
83 21H-1 0.00000 -0.03161 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 0.16691
86 21H+3 0.00000 0.00000 -0.09615 0.00000 0.00000
87 21H-3 0.00000 0.09615 0.00000 0.00000 0.00000
88 21H+4 -0.09212 0.00000 0.00000 0.00000 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00528
90 21H+5 0.00000 0.00000 0.01246 0.00000 0.00000
91 21H-5 0.00000 0.01246 0.00000 0.00000 0.00000
92 2 H 1S -0.00845 -0.00845 -0.00845 -0.01730 0.00000
93 2S 0.35716 0.35716 0.35716 0.57488 0.00000
94 3S -7.37077 -7.37077 -7.37077 -9.91759 0.00000
95 4S -9.83481 -9.83481 -9.83481 -14.76801 0.00000
96 5S 0.98621 0.98621 0.98621 -0.88233 0.00000
97 6PX -0.00189 -0.00189 -0.01050 0.00442 0.00384
98 6PY -0.00189 -0.01050 -0.00189 0.00442 0.00429
99 6PZ -0.01050 -0.00189 -0.00189 0.00442 -0.00813
100 7PX -0.00358 -0.00358 -0.03215 -0.08216 -0.04987
101 7PY -0.00358 -0.03215 -0.00358 -0.08216 -0.05566
102 7PZ -0.03215 -0.00358 -0.00358 -0.08216 0.10553
103 8PX 1.39422 1.39422 1.83944 2.08010 0.43449
104 8PY 1.39422 1.83944 1.39422 2.08010 0.48489
105 8PZ 1.83944 1.39422 1.39422 2.08010 -0.91938
106 9PX 2.11900 2.11900 4.02684 4.02099 1.83383
107 9PY 2.11900 4.02684 2.11900 4.02099 2.04658
108 9PZ 4.02684 2.11900 2.11900 4.02099 -3.88040
109 10D 0 0.01566 -0.00783 -0.00783 0.00000 -0.00710
110 10D+1 0.00552 0.01732 0.00552 0.01164 0.00159
111 10D-1 0.00552 0.00552 0.01732 0.01164 0.00143
112 10D+2 0.00000 -0.01357 0.01357 0.00000 -0.00022
113 10D-2 0.01732 0.00552 0.00552 0.01164 -0.00302
114 11D 0 -0.09481 0.04741 0.04741 0.00000 0.08486
115 11D+1 -0.13034 -0.17515 -0.13034 -0.18026 -0.00093
116 11D-1 -0.13034 -0.13034 -0.17515 -0.18026 -0.00084
117 11D+2 0.00000 0.08211 -0.08211 0.00000 0.00269
118 11D-2 -0.17515 -0.13034 -0.13034 -0.18026 0.00177
119 12D 0 -0.64198 0.32099 0.32099 0.00000 1.84181
120 12D+1 -1.09167 0.14471 -1.09167 -1.00749 0.78083
121 12D-1 -1.09167 -1.09167 0.14471 -1.00749 0.69966
122 12D+2 0.00000 0.55597 -0.55597 0.00000 0.05830
123 12D-2 0.14471 -1.09167 -1.09167 -1.00749 -1.48048
124 13F 0 -0.00404 -0.00379 -0.00379 -0.00759 -0.00163
125 13F+1 -0.00150 0.00614 0.00248 0.00465 0.00662
126 13F-1 -0.00150 0.00248 0.00614 0.00465 0.00631
127 13F+2 0.00000 0.00483 -0.00483 0.00000 0.00032
128 13F-2 0.00510 0.00510 0.00510 0.01341 0.00000
129 13F+3 -0.00596 -0.00004 -0.00320 -0.00600 0.00610
130 13F-3 0.00596 0.00320 0.00004 0.00600 -0.00597
131 14F 0 0.01820 -0.07017 -0.07017 -0.07522 -0.10198
132 14F+1 0.16310 -0.07715 -0.01115 0.04606 -0.27163
133 14F-1 0.16310 -0.01115 -0.07715 0.04606 -0.26637
134 14F+2 0.00000 -0.15195 0.15195 0.00000 -0.01099
135 14F-2 0.10085 0.10085 0.10085 0.16457 0.00000
136 14F+3 0.03757 -0.14853 0.01439 -0.05946 -0.14945
137 14F-3 -0.03757 -0.01439 0.14853 0.05946 0.13829
138 15G 0 0.00588 -0.00064 -0.00064 0.00580 -0.00882
139 15G+1 -0.00654 0.00403 0.00490 0.00314 0.01223
140 15G-1 -0.00654 0.00490 0.00403 0.00314 0.01226
141 15G+2 0.00000 0.00583 -0.00583 0.00000 0.00043
142 15G-2 -0.01140 0.00231 0.00231 -0.00887 0.01598
143 15G+3 0.00000 0.01067 -0.00432 0.00829 0.00439
144 15G-3 0.00000 0.00432 -0.01067 -0.00829 -0.00344
145 15G+4 -0.00384 0.00387 0.00387 0.00490 0.01044
146 15G-4 0.00000 0.00612 -0.00612 0.00000 0.00037
147 3 H 1S -0.00845 0.00845 0.00845 -0.01730 0.00000
148 2S 0.35716 -0.35716 -0.35716 0.57488 0.00000
149 3S -7.37077 7.37077 7.37077 -9.91759 0.00000
150 4S -9.83481 9.83481 9.83481 -14.76801 0.00000
151 5S 0.98621 -0.98621 -0.98621 -0.88233 0.00000
152 6PX 0.00189 -0.00189 -0.01050 -0.00442 -0.00384
153 6PY 0.00189 -0.01050 -0.00189 -0.00442 -0.00429
154 6PZ -0.01050 0.00189 0.00189 0.00442 -0.00813
155 7PX 0.00358 -0.00358 -0.03215 0.08216 0.04987
156 7PY 0.00358 -0.03215 -0.00358 0.08216 0.05566
157 7PZ -0.03215 0.00358 0.00358 -0.08216 0.10553
158 8PX -1.39422 1.39422 1.83944 -2.08010 -0.43449
159 8PY -1.39422 1.83944 1.39422 -2.08010 -0.48489
160 8PZ 1.83944 -1.39422 -1.39422 2.08010 -0.91938
161 9PX -2.11900 2.11900 4.02684 -4.02099 -1.83383
162 9PY -2.11900 4.02684 2.11900 -4.02099 -2.04658
163 9PZ 4.02684 -2.11900 -2.11900 4.02099 -3.88040
164 10D 0 0.01566 0.00783 0.00783 0.00000 -0.00710
165 10D+1 -0.00552 0.01732 0.00552 -0.01164 -0.00159
166 10D-1 -0.00552 0.00552 0.01732 -0.01164 -0.00143
167 10D+2 0.00000 0.01357 -0.01357 0.00000 -0.00022
168 10D-2 0.01732 -0.00552 -0.00552 0.01164 -0.00302
169 11D 0 -0.09481 -0.04741 -0.04741 0.00000 0.08486
170 11D+1 0.13034 -0.17515 -0.13034 0.18026 0.00093
171 11D-1 0.13034 -0.13034 -0.17515 0.18026 0.00084
172 11D+2 0.00000 -0.08211 0.08211 0.00000 0.00269
173 11D-2 -0.17515 0.13034 0.13034 -0.18026 0.00177
174 12D 0 -0.64198 -0.32099 -0.32099 0.00000 1.84181
175 12D+1 1.09167 0.14471 -1.09167 1.00749 -0.78083
176 12D-1 1.09167 -1.09167 0.14471 1.00749 -0.69966
177 12D+2 0.00000 -0.55597 0.55597 0.00000 0.05830
178 12D-2 0.14471 1.09167 1.09167 -1.00749 -1.48048
179 13F 0 -0.00404 0.00379 0.00379 -0.00759 -0.00163
180 13F+1 0.00150 0.00614 0.00248 -0.00465 -0.00662
181 13F-1 0.00150 0.00248 0.00614 -0.00465 -0.00631
182 13F+2 0.00000 -0.00483 0.00483 0.00000 0.00032
183 13F-2 0.00510 -0.00510 -0.00510 0.01341 0.00000
184 13F+3 0.00596 -0.00004 -0.00320 0.00600 -0.00610
185 13F-3 -0.00596 0.00320 0.00004 -0.00600 0.00597
186 14F 0 0.01820 0.07017 0.07017 -0.07522 -0.10198
187 14F+1 -0.16310 -0.07715 -0.01115 -0.04606 0.27163
188 14F-1 -0.16310 -0.01115 -0.07715 -0.04606 0.26637
189 14F+2 0.00000 0.15195 -0.15195 0.00000 -0.01099
190 14F-2 0.10085 -0.10085 -0.10085 0.16457 0.00000
191 14F+3 -0.03757 -0.14853 0.01439 0.05946 0.14945
192 14F-3 0.03757 -0.01439 0.14853 -0.05946 -0.13829
193 15G 0 0.00588 0.00064 0.00064 0.00580 -0.00882
194 15G+1 0.00654 0.00403 0.00490 -0.00314 -0.01223
195 15G-1 0.00654 0.00490 0.00403 -0.00314 -0.01226
196 15G+2 0.00000 -0.00583 0.00583 0.00000 0.00043
197 15G-2 -0.01140 -0.00231 -0.00231 -0.00887 0.01598
198 15G+3 0.00000 0.01067 -0.00432 -0.00829 -0.00439
199 15G-3 0.00000 0.00432 -0.01067 0.00829 0.00344
200 15G+4 -0.00384 -0.00387 -0.00387 0.00490 0.01044
201 15G-4 0.00000 -0.00612 0.00612 0.00000 0.00037
202 4 H 1S 0.00845 0.00845 -0.00845 -0.01730 0.00000
203 2S -0.35716 -0.35716 0.35716 0.57488 0.00000
204 3S 7.37077 7.37077 -7.37077 -9.91759 0.00000
205 4S 9.83481 9.83481 -9.83481 -14.76801 0.00000
206 5S -0.98621 -0.98621 0.98621 -0.88233 0.00000
207 6PX 0.00189 0.00189 -0.01050 0.00442 0.00384
208 6PY -0.00189 -0.01050 0.00189 -0.00442 -0.00429
209 6PZ -0.01050 -0.00189 0.00189 -0.00442 0.00813
210 7PX 0.00358 0.00358 -0.03215 -0.08216 -0.04987
211 7PY -0.00358 -0.03215 0.00358 0.08216 0.05566
212 7PZ -0.03215 -0.00358 0.00358 0.08216 -0.10553
213 8PX -1.39422 -1.39422 1.83944 2.08010 0.43449
214 8PY 1.39422 1.83944 -1.39422 -2.08010 -0.48489
215 8PZ 1.83944 1.39422 -1.39422 -2.08010 0.91938
216 9PX -2.11900 -2.11900 4.02684 4.02099 1.83383
217 9PY 2.11900 4.02684 -2.11900 -4.02099 -2.04658
218 9PZ 4.02684 2.11900 -2.11900 -4.02099 3.88040
219 10D 0 -0.01566 0.00783 -0.00783 0.00000 -0.00710
220 10D+1 0.00552 0.01732 -0.00552 -0.01164 -0.00159
221 10D-1 -0.00552 -0.00552 0.01732 0.01164 0.00143
222 10D+2 0.00000 0.01357 0.01357 0.00000 -0.00022
223 10D-2 0.01732 0.00552 -0.00552 -0.01164 0.00302
224 11D 0 0.09481 -0.04741 0.04741 0.00000 0.08486
225 11D+1 -0.13034 -0.17515 0.13034 0.18026 0.00093
226 11D-1 0.13034 0.13034 -0.17515 -0.18026 -0.00084
227 11D+2 0.00000 -0.08211 -0.08211 0.00000 0.00269
228 11D-2 -0.17515 -0.13034 0.13034 0.18026 -0.00177
229 12D 0 0.64198 -0.32099 0.32099 0.00000 1.84181
230 12D+1 -1.09167 0.14471 1.09167 1.00749 -0.78083
231 12D-1 1.09167 1.09167 0.14471 -1.00749 0.69966
232 12D+2 0.00000 -0.55597 -0.55597 0.00000 0.05830
233 12D-2 0.14471 -1.09167 1.09167 1.00749 1.48048
234 13F 0 -0.00404 -0.00379 0.00379 0.00759 0.00163
235 13F+1 0.00150 -0.00614 0.00248 0.00465 0.00662
236 13F-1 -0.00150 0.00248 -0.00614 -0.00465 -0.00631
237 13F+2 0.00000 0.00483 0.00483 0.00000 -0.00032
238 13F-2 -0.00510 -0.00510 0.00510 0.01341 0.00000
239 13F+3 0.00596 0.00004 -0.00320 -0.00600 0.00610
240 13F-3 0.00596 0.00320 -0.00004 -0.00600 0.00597
241 14F 0 0.01820 -0.07017 0.07017 0.07522 0.10198
242 14F+1 -0.16310 0.07715 -0.01115 0.04606 -0.27163
243 14F-1 0.16310 -0.01115 0.07715 -0.04606 0.26637
244 14F+2 0.00000 -0.15195 -0.15195 0.00000 0.01099
245 14F-2 -0.10085 -0.10085 0.10085 0.16457 0.00000
246 14F+3 -0.03757 0.14853 0.01439 -0.05946 -0.14945
247 14F-3 -0.03757 -0.01439 -0.14853 -0.05946 -0.13829
248 15G 0 -0.00588 0.00064 -0.00064 0.00580 -0.00882
249 15G+1 -0.00654 0.00403 -0.00490 -0.00314 -0.01223
250 15G-1 0.00654 -0.00490 0.00403 0.00314 0.01226
251 15G+2 0.00000 -0.00583 -0.00583 0.00000 0.00043
252 15G-2 -0.01140 0.00231 -0.00231 0.00887 -0.01598
253 15G+3 0.00000 0.01067 0.00432 -0.00829 -0.00439
254 15G-3 0.00000 -0.00432 -0.01067 -0.00829 -0.00344
255 15G+4 0.00384 -0.00387 0.00387 0.00490 0.01044
256 15G-4 0.00000 0.00612 0.00612 0.00000 -0.00037
257 5 H 1S 0.00845 -0.00845 0.00845 -0.01730 0.00000
258 2S -0.35716 0.35716 -0.35716 0.57488 0.00000
259 3S 7.37077 -7.37077 7.37077 -9.91759 0.00000
260 4S 9.83481 -9.83481 9.83481 -14.76801 0.00000
261 5S -0.98621 0.98621 -0.98621 -0.88233 0.00000
262 6PX -0.00189 0.00189 -0.01050 -0.00442 -0.00384
263 6PY 0.00189 -0.01050 0.00189 0.00442 0.00429
264 6PZ -0.01050 0.00189 -0.00189 -0.00442 0.00813
265 7PX -0.00358 0.00358 -0.03215 0.08216 0.04987
266 7PY 0.00358 -0.03215 0.00358 -0.08216 -0.05566
267 7PZ -0.03215 0.00358 -0.00358 0.08216 -0.10553
268 8PX 1.39422 -1.39422 1.83944 -2.08010 -0.43449
269 8PY -1.39422 1.83944 -1.39422 2.08010 0.48489
270 8PZ 1.83944 -1.39422 1.39422 -2.08010 0.91938
271 9PX 2.11900 -2.11900 4.02684 -4.02099 -1.83383
272 9PY -2.11900 4.02684 -2.11900 4.02099 2.04658
273 9PZ 4.02684 -2.11900 2.11900 -4.02099 3.88040
274 10D 0 -0.01566 -0.00783 0.00783 0.00000 -0.00710
275 10D+1 -0.00552 0.01732 -0.00552 0.01164 0.00159
276 10D-1 0.00552 -0.00552 0.01732 -0.01164 -0.00143
277 10D+2 0.00000 -0.01357 -0.01357 0.00000 -0.00022
278 10D-2 0.01732 -0.00552 0.00552 -0.01164 0.00302
279 11D 0 0.09481 0.04741 -0.04741 0.00000 0.08486
280 11D+1 0.13034 -0.17515 0.13034 -0.18026 -0.00093
281 11D-1 -0.13034 0.13034 -0.17515 0.18026 0.00084
282 11D+2 0.00000 0.08211 0.08211 0.00000 0.00269
283 11D-2 -0.17515 0.13034 -0.13034 0.18026 -0.00177
284 12D 0 0.64198 0.32099 -0.32099 0.00000 1.84181
285 12D+1 1.09167 0.14471 1.09167 -1.00749 0.78083
286 12D-1 -1.09167 1.09167 0.14471 1.00749 -0.69966
287 12D+2 0.00000 0.55597 0.55597 0.00000 0.05830
288 12D-2 0.14471 1.09167 -1.09167 1.00749 1.48048
289 13F 0 -0.00404 0.00379 -0.00379 0.00759 0.00163
290 13F+1 -0.00150 -0.00614 0.00248 -0.00465 -0.00662
291 13F-1 0.00150 0.00248 -0.00614 0.00465 0.00631
292 13F+2 0.00000 -0.00483 -0.00483 0.00000 -0.00032
293 13F-2 -0.00510 0.00510 -0.00510 0.01341 0.00000
294 13F+3 -0.00596 0.00004 -0.00320 0.00600 -0.00610
295 13F-3 -0.00596 0.00320 -0.00004 0.00600 -0.00597
296 14F 0 0.01820 0.07017 -0.07017 0.07522 0.10198
297 14F+1 0.16310 0.07715 -0.01115 -0.04606 0.27163
298 14F-1 -0.16310 -0.01115 0.07715 0.04606 -0.26637
299 14F+2 0.00000 0.15195 0.15195 0.00000 0.01099
300 14F-2 -0.10085 0.10085 -0.10085 0.16457 0.00000
301 14F+3 0.03757 0.14853 0.01439 0.05946 0.14945
302 14F-3 0.03757 -0.01439 -0.14853 0.05946 0.13829
303 15G 0 -0.00588 -0.00064 0.00064 0.00580 -0.00882
304 15G+1 0.00654 0.00403 -0.00490 0.00314 0.01223
305 15G-1 -0.00654 -0.00490 0.00403 -0.00314 -0.01226
306 15G+2 0.00000 0.00583 0.00583 0.00000 0.00043
307 15G-2 -0.01140 -0.00231 0.00231 0.00887 -0.01598
308 15G+3 0.00000 0.01067 0.00432 0.00829 0.00439
309 15G-3 0.00000 -0.00432 -0.01067 0.00829 0.00344
310 15G+4 0.00384 0.00387 -0.00387 0.00490 0.01044
311 15G-4 0.00000 -0.00612 -0.00612 0.00000 -0.00037
61 62 63 64 65
(E)--V (T2)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 2.08593 2.10890 2.10890 2.10890 2.18330
1 1 C 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 0.00000 -0.06343 0.00000
8 7PY 0.00000 0.00000 -0.06343 0.00000 0.00000
9 7PZ 0.00000 -0.06343 0.00000 0.00000 0.17809
10 8PX 0.00000 0.00000 0.00000 -0.91286 0.00000
11 8PY 0.00000 0.00000 -0.91286 0.00000 0.00000
12 8PZ 0.00000 -0.91286 0.00000 0.00000 -1.48392
13 9PX 0.00000 0.00000 0.00000 14.35212 0.00000
14 9PY 0.00000 0.00000 14.35212 0.00000 0.00000
15 9PZ 0.00000 14.35212 0.00000 0.00000 14.48482
16 10PX 0.00000 0.00000 0.00000 15.60217 0.00000
17 10PY 0.00000 0.00000 15.60217 0.00000 0.00000
18 10PZ 0.00000 15.60217 0.00000 0.00000 25.47530
19 11PX 0.00000 0.00000 0.00000 0.83885 0.00000
20 11PY 0.00000 0.00000 0.83885 0.00000 0.00000
21 11PZ 0.00000 0.83885 0.00000 0.00000 -0.19770
22 12D 0 -0.00015 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 -0.07177 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 -0.07177 0.00000
25 12D+2 0.00462 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 -0.07177 0.00000 0.00000 -0.00987
27 13D 0 0.00963 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.39624 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.39624 0.00000
30 13D+2 -0.30422 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.39624 0.00000 0.00000 -0.01641
32 14D 0 -0.21104 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 5.22362 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 5.22362 0.00000
35 14D+2 6.66694 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 5.22362 0.00000 0.00000 4.20512
37 15D 0 -0.24485 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 4.24891 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 4.24891 0.00000
40 15D+2 7.73497 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 4.24891 0.00000 0.00000 5.03341
42 16F 0 0.00000 0.01691 0.00000 0.00000 0.00110
43 16F+1 0.00000 0.00000 0.00000 -0.01035 0.00000
44 16F-1 0.00000 0.00000 -0.01035 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 0.01336 0.00000
48 16F-3 0.00000 0.00000 -0.01336 0.00000 0.00000
49 17F 0 0.00000 -0.56236 0.00000 0.00000 -0.26705
50 17F+1 0.00000 0.00000 0.00000 0.34437 0.00000
51 17F-1 0.00000 0.00000 0.34437 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 -0.44458 0.00000
55 17F-3 0.00000 0.00000 0.44458 0.00000 0.00000
56 18F 0 0.00000 -0.10522 0.00000 0.00000 -1.19152
57 18F+1 0.00000 0.00000 0.00000 0.06443 0.00000
58 18F-1 0.00000 0.00000 0.06443 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 -0.08318 0.00000
62 18F-3 0.00000 0.00000 0.08318 0.00000 0.00000
63 19G 0 0.00057 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 -0.01899 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 -0.01899 0.00000
66 19G+2 0.02812 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.05372 0.00000 0.00000 0.03462
68 19G+3 0.00000 0.00000 -0.05025 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.05025 0.00000
70 19G+4 -0.00068 0.00000 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00902 0.00000 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 -0.14835 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.00000 -0.14835 0.00000
75 20G+2 0.44131 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.41959 0.00000 0.00000 1.33483
77 20G+3 0.00000 0.00000 -0.39249 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.39249 0.00000
79 20G+4 -0.01067 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 -0.03471 0.00000 0.00000 -0.09706
82 21H+1 0.00000 0.00000 0.00000 -0.01154 0.00000
83 21H-1 0.00000 0.00000 -0.01154 0.00000 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 21H-2 -0.00528 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.00000 0.00000 0.00000 0.02546 0.00000
87 21H-3 0.00000 0.00000 -0.02546 0.00000 0.00000
88 21H+4 0.00000 0.00919 0.00000 0.00000 -0.06608
89 21H-4 0.16691 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00000 0.00000 0.00000 -0.02254 0.00000
91 21H-5 0.00000 0.00000 -0.02254 0.00000 0.00000
92 2 H 1S 0.00000 -0.03595 -0.03595 -0.03595 -0.00443
93 2S 0.00000 0.61710 0.61710 0.61710 0.25786
94 3S 0.00000 -6.74620 -6.74620 -6.74620 -8.35258
95 4S 0.00000 -13.38659 -13.38659 -13.38659 -12.81950
96 5S 0.00000 0.37282 0.37282 0.37282 1.06411
97 6PX -0.00717 0.01127 0.01127 0.01329 -0.00110
98 6PY 0.00691 0.01127 0.01329 0.01127 -0.00110
99 6PZ 0.00026 0.01329 0.01127 0.01127 -0.01829
100 7PX 0.09306 -0.13672 -0.13672 -0.12647 -0.03128
101 7PY -0.08972 -0.13672 -0.12647 -0.13672 -0.03128
102 7PZ -0.00334 -0.12647 -0.13672 -0.13672 0.09634
103 8PX -0.81076 1.88879 1.88879 1.64207 2.11053
104 8PY 0.78165 1.88879 1.64207 1.88879 2.11053
105 8PZ 0.02910 1.64207 1.88879 1.88879 0.88971
106 9PX -3.42194 3.94897 3.94897 3.53407 3.48574
107 9PY 3.29911 3.94897 3.53407 3.94897 3.48574
108 9PZ 0.12283 3.53407 3.94897 3.94897 0.55689
109 10D 0 0.00022 -0.01883 0.00942 0.00942 0.00338
110 10D+1 0.00257 0.01135 0.00128 0.01135 0.01902
111 10D-1 -0.00266 0.01135 0.01135 0.00128 0.01902
112 10D+2 -0.00710 0.00000 0.01631 -0.01631 0.00000
113 10D-2 0.00010 0.00128 0.01135 0.01135 0.01253
114 11D 0 -0.00269 0.10579 -0.05290 -0.05290 0.02997
115 11D+1 -0.00150 -0.10913 -0.06913 -0.10913 -0.20385
116 11D-1 0.00156 -0.10913 -0.10913 -0.06913 -0.20385
117 11D+2 0.08486 0.00000 -0.09162 0.09162 0.00000
118 11D-2 -0.00006 -0.06913 -0.10913 -0.10913 -0.20888
119 12D 0 -0.05830 0.02317 -0.01159 -0.01159 1.55007
120 12D+1 1.25870 -1.13351 -1.74440 -1.13351 0.12727
121 12D-1 -1.30557 -1.13351 -1.13351 -1.74440 0.12727
122 12D+2 1.84181 0.00000 -0.02007 0.02007 0.00000
123 12D-2 0.04686 -1.74440 -1.13351 -1.13351 -1.22882
124 13F 0 0.00005 -0.00230 -0.00003 -0.00003 -0.00206
125 13F+1 0.00468 0.00288 -0.00284 0.00141 0.00696
126 13F-1 -0.00509 0.00288 0.00141 -0.00284 0.00696
127 13F+2 0.01017 0.00000 -0.00362 0.00362 0.00000
128 13F-2 0.00000 0.00451 0.00451 0.00451 0.01782
129 13F+3 0.00181 0.00219 -0.00224 -0.00181 -0.00407
130 13F-3 0.00219 -0.00219 0.00181 0.00224 0.00407
131 14F 0 0.00323 -0.12220 -0.08550 -0.08550 -0.14657
132 14F+1 -0.07468 -0.00424 0.10895 0.07483 -0.16412
133 14F-1 0.09171 -0.00424 0.07483 0.10895 -0.16412
134 14F+2 -0.34729 0.00000 0.07159 -0.07159 0.00000
135 14F-2 0.00000 0.16794 0.16794 0.16794 0.00877
136 14F+3 -0.17160 -0.11143 -0.02375 -0.09661 -0.10230
137 14F-3 -0.18071 0.11143 0.09661 0.02375 0.10230
138 15G 0 0.00028 0.00541 0.00614 0.00614 -0.00382
139 15G+1 -0.00093 0.00680 0.00183 -0.00029 0.01023
140 15G-1 0.00016 0.00680 -0.00029 0.00183 0.01023
141 15G+2 0.01367 0.00000 -0.00065 0.00065 0.00000
142 15G-2 -0.00051 -0.00518 -0.00922 -0.00922 0.00839
143 15G+3 0.01488 0.00728 0.00485 0.00996 0.00248
144 15G-3 0.01512 -0.00728 -0.00996 -0.00485 -0.00248
145 15G+4 -0.00033 0.00556 0.00469 0.00469 0.01046
146 15G-4 0.01163 0.00000 -0.00379 0.00379 0.00000
147 3 H 1S 0.00000 -0.03595 0.03595 0.03595 -0.00443
148 2S 0.00000 0.61710 -0.61710 -0.61710 0.25786
149 3S 0.00000 -6.74620 6.74620 6.74620 -8.35258
150 4S 0.00000 -13.38659 13.38659 13.38659 -12.81950
151 5S 0.00000 0.37282 -0.37282 -0.37282 1.06411
152 6PX 0.00717 -0.01127 0.01127 0.01329 0.00110
153 6PY -0.00691 -0.01127 0.01329 0.01127 0.00110
154 6PZ 0.00026 0.01329 -0.01127 -0.01127 -0.01829
155 7PX -0.09306 0.13672 -0.13672 -0.12647 0.03128
156 7PY 0.08972 0.13672 -0.12647 -0.13672 0.03128
157 7PZ -0.00334 -0.12647 0.13672 0.13672 0.09634
158 8PX 0.81076 -1.88879 1.88879 1.64207 -2.11053
159 8PY -0.78165 -1.88879 1.64207 1.88879 -2.11053
160 8PZ 0.02910 1.64207 -1.88879 -1.88879 0.88971
161 9PX 3.42194 -3.94897 3.94897 3.53407 -3.48574
162 9PY -3.29911 -3.94897 3.53407 3.94897 -3.48574
163 9PZ 0.12283 3.53407 -3.94897 -3.94897 0.55689
164 10D 0 0.00022 -0.01883 -0.00942 -0.00942 0.00338
165 10D+1 -0.00257 -0.01135 0.00128 0.01135 -0.01902
166 10D-1 0.00266 -0.01135 0.01135 0.00128 -0.01902
167 10D+2 -0.00710 0.00000 -0.01631 0.01631 0.00000
168 10D-2 0.00010 0.00128 -0.01135 -0.01135 0.01253
169 11D 0 -0.00269 0.10579 0.05290 0.05290 0.02997
170 11D+1 0.00150 0.10913 -0.06913 -0.10913 0.20385
171 11D-1 -0.00156 0.10913 -0.10913 -0.06913 0.20385
172 11D+2 0.08486 0.00000 0.09162 -0.09162 0.00000
173 11D-2 -0.00006 -0.06913 0.10913 0.10913 -0.20888
174 12D 0 -0.05830 0.02317 0.01159 0.01159 1.55007
175 12D+1 -1.25870 1.13351 -1.74440 -1.13351 -0.12727
176 12D-1 1.30557 1.13351 -1.13351 -1.74440 -0.12727
177 12D+2 1.84181 0.00000 0.02007 -0.02007 0.00000
178 12D-2 0.04686 -1.74440 1.13351 1.13351 -1.22882
179 13F 0 0.00005 -0.00230 0.00003 0.00003 -0.00206
180 13F+1 -0.00468 -0.00288 -0.00284 0.00141 -0.00696
181 13F-1 0.00509 -0.00288 0.00141 -0.00284 -0.00696
182 13F+2 0.01017 0.00000 0.00362 -0.00362 0.00000
183 13F-2 0.00000 0.00451 -0.00451 -0.00451 0.01782
184 13F+3 -0.00181 -0.00219 -0.00224 -0.00181 0.00407
185 13F-3 -0.00219 0.00219 0.00181 0.00224 -0.00407
186 14F 0 0.00323 -0.12220 0.08550 0.08550 -0.14657
187 14F+1 0.07468 0.00424 0.10895 0.07483 0.16412
188 14F-1 -0.09171 0.00424 0.07483 0.10895 0.16412
189 14F+2 -0.34729 0.00000 -0.07159 0.07159 0.00000
190 14F-2 0.00000 0.16794 -0.16794 -0.16794 0.00877
191 14F+3 0.17160 0.11143 -0.02375 -0.09661 0.10230
192 14F-3 0.18071 -0.11143 0.09661 0.02375 -0.10230
193 15G 0 0.00028 0.00541 -0.00614 -0.00614 -0.00382
194 15G+1 0.00093 -0.00680 0.00183 -0.00029 -0.01023
195 15G-1 -0.00016 -0.00680 -0.00029 0.00183 -0.01023
196 15G+2 0.01367 0.00000 0.00065 -0.00065 0.00000
197 15G-2 -0.00051 -0.00518 0.00922 0.00922 0.00839
198 15G+3 -0.01488 -0.00728 0.00485 0.00996 -0.00248
199 15G-3 -0.01512 0.00728 -0.00996 -0.00485 0.00248
200 15G+4 -0.00033 0.00556 -0.00469 -0.00469 0.01046
201 15G-4 0.01163 0.00000 0.00379 -0.00379 0.00000
202 4 H 1S 0.00000 0.03595 0.03595 -0.03595 0.00443
203 2S 0.00000 -0.61710 -0.61710 0.61710 -0.25786
204 3S 0.00000 6.74620 6.74620 -6.74620 8.35258
205 4S 0.00000 13.38659 13.38659 -13.38659 12.81950
206 5S 0.00000 -0.37282 -0.37282 0.37282 -1.06411
207 6PX -0.00717 -0.01127 -0.01127 0.01329 0.00110
208 6PY -0.00691 0.01127 0.01329 -0.01127 -0.00110
209 6PZ -0.00026 0.01329 0.01127 -0.01127 -0.01829
210 7PX 0.09306 0.13672 0.13672 -0.12647 0.03128
211 7PY 0.08972 -0.13672 -0.12647 0.13672 -0.03128
212 7PZ 0.00334 -0.12647 -0.13672 0.13672 0.09634
213 8PX -0.81076 -1.88879 -1.88879 1.64207 -2.11053
214 8PY -0.78165 1.88879 1.64207 -1.88879 2.11053
215 8PZ -0.02910 1.64207 1.88879 -1.88879 0.88971
216 9PX -3.42194 -3.94897 -3.94897 3.53407 -3.48574
217 9PY -3.29911 3.94897 3.53407 -3.94897 3.48574
218 9PZ -0.12283 3.53407 3.94897 -3.94897 0.55689
219 10D 0 0.00022 0.01883 -0.00942 0.00942 -0.00338
220 10D+1 -0.00257 0.01135 0.00128 -0.01135 0.01902
221 10D-1 -0.00266 -0.01135 -0.01135 0.00128 -0.01902
222 10D+2 -0.00710 0.00000 -0.01631 -0.01631 0.00000
223 10D-2 -0.00010 0.00128 0.01135 -0.01135 0.01253
224 11D 0 -0.00269 -0.10579 0.05290 -0.05290 -0.02997
225 11D+1 0.00150 -0.10913 -0.06913 0.10913 -0.20385
226 11D-1 0.00156 0.10913 0.10913 -0.06913 0.20385
227 11D+2 0.08486 0.00000 0.09162 0.09162 0.00000
228 11D-2 0.00006 -0.06913 -0.10913 0.10913 -0.20888
229 12D 0 -0.05830 -0.02317 0.01159 -0.01159 -1.55007
230 12D+1 -1.25870 -1.13351 -1.74440 1.13351 0.12727
231 12D-1 -1.30557 1.13351 1.13351 -1.74440 -0.12727
232 12D+2 1.84181 0.00000 0.02007 0.02007 0.00000
233 12D-2 -0.04686 -1.74440 -1.13351 1.13351 -1.22882
234 13F 0 -0.00005 -0.00230 -0.00003 0.00003 -0.00206
235 13F+1 0.00468 -0.00288 0.00284 0.00141 -0.00696
236 13F-1 0.00509 0.00288 0.00141 0.00284 0.00696
237 13F+2 -0.01017 0.00000 -0.00362 -0.00362 0.00000
238 13F-2 0.00000 -0.00451 -0.00451 0.00451 -0.01782
239 13F+3 0.00181 -0.00219 0.00224 -0.00181 0.00407
240 13F-3 -0.00219 -0.00219 0.00181 -0.00224 0.00407
241 14F 0 -0.00323 -0.12220 -0.08550 0.08550 -0.14657
242 14F+1 -0.07468 0.00424 -0.10895 0.07483 0.16412
243 14F-1 -0.09171 -0.00424 0.07483 -0.10895 -0.16412
244 14F+2 0.34729 0.00000 0.07159 0.07159 0.00000
245 14F-2 0.00000 -0.16794 -0.16794 0.16794 -0.00877
246 14F+3 -0.17160 0.11143 0.02375 -0.09661 0.10230
247 14F-3 0.18071 0.11143 0.09661 -0.02375 0.10230
248 15G 0 0.00028 -0.00541 -0.00614 0.00614 0.00382
249 15G+1 0.00093 0.00680 0.00183 0.00029 0.01023
250 15G-1 0.00016 -0.00680 0.00029 0.00183 -0.01023
251 15G+2 0.01367 0.00000 0.00065 0.00065 0.00000
252 15G-2 0.00051 -0.00518 -0.00922 0.00922 0.00839
253 15G+3 -0.01488 0.00728 0.00485 -0.00996 0.00248
254 15G-3 0.01512 0.00728 0.00996 -0.00485 0.00248
255 15G+4 -0.00033 -0.00556 -0.00469 0.00469 -0.01046
256 15G-4 -0.01163 0.00000 -0.00379 -0.00379 0.00000
257 5 H 1S 0.00000 0.03595 -0.03595 0.03595 0.00443
258 2S 0.00000 -0.61710 0.61710 -0.61710 -0.25786
259 3S 0.00000 6.74620 -6.74620 6.74620 8.35258
260 4S 0.00000 13.38659 -13.38659 13.38659 12.81950
261 5S 0.00000 -0.37282 0.37282 -0.37282 -1.06411
262 6PX 0.00717 0.01127 -0.01127 0.01329 -0.00110
263 6PY 0.00691 -0.01127 0.01329 -0.01127 0.00110
264 6PZ -0.00026 0.01329 -0.01127 0.01127 -0.01829
265 7PX -0.09306 -0.13672 0.13672 -0.12647 -0.03128
266 7PY -0.08972 0.13672 -0.12647 0.13672 0.03128
267 7PZ 0.00334 -0.12647 0.13672 -0.13672 0.09634
268 8PX 0.81076 1.88879 -1.88879 1.64207 2.11053
269 8PY 0.78165 -1.88879 1.64207 -1.88879 -2.11053
270 8PZ -0.02910 1.64207 -1.88879 1.88879 0.88971
271 9PX 3.42194 3.94897 -3.94897 3.53407 3.48574
272 9PY 3.29911 -3.94897 3.53407 -3.94897 -3.48574
273 9PZ -0.12283 3.53407 -3.94897 3.94897 0.55689
274 10D 0 0.00022 0.01883 0.00942 -0.00942 -0.00338
275 10D+1 0.00257 -0.01135 0.00128 -0.01135 -0.01902
276 10D-1 0.00266 0.01135 -0.01135 0.00128 0.01902
277 10D+2 -0.00710 0.00000 0.01631 0.01631 0.00000
278 10D-2 -0.00010 0.00128 -0.01135 0.01135 0.01253
279 11D 0 -0.00269 -0.10579 -0.05290 0.05290 -0.02997
280 11D+1 -0.00150 0.10913 -0.06913 0.10913 0.20385
281 11D-1 -0.00156 -0.10913 0.10913 -0.06913 -0.20385
282 11D+2 0.08486 0.00000 -0.09162 -0.09162 0.00000
283 11D-2 0.00006 -0.06913 0.10913 -0.10913 -0.20888
284 12D 0 -0.05830 -0.02317 -0.01159 0.01159 -1.55007
285 12D+1 1.25870 1.13351 -1.74440 1.13351 -0.12727
286 12D-1 1.30557 -1.13351 1.13351 -1.74440 0.12727
287 12D+2 1.84181 0.00000 -0.02007 -0.02007 0.00000
288 12D-2 -0.04686 -1.74440 1.13351 -1.13351 -1.22882
289 13F 0 -0.00005 -0.00230 0.00003 -0.00003 -0.00206
290 13F+1 -0.00468 0.00288 0.00284 0.00141 0.00696
291 13F-1 -0.00509 -0.00288 0.00141 0.00284 -0.00696
292 13F+2 -0.01017 0.00000 0.00362 0.00362 0.00000
293 13F-2 0.00000 -0.00451 0.00451 -0.00451 -0.01782
294 13F+3 -0.00181 0.00219 0.00224 -0.00181 -0.00407
295 13F-3 0.00219 0.00219 0.00181 -0.00224 -0.00407
296 14F 0 -0.00323 -0.12220 0.08550 -0.08550 -0.14657
297 14F+1 0.07468 -0.00424 -0.10895 0.07483 -0.16412
298 14F-1 0.09171 0.00424 0.07483 -0.10895 0.16412
299 14F+2 0.34729 0.00000 -0.07159 -0.07159 0.00000
300 14F-2 0.00000 -0.16794 0.16794 -0.16794 -0.00877
301 14F+3 0.17160 -0.11143 0.02375 -0.09661 -0.10230
302 14F-3 -0.18071 -0.11143 0.09661 -0.02375 -0.10230
303 15G 0 0.00028 -0.00541 0.00614 -0.00614 0.00382
304 15G+1 -0.00093 -0.00680 0.00183 0.00029 -0.01023
305 15G-1 -0.00016 0.00680 0.00029 0.00183 0.01023
306 15G+2 0.01367 0.00000 -0.00065 -0.00065 0.00000
307 15G-2 0.00051 -0.00518 0.00922 -0.00922 0.00839
308 15G+3 0.01488 -0.00728 0.00485 -0.00996 -0.00248
309 15G-3 -0.01512 -0.00728 0.00996 -0.00485 -0.00248
310 15G+4 -0.00033 -0.00556 0.00469 -0.00469 -0.01046
311 15G-4 -0.01163 0.00000 0.00379 0.00379 0.00000
66 67 68 69 70
(T2)--V (T2)--V (T1)--V (T1)--V (T1)--V
Eigenvalues -- 2.18330 2.18330 2.38837 2.38837 2.38837
1 1 C 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 0.17809 0.00000 0.00000 0.00000
8 7PY 0.17809 0.00000 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -1.48392 0.00000 0.00000 0.00000
11 8PY -1.48392 0.00000 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 14.48482 0.00000 0.00000 0.00000
14 9PY 14.48482 0.00000 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 25.47530 0.00000 0.00000 0.00000
17 10PY 25.47530 0.00000 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 -0.19770 0.00000 0.00000 0.00000
20 11PY -0.19770 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 -0.00987 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 -0.00987 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 -0.01641 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 -0.01641 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 4.20512 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 4.20512 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 5.03341 0.00000 0.00000 0.00000 0.00000
39 15D-1 0.00000 5.03341 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 -0.00067 0.04455 0.00000 0.00000
44 16F-1 -0.00067 0.00000 0.00000 0.04455 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.05635
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.00087 0.03451 0.00000 0.00000
48 16F-3 -0.00087 0.00000 0.00000 -0.03451 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.16353 -0.36435 0.00000 0.00000
51 17F-1 0.16353 0.00000 0.00000 -0.36435 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 -0.46087
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.00000 -0.21112 -0.28223 0.00000 0.00000
55 17F-3 0.21112 0.00000 0.00000 0.28223 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.72966 1.09290 0.00000 0.00000
58 18F-1 0.72966 0.00000 0.00000 1.09290 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 1.38242
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.00000 -0.94198 0.84655 0.00000 0.00000
62 18F-3 0.94198 0.00000 0.00000 -0.84655 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 -0.01224 0.00000 0.00000 -0.01084 0.00000
65 19G-1 0.00000 -0.01224 -0.01084 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 -0.03238 0.00000 0.00000 0.00410 0.00000
69 19G-3 0.00000 0.03238 -0.00410 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 -0.01159
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
73 20G+1 -0.47193 0.00000 0.00000 0.02555 0.00000
74 20G-1 0.00000 -0.47193 0.02555 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 -1.24862 0.00000 0.00000 -0.00966 0.00000
78 20G-3 0.00000 1.24862 0.00966 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 0.02731
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.00000 -0.08484 0.00705 0.00000 0.00000
83 21H-1 -0.08484 0.00000 0.00000 0.00705 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 -0.01065
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.00000 -0.00181 -0.00326 0.00000 0.00000
87 21H-3 0.00181 0.00000 0.00000 0.00326 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 -0.08115 -0.00729 0.00000 0.00000
91 21H-5 -0.08115 0.00000 0.00000 -0.00729 0.00000
92 2 H 1S -0.00443 -0.00443 0.00000 0.00000 0.00000
93 2S 0.25786 0.25786 0.00000 0.00000 0.00000
94 3S -8.35258 -8.35258 0.00000 0.00000 0.00000
95 4S -12.81950 -12.81950 0.00000 0.00000 0.00000
96 5S 1.06411 1.06411 0.00000 0.00000 0.00000
97 6PX -0.00110 -0.01829 0.00000 0.01254 -0.01254
98 6PY -0.01829 -0.00110 0.01254 0.00000 0.01254
99 6PZ -0.00110 -0.00110 -0.01254 -0.01254 0.00000
100 7PX -0.03128 0.09634 0.00000 -0.06423 0.06423
101 7PY 0.09634 -0.03128 -0.06423 0.00000 -0.06423
102 7PZ -0.03128 -0.03128 0.06423 0.06423 0.00000
103 8PX 2.11053 0.88971 0.00000 0.44513 -0.44513
104 8PY 0.88971 2.11053 0.44513 0.00000 0.44513
105 8PZ 2.11053 2.11053 -0.44513 -0.44513 0.00000
106 9PX 3.48574 0.55689 0.00000 -0.52157 0.52157
107 9PY 0.55689 3.48574 -0.52157 0.00000 -0.52157
108 9PZ 3.48574 3.48574 0.52157 0.52157 0.00000
109 10D 0 -0.00169 -0.00169 -0.00661 -0.00661 0.00000
110 10D+1 0.01253 0.01902 -0.03228 0.00000 -0.03228
111 10D-1 0.01902 0.01253 0.00000 -0.03228 0.03228
112 10D+2 -0.00293 0.00293 -0.00382 0.00382 -0.00763
113 10D-2 0.01902 0.01902 0.03228 0.03228 0.00000
114 11D 0 -0.01499 -0.01499 0.03538 0.03538 0.00000
115 11D+1 -0.20888 -0.20385 0.16308 0.00000 0.16308
116 11D-1 -0.20385 -0.20888 0.00000 0.16308 -0.16308
117 11D+2 -0.02596 0.02596 0.02043 -0.02043 0.04086
118 11D-2 -0.20385 -0.20385 -0.16308 -0.16308 0.00000
119 12D 0 -0.77504 -0.77504 -0.29698 -0.29698 0.00000
120 12D+1 -1.22882 0.12727 -0.76218 0.00000 -0.76218
121 12D-1 0.12727 -1.22882 0.00000 -0.76218 0.76218
122 12D+2 -1.34240 1.34240 -0.17146 0.17146 -0.34292
123 12D-2 0.12727 0.12727 0.76218 0.76218 0.00000
124 13F 0 -0.00748 -0.00748 -0.00217 -0.00217 0.00000
125 13F+1 0.00220 0.00126 -0.00880 -0.00065 0.00201
126 13F-1 0.00126 0.00220 -0.00065 -0.00880 -0.00201
127 13F+2 -0.00301 0.00301 0.00087 -0.00087 -0.01114
128 13F-2 0.01782 0.01782 0.00000 0.00000 0.00000
129 13F+3 -0.00775 -0.00163 -0.00682 0.00225 -0.00119
130 13F-3 0.00163 0.00775 -0.00225 0.00682 -0.00119
131 14F 0 0.01963 0.01963 0.05115 0.05115 0.00000
132 14F+1 0.14008 0.08976 0.09289 0.04791 -0.01474
133 14F-1 0.08976 0.14008 0.04791 0.09289 0.01474
134 14F+2 0.19239 -0.19239 0.02098 -0.02098 0.11749
135 14F-2 0.00877 0.00877 0.00000 0.00000 0.00000
136 14F+3 0.13333 -0.11588 0.07195 -0.02759 0.05329
137 14F-3 0.11588 -0.13333 0.02759 -0.07195 0.05329
138 15G 0 0.00630 0.00630 0.00234 0.00234 0.00000
139 15G+1 -0.00297 -0.00603 -0.00626 -0.00772 0.00197
140 15G-1 -0.00603 -0.00297 -0.00772 -0.00626 -0.00197
141 15G+2 -0.00905 0.00905 -0.00210 0.00210 -0.00419
142 15G-2 -0.00594 -0.00594 -0.00608 -0.00608 0.00000
143 15G+3 -0.00785 0.00863 -0.00413 0.00292 -0.00724
144 15G-3 -0.00863 0.00785 -0.00292 0.00413 -0.00724
145 15G+4 -0.00152 -0.00152 -0.00277 -0.00277 0.00000
146 15G-4 -0.00869 0.00869 -0.00440 0.00440 -0.00826
147 3 H 1S 0.00443 0.00443 0.00000 0.00000 0.00000
148 2S -0.25786 -0.25786 0.00000 0.00000 0.00000
149 3S 8.35258 8.35258 0.00000 0.00000 0.00000
150 4S 12.81950 12.81950 0.00000 0.00000 0.00000
151 5S -1.06411 -1.06411 0.00000 0.00000 0.00000
152 6PX -0.00110 -0.01829 0.00000 0.01254 0.01254
153 6PY -0.01829 -0.00110 0.01254 0.00000 -0.01254
154 6PZ 0.00110 0.00110 0.01254 0.01254 0.00000
155 7PX -0.03128 0.09634 0.00000 -0.06423 -0.06423
156 7PY 0.09634 -0.03128 -0.06423 0.00000 0.06423
157 7PZ 0.03128 0.03128 -0.06423 -0.06423 0.00000
158 8PX 2.11053 0.88971 0.00000 0.44513 0.44513
159 8PY 0.88971 2.11053 0.44513 0.00000 -0.44513
160 8PZ -2.11053 -2.11053 0.44513 0.44513 0.00000
161 9PX 3.48574 0.55689 0.00000 -0.52157 -0.52157
162 9PY 0.55689 3.48574 -0.52157 0.00000 0.52157
163 9PZ -3.48574 -3.48574 -0.52157 -0.52157 0.00000
164 10D 0 0.00169 0.00169 0.00661 0.00661 0.00000
165 10D+1 0.01253 0.01902 -0.03228 0.00000 0.03228
166 10D-1 0.01902 0.01253 0.00000 -0.03228 -0.03228
167 10D+2 0.00293 -0.00293 0.00382 -0.00382 -0.00763
168 10D-2 -0.01902 -0.01902 -0.03228 -0.03228 0.00000
169 11D 0 0.01499 0.01499 -0.03538 -0.03538 0.00000
170 11D+1 -0.20888 -0.20385 0.16308 0.00000 -0.16308
171 11D-1 -0.20385 -0.20888 0.00000 0.16308 0.16308
172 11D+2 0.02596 -0.02596 -0.02043 0.02043 0.04086
173 11D-2 0.20385 0.20385 0.16308 0.16308 0.00000
174 12D 0 0.77504 0.77504 0.29698 0.29698 0.00000
175 12D+1 -1.22882 0.12727 -0.76218 0.00000 0.76218
176 12D-1 0.12727 -1.22882 0.00000 -0.76218 -0.76218
177 12D+2 1.34240 -1.34240 0.17146 -0.17146 -0.34292
178 12D-2 -0.12727 -0.12727 -0.76218 -0.76218 0.00000
179 13F 0 0.00748 0.00748 0.00217 0.00217 0.00000
180 13F+1 0.00220 0.00126 -0.00880 -0.00065 -0.00201
181 13F-1 0.00126 0.00220 -0.00065 -0.00880 0.00201
182 13F+2 0.00301 -0.00301 -0.00087 0.00087 -0.01114
183 13F-2 -0.01782 -0.01782 0.00000 0.00000 0.00000
184 13F+3 -0.00775 -0.00163 -0.00682 0.00225 0.00119
185 13F-3 0.00163 0.00775 -0.00225 0.00682 0.00119
186 14F 0 -0.01963 -0.01963 -0.05115 -0.05115 0.00000
187 14F+1 0.14008 0.08976 0.09289 0.04791 0.01474
188 14F-1 0.08976 0.14008 0.04791 0.09289 -0.01474
189 14F+2 -0.19239 0.19239 -0.02098 0.02098 0.11749
190 14F-2 -0.00877 -0.00877 0.00000 0.00000 0.00000
191 14F+3 0.13333 -0.11588 0.07195 -0.02759 -0.05329
192 14F-3 0.11588 -0.13333 0.02759 -0.07195 -0.05329
193 15G 0 -0.00630 -0.00630 -0.00234 -0.00234 0.00000
194 15G+1 -0.00297 -0.00603 -0.00626 -0.00772 -0.00197
195 15G-1 -0.00603 -0.00297 -0.00772 -0.00626 0.00197
196 15G+2 0.00905 -0.00905 0.00210 -0.00210 -0.00419
197 15G-2 0.00594 0.00594 0.00608 0.00608 0.00000
198 15G+3 -0.00785 0.00863 -0.00413 0.00292 0.00724
199 15G-3 -0.00863 0.00785 -0.00292 0.00413 0.00724
200 15G+4 0.00152 0.00152 0.00277 0.00277 0.00000
201 15G-4 0.00869 -0.00869 0.00440 -0.00440 -0.00826
202 4 H 1S 0.00443 -0.00443 0.00000 0.00000 0.00000
203 2S -0.25786 0.25786 0.00000 0.00000 0.00000
204 3S 8.35258 -8.35258 0.00000 0.00000 0.00000
205 4S 12.81950 -12.81950 0.00000 0.00000 0.00000
206 5S -1.06411 1.06411 0.00000 0.00000 0.00000
207 6PX 0.00110 -0.01829 0.00000 -0.01254 0.01254
208 6PY -0.01829 0.00110 -0.01254 0.00000 0.01254
209 6PZ -0.00110 0.00110 0.01254 -0.01254 0.00000
210 7PX 0.03128 0.09634 0.00000 0.06423 -0.06423
211 7PY 0.09634 0.03128 0.06423 0.00000 -0.06423
212 7PZ -0.03128 0.03128 -0.06423 0.06423 0.00000
213 8PX -2.11053 0.88971 0.00000 -0.44513 0.44513
214 8PY 0.88971 -2.11053 -0.44513 0.00000 0.44513
215 8PZ 2.11053 -2.11053 0.44513 -0.44513 0.00000
216 9PX -3.48574 0.55689 0.00000 0.52157 -0.52157
217 9PY 0.55689 -3.48574 0.52157 0.00000 -0.52157
218 9PZ 3.48574 -3.48574 -0.52157 0.52157 0.00000
219 10D 0 0.00169 -0.00169 -0.00661 0.00661 0.00000
220 10D+1 0.01253 -0.01902 0.03228 0.00000 -0.03228
221 10D-1 -0.01902 0.01253 0.00000 0.03228 -0.03228
222 10D+2 0.00293 0.00293 -0.00382 -0.00382 0.00763
223 10D-2 0.01902 -0.01902 -0.03228 0.03228 0.00000
224 11D 0 0.01499 -0.01499 0.03538 -0.03538 0.00000
225 11D+1 -0.20888 0.20385 -0.16308 0.00000 0.16308
226 11D-1 0.20385 -0.20888 0.00000 -0.16308 0.16308
227 11D+2 0.02596 0.02596 0.02043 0.02043 -0.04086
228 11D-2 -0.20385 0.20385 0.16308 -0.16308 0.00000
229 12D 0 0.77504 -0.77504 -0.29698 0.29698 0.00000
230 12D+1 -1.22882 -0.12727 0.76218 0.00000 -0.76218
231 12D-1 -0.12727 -1.22882 0.00000 0.76218 -0.76218
232 12D+2 1.34240 1.34240 -0.17146 -0.17146 0.34292
233 12D-2 0.12727 -0.12727 -0.76218 0.76218 0.00000
234 13F 0 -0.00748 0.00748 0.00217 -0.00217 0.00000
235 13F+1 -0.00220 0.00126 -0.00880 0.00065 -0.00201
236 13F-1 0.00126 -0.00220 0.00065 -0.00880 -0.00201
237 13F+2 -0.00301 -0.00301 -0.00087 -0.00087 -0.01114
238 13F-2 -0.01782 0.01782 0.00000 0.00000 0.00000
239 13F+3 0.00775 -0.00163 -0.00682 -0.00225 0.00119
240 13F-3 0.00163 -0.00775 0.00225 0.00682 -0.00119
241 14F 0 0.01963 -0.01963 -0.05115 0.05115 0.00000
242 14F+1 -0.14008 0.08976 0.09289 -0.04791 0.01474
243 14F-1 0.08976 -0.14008 -0.04791 0.09289 0.01474
244 14F+2 0.19239 0.19239 -0.02098 -0.02098 0.11749
245 14F-2 -0.00877 0.00877 0.00000 0.00000 0.00000
246 14F+3 -0.13333 -0.11588 0.07195 0.02759 -0.05329
247 14F-3 0.11588 0.13333 -0.02759 -0.07195 0.05329
248 15G 0 -0.00630 0.00630 0.00234 -0.00234 0.00000
249 15G+1 -0.00297 0.00603 0.00626 -0.00772 0.00197
250 15G-1 0.00603 -0.00297 -0.00772 0.00626 0.00197
251 15G+2 0.00905 0.00905 -0.00210 -0.00210 0.00419
252 15G-2 -0.00594 0.00594 0.00608 -0.00608 0.00000
253 15G+3 -0.00785 -0.00863 0.00413 0.00292 -0.00724
254 15G-3 0.00863 0.00785 -0.00292 -0.00413 0.00724
255 15G+4 0.00152 -0.00152 -0.00277 0.00277 0.00000
256 15G-4 -0.00869 -0.00869 0.00440 0.00440 -0.00826
257 5 H 1S -0.00443 0.00443 0.00000 0.00000 0.00000
258 2S 0.25786 -0.25786 0.00000 0.00000 0.00000
259 3S -8.35258 8.35258 0.00000 0.00000 0.00000
260 4S -12.81950 12.81950 0.00000 0.00000 0.00000
261 5S 1.06411 -1.06411 0.00000 0.00000 0.00000
262 6PX 0.00110 -0.01829 0.00000 -0.01254 -0.01254
263 6PY -0.01829 0.00110 -0.01254 0.00000 -0.01254
264 6PZ 0.00110 -0.00110 -0.01254 0.01254 0.00000
265 7PX 0.03128 0.09634 0.00000 0.06423 0.06423
266 7PY 0.09634 0.03128 0.06423 0.00000 0.06423
267 7PZ 0.03128 -0.03128 0.06423 -0.06423 0.00000
268 8PX -2.11053 0.88971 0.00000 -0.44513 -0.44513
269 8PY 0.88971 -2.11053 -0.44513 0.00000 -0.44513
270 8PZ -2.11053 2.11053 -0.44513 0.44513 0.00000
271 9PX -3.48574 0.55689 0.00000 0.52157 0.52157
272 9PY 0.55689 -3.48574 0.52157 0.00000 0.52157
273 9PZ -3.48574 3.48574 0.52157 -0.52157 0.00000
274 10D 0 -0.00169 0.00169 0.00661 -0.00661 0.00000
275 10D+1 0.01253 -0.01902 0.03228 0.00000 0.03228
276 10D-1 -0.01902 0.01253 0.00000 0.03228 0.03228
277 10D+2 -0.00293 -0.00293 0.00382 0.00382 0.00763
278 10D-2 -0.01902 0.01902 0.03228 -0.03228 0.00000
279 11D 0 -0.01499 0.01499 -0.03538 0.03538 0.00000
280 11D+1 -0.20888 0.20385 -0.16308 0.00000 -0.16308
281 11D-1 0.20385 -0.20888 0.00000 -0.16308 -0.16308
282 11D+2 -0.02596 -0.02596 -0.02043 -0.02043 -0.04086
283 11D-2 0.20385 -0.20385 -0.16308 0.16308 0.00000
284 12D 0 -0.77504 0.77504 0.29698 -0.29698 0.00000
285 12D+1 -1.22882 -0.12727 0.76218 0.00000 0.76218
286 12D-1 -0.12727 -1.22882 0.00000 0.76218 0.76218
287 12D+2 -1.34240 -1.34240 0.17146 0.17146 0.34292
288 12D-2 -0.12727 0.12727 0.76218 -0.76218 0.00000
289 13F 0 0.00748 -0.00748 -0.00217 0.00217 0.00000
290 13F+1 -0.00220 0.00126 -0.00880 0.00065 0.00201
291 13F-1 0.00126 -0.00220 0.00065 -0.00880 0.00201
292 13F+2 0.00301 0.00301 0.00087 0.00087 -0.01114
293 13F-2 0.01782 -0.01782 0.00000 0.00000 0.00000
294 13F+3 0.00775 -0.00163 -0.00682 -0.00225 -0.00119
295 13F-3 0.00163 -0.00775 0.00225 0.00682 0.00119
296 14F 0 -0.01963 0.01963 0.05115 -0.05115 0.00000
297 14F+1 -0.14008 0.08976 0.09289 -0.04791 -0.01474
298 14F-1 0.08976 -0.14008 -0.04791 0.09289 -0.01474
299 14F+2 -0.19239 -0.19239 0.02098 0.02098 0.11749
300 14F-2 0.00877 -0.00877 0.00000 0.00000 0.00000
301 14F+3 -0.13333 -0.11588 0.07195 0.02759 0.05329
302 14F-3 0.11588 0.13333 -0.02759 -0.07195 -0.05329
303 15G 0 0.00630 -0.00630 -0.00234 0.00234 0.00000
304 15G+1 -0.00297 0.00603 0.00626 -0.00772 -0.00197
305 15G-1 0.00603 -0.00297 -0.00772 0.00626 -0.00197
306 15G+2 -0.00905 -0.00905 0.00210 0.00210 0.00419
307 15G-2 0.00594 -0.00594 -0.00608 0.00608 0.00000
308 15G+3 -0.00785 -0.00863 0.00413 0.00292 0.00724
309 15G-3 0.00863 0.00785 -0.00292 -0.00413 -0.00724
310 15G+4 -0.00152 0.00152 0.00277 -0.00277 0.00000
311 15G-4 0.00869 0.00869 -0.00440 -0.00440 -0.00826
71 72 73 74 75
(T2)--V (T2)--V (T2)--V (A1)--V (T1)--V
Eigenvalues -- 2.46534 2.46534 2.46534 2.58439 2.65825
1 1 C 1S 0.00000 0.00000 0.00000 0.00184 0.00000
2 2S 0.00000 0.00000 0.00000 0.06658 0.00000
3 3S 0.00000 0.00000 0.00000 0.57746 0.00000
4 4S 0.00000 0.00000 0.00000 -10.14361 0.00000
5 5S 0.00000 0.00000 0.00000 24.08302 0.00000
6 6S 0.00000 0.00000 0.00000 0.44300 0.00000
7 7PX 0.00000 0.00000 -0.05327 0.00000 0.00000
8 7PY -0.05327 0.00000 0.00000 0.00000 0.00000
9 7PZ 0.00000 -0.05327 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 -0.99955 0.00000 0.00000
11 8PY -0.99955 0.00000 0.00000 0.00000 0.00000
12 8PZ 0.00000 -0.99955 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 10.66978 0.00000 0.00000
14 9PY 10.66978 0.00000 0.00000 0.00000 0.00000
15 9PZ 0.00000 10.66978 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 1.47301 0.00000 0.00000
17 10PY 1.47301 0.00000 0.00000 0.00000 0.00000
18 10PZ 0.00000 1.47301 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.58171 0.00000 0.00000
20 11PY 0.58171 0.00000 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.58171 0.00000 0.00000 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 -0.05833 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 -0.05833 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 -0.05833 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.28252 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.28252 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.28252 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 2.54375 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 2.54375 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 2.54375 0.00000 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.01036 0.00000 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.01036 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.01036 0.00000 0.00000 0.00000
42 16F 0 0.00000 -0.02398 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.01468 0.00000 -0.07587
44 16F-1 0.01468 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 -0.11881 0.00000
47 16F+3 0.00000 0.00000 -0.01896 0.00000 -0.05877
48 16F-3 0.01896 0.00000 0.00000 0.00000 0.00000
49 17F 0 0.00000 -0.17842 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.10926 0.00000 0.57279
51 17F-1 0.10926 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 0.96024 0.00000
54 17F+3 0.00000 0.00000 -0.14105 0.00000 0.44368
55 17F-3 0.14105 0.00000 0.00000 0.00000 0.00000
56 18F 0 0.00000 -3.14869 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 1.92817 0.00000 3.37142
58 18F-1 1.92817 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 3.95653 0.00000
61 18F+3 0.00000 0.00000 -2.48926 0.00000 2.61149
62 18F-3 2.48926 0.00000 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 -0.00185 0.00000
64 19G+1 -0.01612 0.00000 0.00000 0.00000 0.00000
65 19G-1 0.00000 0.00000 -0.01612 0.00000 -0.02510
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.04558 0.00000 0.00000 0.00000
68 19G+3 -0.04264 0.00000 0.00000 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.04264 0.00000 -0.00949
70 19G+4 0.00000 0.00000 0.00000 -0.00157 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 -0.47080 0.00000
73 20G+1 -0.18281 0.00000 0.00000 0.00000 0.00000
74 20G-1 0.00000 0.00000 -0.18281 0.00000 0.78260
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.51707 0.00000 0.00000 0.00000
77 20G+3 -0.48368 0.00000 0.00000 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.48368 0.00000 0.29580
79 20G+4 0.00000 0.00000 0.00000 -0.39790 0.00000
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 -0.04800 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 -0.01671 0.00000 0.00999
83 21H-1 -0.01671 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 0.03417 0.00000 -0.00463
87 21H-3 -0.03417 0.00000 0.00000 0.00000 0.00000
88 21H+4 0.00000 0.01140 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 -0.03142 0.00000 -0.01035
91 21H-5 -0.03142 0.00000 0.00000 0.00000 0.00000
92 2 H 1S 0.00304 0.00304 0.00304 0.01085 0.00000
93 2S 0.36602 0.36602 0.36602 -0.37091 0.00000
94 3S -4.81472 -4.81472 -4.81472 -6.59745 0.00000
95 4S -1.98354 -1.98354 -1.98354 -0.92369 0.00000
96 5S -0.44166 -0.44166 -0.44166 0.22909 0.00000
97 6PX -0.00112 -0.00112 0.01480 0.00750 0.00000
98 6PY 0.01480 -0.00112 -0.00112 0.00750 0.03171
99 6PZ -0.00112 0.01480 -0.00112 0.00750 -0.03171
100 7PX -0.04379 -0.04379 -0.10376 -0.02412 0.00000
101 7PY -0.10376 -0.04379 -0.04379 -0.02412 -0.18452
102 7PZ -0.04379 -0.10376 -0.04379 -0.02412 0.18452
103 8PX 1.22322 1.22322 1.38081 1.48226 0.00000
104 8PY 1.38081 1.22322 1.22322 1.48226 1.71076
105 8PZ 1.22322 1.38081 1.22322 1.48226 -1.71076
106 9PX 1.21334 1.21334 1.01794 -0.31801 0.00000
107 9PY 1.01794 1.21334 1.21334 -0.31801 1.19863
108 9PZ 1.21334 1.01794 1.21334 -0.31801 -1.19863
109 10D 0 -0.00875 0.01749 -0.00875 0.00000 0.00342
110 10D+1 0.04401 -0.00470 -0.00470 0.01613 -0.01092
111 10D-1 -0.00470 -0.00470 0.04401 0.01613 0.00000
112 10D+2 -0.01515 0.00000 0.01515 0.00000 0.00198
113 10D-2 -0.00470 0.04401 -0.00470 0.01613 0.01092
114 11D 0 0.03502 -0.07004 0.03502 0.00000 0.02311
115 11D+1 -0.28225 -0.00530 -0.00530 -0.19236 0.09200
116 11D-1 -0.00530 -0.00530 -0.28225 -0.19236 0.00000
117 11D+2 0.06065 0.00000 -0.06065 0.00000 0.01334
118 11D-2 -0.00530 -0.28225 -0.00530 -0.19236 -0.09200
119 12D 0 -0.55411 1.10822 -0.55411 0.00000 1.44980
120 12D+1 -0.02351 -1.06938 -1.06938 0.51229 0.52180
121 12D-1 -1.06938 -1.06938 -0.02351 0.51229 0.00000
122 12D+2 -0.95975 0.00000 0.95975 0.00000 0.83704
123 12D-2 -1.06938 -0.02351 -1.06938 0.51229 -0.52180
124 13F 0 -0.00295 0.00787 -0.00295 -0.00882 -0.00095
125 13F+1 0.00164 0.00197 -0.00482 0.00540 -0.01283
126 13F-1 -0.00482 0.00197 0.00164 0.00540 -0.00072
127 13F+2 -0.00021 0.00000 0.00021 0.00000 -0.00018
128 13F-2 -0.00040 -0.00040 -0.00040 0.01475 0.00000
129 13F+3 -0.00246 -0.00220 0.00622 -0.00697 -0.00994
130 13F-3 -0.00622 0.00220 0.00246 0.00697 -0.00065
131 14F 0 -0.01336 -0.19029 -0.01336 0.03994 -0.03395
132 14F+1 0.06970 -0.05333 0.11653 -0.02446 -0.07836
133 14F-1 0.11653 -0.05333 0.06970 -0.02446 -0.10358
134 14F+2 0.07781 0.00000 -0.07781 0.00000 -0.10472
135 14F-2 0.13893 0.13893 0.13893 -0.05376 0.00000
136 14F+3 0.03709 -0.05821 -0.15044 0.03158 -0.06070
137 14F-3 0.15044 0.05821 -0.03709 -0.03158 0.03729
138 15G 0 0.00337 0.00306 0.00337 -0.00460 -0.00458
139 15G+1 0.00049 0.01098 -0.00472 -0.00165 0.00335
140 15G-1 -0.00472 0.01098 0.00049 -0.00165 0.00531
141 15G+2 -0.00027 0.00000 0.00027 0.00000 0.00409
142 15G-2 -0.00885 -0.00140 -0.00885 0.00467 0.00837
143 15G+3 0.00131 0.00532 0.01125 -0.00437 0.00768
144 15G-3 -0.01125 -0.00532 -0.00131 0.00437 0.00201
145 15G+4 0.00264 0.00300 0.00264 -0.00389 0.00542
146 15G-4 -0.00839 0.00000 0.00839 0.00000 0.00041
147 3 H 1S -0.00304 0.00304 -0.00304 0.01085 0.00000
148 2S -0.36602 0.36602 -0.36602 -0.37091 0.00000
149 3S 4.81472 -4.81472 4.81472 -6.59745 0.00000
150 4S 1.98354 -1.98354 1.98354 -0.92369 0.00000
151 5S 0.44166 -0.44166 0.44166 0.22909 0.00000
152 6PX -0.00112 0.00112 0.01480 -0.00750 0.00000
153 6PY 0.01480 0.00112 -0.00112 -0.00750 0.03171
154 6PZ 0.00112 0.01480 0.00112 0.00750 0.03171
155 7PX -0.04379 0.04379 -0.10376 0.02412 0.00000
156 7PY -0.10376 0.04379 -0.04379 0.02412 -0.18452
157 7PZ 0.04379 -0.10376 0.04379 -0.02412 -0.18452
158 8PX 1.22322 -1.22322 1.38081 -1.48226 0.00000
159 8PY 1.38081 -1.22322 1.22322 -1.48226 1.71076
160 8PZ -1.22322 1.38081 -1.22322 1.48226 1.71076
161 9PX 1.21334 -1.21334 1.01794 0.31801 0.00000
162 9PY 1.01794 -1.21334 1.21334 0.31801 1.19863
163 9PZ -1.21334 1.01794 -1.21334 -0.31801 1.19863
164 10D 0 0.00875 0.01749 0.00875 0.00000 -0.00342
165 10D+1 0.04401 0.00470 -0.00470 -0.01613 -0.01092
166 10D-1 -0.00470 0.00470 0.04401 -0.01613 0.00000
167 10D+2 0.01515 0.00000 -0.01515 0.00000 -0.00198
168 10D-2 0.00470 0.04401 0.00470 0.01613 -0.01092
169 11D 0 -0.03502 -0.07004 -0.03502 0.00000 -0.02311
170 11D+1 -0.28225 0.00530 -0.00530 0.19236 0.09200
171 11D-1 -0.00530 0.00530 -0.28225 0.19236 0.00000
172 11D+2 -0.06065 0.00000 0.06065 0.00000 -0.01334
173 11D-2 0.00530 -0.28225 0.00530 -0.19236 0.09200
174 12D 0 0.55411 1.10822 0.55411 0.00000 -1.44980
175 12D+1 -0.02351 1.06938 -1.06938 -0.51229 0.52180
176 12D-1 -1.06938 1.06938 -0.02351 -0.51229 0.00000
177 12D+2 0.95975 0.00000 -0.95975 0.00000 -0.83704
178 12D-2 1.06938 -0.02351 1.06938 0.51229 0.52180
179 13F 0 0.00295 0.00787 0.00295 -0.00882 0.00095
180 13F+1 0.00164 -0.00197 -0.00482 -0.00540 -0.01283
181 13F-1 -0.00482 -0.00197 0.00164 -0.00540 -0.00072
182 13F+2 0.00021 0.00000 -0.00021 0.00000 0.00018
183 13F-2 0.00040 -0.00040 0.00040 0.01475 0.00000
184 13F+3 -0.00246 0.00220 0.00622 0.00697 -0.00994
185 13F-3 -0.00622 -0.00220 0.00246 -0.00697 -0.00065
186 14F 0 0.01336 -0.19029 0.01336 0.03994 0.03395
187 14F+1 0.06970 0.05333 0.11653 0.02446 -0.07836
188 14F-1 0.11653 0.05333 0.06970 0.02446 -0.10358
189 14F+2 -0.07781 0.00000 0.07781 0.00000 0.10472
190 14F-2 -0.13893 0.13893 -0.13893 -0.05376 0.00000
191 14F+3 0.03709 0.05821 -0.15044 -0.03158 -0.06070
192 14F-3 0.15044 -0.05821 -0.03709 0.03158 0.03729
193 15G 0 -0.00337 0.00306 -0.00337 -0.00460 0.00458
194 15G+1 0.00049 -0.01098 -0.00472 0.00165 0.00335
195 15G-1 -0.00472 -0.01098 0.00049 0.00165 0.00531
196 15G+2 0.00027 0.00000 -0.00027 0.00000 -0.00409
197 15G-2 0.00885 -0.00140 0.00885 0.00467 -0.00837
198 15G+3 0.00131 -0.00532 0.01125 0.00437 0.00768
199 15G-3 -0.01125 0.00532 -0.00131 -0.00437 0.00201
200 15G+4 -0.00264 0.00300 -0.00264 -0.00389 -0.00542
201 15G-4 0.00839 0.00000 -0.00839 0.00000 -0.00041
202 4 H 1S -0.00304 -0.00304 0.00304 0.01085 0.00000
203 2S -0.36602 -0.36602 0.36602 -0.37091 0.00000
204 3S 4.81472 4.81472 -4.81472 -6.59745 0.00000
205 4S 1.98354 1.98354 -1.98354 -0.92369 0.00000
206 5S 0.44166 0.44166 -0.44166 0.22909 0.00000
207 6PX 0.00112 0.00112 0.01480 0.00750 0.00000
208 6PY 0.01480 -0.00112 0.00112 -0.00750 -0.03171
209 6PZ -0.00112 0.01480 0.00112 -0.00750 0.03171
210 7PX 0.04379 0.04379 -0.10376 -0.02412 0.00000
211 7PY -0.10376 -0.04379 0.04379 0.02412 0.18452
212 7PZ -0.04379 -0.10376 0.04379 0.02412 -0.18452
213 8PX -1.22322 -1.22322 1.38081 1.48226 0.00000
214 8PY 1.38081 1.22322 -1.22322 -1.48226 -1.71076
215 8PZ 1.22322 1.38081 -1.22322 -1.48226 1.71076
216 9PX -1.21334 -1.21334 1.01794 -0.31801 0.00000
217 9PY 1.01794 1.21334 -1.21334 0.31801 -1.19863
218 9PZ 1.21334 1.01794 -1.21334 0.31801 1.19863
219 10D 0 0.00875 -0.01749 -0.00875 0.00000 0.00342
220 10D+1 0.04401 -0.00470 0.00470 -0.01613 0.01092
221 10D-1 0.00470 0.00470 0.04401 0.01613 0.00000
222 10D+2 0.01515 0.00000 0.01515 0.00000 0.00198
223 10D-2 -0.00470 0.04401 0.00470 -0.01613 -0.01092
224 11D 0 -0.03502 0.07004 0.03502 0.00000 0.02311
225 11D+1 -0.28225 -0.00530 0.00530 0.19236 -0.09200
226 11D-1 0.00530 0.00530 -0.28225 -0.19236 0.00000
227 11D+2 -0.06065 0.00000 -0.06065 0.00000 0.01334
228 11D-2 -0.00530 -0.28225 0.00530 0.19236 0.09200
229 12D 0 0.55411 -1.10822 -0.55411 0.00000 1.44980
230 12D+1 -0.02351 -1.06938 1.06938 -0.51229 -0.52180
231 12D-1 1.06938 1.06938 -0.02351 0.51229 0.00000
232 12D+2 0.95975 0.00000 0.95975 0.00000 0.83704
233 12D-2 -1.06938 -0.02351 1.06938 -0.51229 0.52180
234 13F 0 -0.00295 0.00787 0.00295 0.00882 0.00095
235 13F+1 -0.00164 -0.00197 -0.00482 0.00540 -0.01283
236 13F-1 -0.00482 0.00197 -0.00164 -0.00540 0.00072
237 13F+2 -0.00021 0.00000 -0.00021 0.00000 0.00018
238 13F-2 0.00040 0.00040 -0.00040 0.01475 0.00000
239 13F+3 0.00246 0.00220 0.00622 -0.00697 -0.00994
240 13F-3 -0.00622 0.00220 -0.00246 -0.00697 0.00065
241 14F 0 -0.01336 -0.19029 0.01336 -0.03994 0.03395
242 14F+1 -0.06970 0.05333 0.11653 -0.02446 -0.07836
243 14F-1 0.11653 -0.05333 -0.06970 0.02446 0.10358
244 14F+2 0.07781 0.00000 0.07781 0.00000 0.10472
245 14F-2 -0.13893 -0.13893 0.13893 -0.05376 0.00000
246 14F+3 -0.03709 0.05821 -0.15044 0.03158 -0.06070
247 14F-3 0.15044 0.05821 0.03709 0.03158 -0.03729
248 15G 0 -0.00337 -0.00306 0.00337 -0.00460 -0.00458
249 15G+1 0.00049 0.01098 0.00472 0.00165 -0.00335
250 15G-1 0.00472 -0.01098 0.00049 -0.00165 0.00531
251 15G+2 0.00027 0.00000 0.00027 0.00000 0.00409
252 15G-2 -0.00885 -0.00140 0.00885 -0.00467 -0.00837
253 15G+3 0.00131 0.00532 -0.01125 0.00437 -0.00768
254 15G-3 0.01125 0.00532 -0.00131 0.00437 0.00201
255 15G+4 -0.00264 -0.00300 0.00264 -0.00389 0.00542
256 15G-4 -0.00839 0.00000 -0.00839 0.00000 -0.00041
257 5 H 1S 0.00304 -0.00304 -0.00304 0.01085 0.00000
258 2S 0.36602 -0.36602 -0.36602 -0.37091 0.00000
259 3S -4.81472 4.81472 4.81472 -6.59745 0.00000
260 4S -1.98354 1.98354 1.98354 -0.92369 0.00000
261 5S -0.44166 0.44166 0.44166 0.22909 0.00000
262 6PX 0.00112 -0.00112 0.01480 -0.00750 0.00000
263 6PY 0.01480 0.00112 0.00112 0.00750 -0.03171
264 6PZ 0.00112 0.01480 -0.00112 -0.00750 -0.03171
265 7PX 0.04379 -0.04379 -0.10376 0.02412 0.00000
266 7PY -0.10376 0.04379 0.04379 -0.02412 0.18452
267 7PZ 0.04379 -0.10376 -0.04379 0.02412 0.18452
268 8PX -1.22322 1.22322 1.38081 -1.48226 0.00000
269 8PY 1.38081 -1.22322 -1.22322 1.48226 -1.71076
270 8PZ -1.22322 1.38081 1.22322 -1.48226 -1.71076
271 9PX -1.21334 1.21334 1.01794 0.31801 0.00000
272 9PY 1.01794 -1.21334 -1.21334 -0.31801 -1.19863
273 9PZ -1.21334 1.01794 1.21334 0.31801 -1.19863
274 10D 0 -0.00875 -0.01749 0.00875 0.00000 -0.00342
275 10D+1 0.04401 0.00470 0.00470 0.01613 0.01092
276 10D-1 0.00470 -0.00470 0.04401 -0.01613 0.00000
277 10D+2 -0.01515 0.00000 -0.01515 0.00000 -0.00198
278 10D-2 0.00470 0.04401 -0.00470 -0.01613 0.01092
279 11D 0 0.03502 0.07004 -0.03502 0.00000 -0.02311
280 11D+1 -0.28225 0.00530 0.00530 -0.19236 -0.09200
281 11D-1 0.00530 -0.00530 -0.28225 0.19236 0.00000
282 11D+2 0.06065 0.00000 0.06065 0.00000 -0.01334
283 11D-2 0.00530 -0.28225 -0.00530 0.19236 -0.09200
284 12D 0 -0.55411 -1.10822 0.55411 0.00000 -1.44980
285 12D+1 -0.02351 1.06938 1.06938 0.51229 -0.52180
286 12D-1 1.06938 -1.06938 -0.02351 -0.51229 0.00000
287 12D+2 -0.95975 0.00000 -0.95975 0.00000 -0.83704
288 12D-2 1.06938 -0.02351 -1.06938 -0.51229 -0.52180
289 13F 0 0.00295 0.00787 -0.00295 0.00882 -0.00095
290 13F+1 -0.00164 0.00197 -0.00482 -0.00540 -0.01283
291 13F-1 -0.00482 -0.00197 -0.00164 0.00540 0.00072
292 13F+2 0.00021 0.00000 0.00021 0.00000 -0.00018
293 13F-2 -0.00040 0.00040 0.00040 0.01475 0.00000
294 13F+3 0.00246 -0.00220 0.00622 0.00697 -0.00994
295 13F-3 -0.00622 -0.00220 -0.00246 0.00697 0.00065
296 14F 0 0.01336 -0.19029 -0.01336 -0.03994 -0.03395
297 14F+1 -0.06970 -0.05333 0.11653 0.02446 -0.07836
298 14F-1 0.11653 0.05333 -0.06970 -0.02446 0.10358
299 14F+2 -0.07781 0.00000 -0.07781 0.00000 -0.10472
300 14F-2 0.13893 -0.13893 -0.13893 -0.05376 0.00000
301 14F+3 -0.03709 -0.05821 -0.15044 -0.03158 -0.06070
302 14F-3 0.15044 -0.05821 0.03709 -0.03158 -0.03729
303 15G 0 0.00337 -0.00306 -0.00337 -0.00460 0.00458
304 15G+1 0.00049 -0.01098 0.00472 -0.00165 -0.00335
305 15G-1 0.00472 0.01098 0.00049 0.00165 0.00531
306 15G+2 -0.00027 0.00000 -0.00027 0.00000 -0.00409
307 15G-2 0.00885 -0.00140 -0.00885 -0.00467 0.00837
308 15G+3 0.00131 -0.00532 -0.01125 -0.00437 -0.00768
309 15G-3 0.01125 -0.00532 -0.00131 -0.00437 0.00201
310 15G+4 0.00264 -0.00300 -0.00264 -0.00389 -0.00542
311 15G-4 0.00839 0.00000 0.00839 0.00000 0.00041
76 77 78 79 80
(T1)--V (T1)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 2.65825 2.65825 2.71227 2.71227 2.71227
1 1 C 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 0.00000 0.00000 -0.11253
8 7PY 0.00000 0.00000 0.00000 -0.11253 0.00000
9 7PZ 0.00000 0.00000 -0.11253 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 0.00000 -1.02705
11 8PY 0.00000 0.00000 0.00000 -1.02705 0.00000
12 8PZ 0.00000 0.00000 -1.02705 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 3.70878
14 9PY 0.00000 0.00000 0.00000 3.70878 0.00000
15 9PZ 0.00000 0.00000 3.70878 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 11.57362
17 10PY 0.00000 0.00000 0.00000 11.57362 0.00000
18 10PZ 0.00000 0.00000 11.57362 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 1.00232
20 11PY 0.00000 0.00000 0.00000 1.00232 0.00000
21 11PZ 0.00000 0.00000 1.00232 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 -0.00689 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 -0.00689
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 -0.00689 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 0.03392 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.03392
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.03392 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 4.34838 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 4.34838
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 4.34838 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 4.93835 0.00000
39 15D-1 0.00000 0.00000 0.00000 0.00000 4.93835
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 4.93835 0.00000 0.00000
42 16F 0 0.00000 0.00000 0.03100 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.00000 0.00000 -0.01898
44 16F-1 0.00000 -0.07587 0.00000 -0.01898 0.00000
45 16F+2 -0.09597 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 0.02451
48 16F-3 0.00000 0.05877 0.00000 -0.02451 0.00000
49 17F 0 0.00000 0.00000 -0.48368 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.29620
51 17F-1 0.00000 0.57279 0.00000 0.29620 0.00000
52 17F+2 0.72452 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 -0.38239
55 17F-3 0.00000 -0.44368 0.00000 0.38239 0.00000
56 18F 0 0.00000 0.00000 -1.78570 0.00000 0.00000
57 18F+1 0.00000 0.00000 0.00000 0.00000 1.09351
58 18F-1 0.00000 3.37142 0.00000 1.09351 0.00000
59 18F+2 4.26455 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 -1.41172
62 18F-3 0.00000 -2.61149 0.00000 1.41172 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 -0.02510 0.00000 -0.01977 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00000 -0.01977
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.05591 0.00000 0.00000
68 19G+3 0.00000 0.00949 0.00000 -0.05230 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.05230
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
71 19G-4 -0.02683 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 0.78260 0.00000 -0.05452 0.00000
74 20G-1 0.00000 0.00000 0.00000 0.00000 -0.05452
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.15420 0.00000 0.00000
77 20G+3 0.00000 -0.29580 0.00000 -0.14424 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.14424
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
80 20G-4 0.83664 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00839 0.00000 0.00000
82 21H+1 0.00000 0.00000 0.00000 0.00000 -0.03798
83 21H-1 0.00000 0.00999 0.00000 -0.03798 0.00000
84 21H+2 -0.01511 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 -0.06278
87 21H-3 0.00000 0.00463 0.00000 0.06278 0.00000
88 21H+4 0.00000 0.00000 -0.07340 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 -0.00862
91 21H-5 0.00000 -0.01035 0.00000 -0.00862 0.00000
92 2 H 1S 0.00000 0.00000 0.00669 0.00669 0.00669
93 2S 0.00000 0.00000 0.51141 0.51141 0.51141
94 3S 0.00000 0.00000 -5.30110 -5.30110 -5.30110
95 4S 0.00000 0.00000 -6.43015 -6.43015 -6.43015
96 5S 0.00000 0.00000 -0.34664 -0.34664 -0.34664
97 6PX -0.03171 0.03171 -0.03343 -0.03343 -0.00110
98 6PY 0.03171 0.00000 -0.03343 -0.00110 -0.03343
99 6PZ 0.00000 -0.03171 -0.00110 -0.03343 -0.03343
100 7PX 0.18452 -0.18452 0.14072 0.14072 -0.02735
101 7PY -0.18452 0.00000 0.14072 -0.02735 0.14072
102 7PZ 0.00000 0.18452 -0.02735 0.14072 0.14072
103 8PX -1.71076 1.71076 0.13720 0.13720 1.22306
104 8PY 1.71076 0.00000 0.13720 1.22306 0.13720
105 8PZ 0.00000 -1.71076 1.22306 0.13720 0.13720
106 9PX -1.19863 1.19863 1.31193 1.31193 1.25355
107 9PY 1.19863 0.00000 1.31193 1.25355 1.31193
108 9PZ 0.00000 -1.19863 1.25355 1.31193 1.31193
109 10D 0 0.00000 0.00342 -0.00854 0.00427 0.00427
110 10D+1 -0.01092 0.00000 0.01996 0.02014 0.01996
111 10D-1 0.01092 -0.01092 0.01996 0.01996 0.02014
112 10D+2 0.00395 -0.00198 0.00000 0.00740 -0.00740
113 10D-2 0.00000 0.01092 0.02014 0.01996 0.01996
114 11D 0 0.00000 0.02311 0.03242 -0.01621 -0.01621
115 11D+1 0.09200 0.00000 -0.18312 -0.17559 -0.18312
116 11D-1 -0.09200 0.09200 -0.18312 -0.18312 -0.17559
117 11D+2 0.02668 -0.01334 0.00000 -0.02808 0.02808
118 11D-2 0.00000 -0.09200 -0.17559 -0.18312 -0.18312
119 12D 0 0.00000 1.44980 -0.35862 0.17931 0.17931
120 12D+1 0.52180 0.00000 0.05039 0.22175 0.05039
121 12D-1 -0.52180 0.52180 0.05039 0.05039 0.22175
122 12D+2 1.67409 -0.83704 0.00000 0.31057 -0.31057
123 12D-2 0.00000 -0.52180 0.22175 0.05039 0.05039
124 13F 0 0.00000 -0.00095 -0.00034 -0.00638 -0.00638
125 13F+1 0.00044 -0.00072 0.00765 0.00016 0.00021
126 13F-1 -0.00044 -0.01283 0.00765 0.00021 0.00016
127 13F+2 -0.01623 0.00018 0.00000 -0.00474 0.00474
128 13F-2 0.00000 0.00000 0.00567 0.00567 0.00567
129 13F+3 -0.00086 0.00065 -0.00214 -0.00794 -0.00027
130 13F-3 -0.00086 0.00994 0.00214 0.00027 0.00794
131 14F 0 0.00000 -0.03395 -0.02307 -0.01119 -0.01119
132 14F+1 -0.06200 -0.10358 0.00776 0.00594 0.01413
133 14F-1 0.06200 -0.07836 0.00776 0.01413 0.00594
134 14F+2 -0.09912 0.10472 0.00000 -0.00115 0.00115
135 14F-2 0.00000 0.00000 0.04660 0.04660 0.04660
136 14F+3 -0.09097 -0.03729 -0.00814 -0.00955 -0.01824
137 14F-3 -0.09097 0.06070 0.00814 0.01824 0.00955
138 15G 0 0.00000 -0.00458 -0.00010 0.00024 0.00024
139 15G+1 0.00257 0.00531 -0.00091 0.00077 0.00152
140 15G-1 -0.00257 0.00335 -0.00091 0.00152 0.00077
141 15G+2 0.00819 -0.00409 0.00000 -0.00031 0.00031
142 15G-2 0.00000 0.00837 -0.00219 -0.00087 -0.00087
143 15G+3 0.00798 -0.00201 0.00127 0.00205 0.00035
144 15G-3 0.00798 -0.00768 -0.00127 -0.00035 -0.00205
145 15G+4 0.00000 0.00542 0.00038 -0.00003 -0.00003
146 15G-4 0.00568 -0.00041 0.00000 0.00130 -0.00130
147 3 H 1S 0.00000 0.00000 0.00669 -0.00669 -0.00669
148 2S 0.00000 0.00000 0.51141 -0.51141 -0.51141
149 3S 0.00000 0.00000 -5.30110 5.30110 5.30110
150 4S 0.00000 0.00000 -6.43015 6.43015 6.43015
151 5S 0.00000 0.00000 -0.34664 0.34664 0.34664
152 6PX 0.03171 0.03171 0.03343 -0.03343 -0.00110
153 6PY -0.03171 0.00000 0.03343 -0.00110 -0.03343
154 6PZ 0.00000 0.03171 -0.00110 0.03343 0.03343
155 7PX -0.18452 -0.18452 -0.14072 0.14072 -0.02735
156 7PY 0.18452 0.00000 -0.14072 -0.02735 0.14072
157 7PZ 0.00000 -0.18452 -0.02735 -0.14072 -0.14072
158 8PX 1.71076 1.71076 -0.13720 0.13720 1.22306
159 8PY -1.71076 0.00000 -0.13720 1.22306 0.13720
160 8PZ 0.00000 1.71076 1.22306 -0.13720 -0.13720
161 9PX 1.19863 1.19863 -1.31193 1.31193 1.25355
162 9PY -1.19863 0.00000 -1.31193 1.25355 1.31193
163 9PZ 0.00000 1.19863 1.25355 -1.31193 -1.31193
164 10D 0 0.00000 -0.00342 -0.00854 -0.00427 -0.00427
165 10D+1 0.01092 0.00000 -0.01996 0.02014 0.01996
166 10D-1 -0.01092 -0.01092 -0.01996 0.01996 0.02014
167 10D+2 0.00395 0.00198 0.00000 -0.00740 0.00740
168 10D-2 0.00000 -0.01092 0.02014 -0.01996 -0.01996
169 11D 0 0.00000 -0.02311 0.03242 0.01621 0.01621
170 11D+1 -0.09200 0.00000 0.18312 -0.17559 -0.18312
171 11D-1 0.09200 0.09200 0.18312 -0.18312 -0.17559
172 11D+2 0.02668 0.01334 0.00000 0.02808 -0.02808
173 11D-2 0.00000 0.09200 -0.17559 0.18312 0.18312
174 12D 0 0.00000 -1.44980 -0.35862 -0.17931 -0.17931
175 12D+1 -0.52180 0.00000 -0.05039 0.22175 0.05039
176 12D-1 0.52180 0.52180 -0.05039 0.05039 0.22175
177 12D+2 1.67409 0.83704 0.00000 -0.31057 0.31057
178 12D-2 0.00000 0.52180 0.22175 -0.05039 -0.05039
179 13F 0 0.00000 0.00095 -0.00034 0.00638 0.00638
180 13F+1 -0.00044 -0.00072 -0.00765 0.00016 0.00021
181 13F-1 0.00044 -0.01283 -0.00765 0.00021 0.00016
182 13F+2 -0.01623 -0.00018 0.00000 0.00474 -0.00474
183 13F-2 0.00000 0.00000 0.00567 -0.00567 -0.00567
184 13F+3 0.00086 0.00065 0.00214 -0.00794 -0.00027
185 13F-3 0.00086 0.00994 -0.00214 0.00027 0.00794
186 14F 0 0.00000 0.03395 -0.02307 0.01119 0.01119
187 14F+1 0.06200 -0.10358 -0.00776 0.00594 0.01413
188 14F-1 -0.06200 -0.07836 -0.00776 0.01413 0.00594
189 14F+2 -0.09912 -0.10472 0.00000 0.00115 -0.00115
190 14F-2 0.00000 0.00000 0.04660 -0.04660 -0.04660
191 14F+3 0.09097 -0.03729 0.00814 -0.00955 -0.01824
192 14F-3 0.09097 0.06070 -0.00814 0.01824 0.00955
193 15G 0 0.00000 0.00458 -0.00010 -0.00024 -0.00024
194 15G+1 -0.00257 0.00531 0.00091 0.00077 0.00152
195 15G-1 0.00257 0.00335 0.00091 0.00152 0.00077
196 15G+2 0.00819 0.00409 0.00000 0.00031 -0.00031
197 15G-2 0.00000 -0.00837 -0.00219 0.00087 0.00087
198 15G+3 -0.00798 -0.00201 -0.00127 0.00205 0.00035
199 15G-3 -0.00798 -0.00768 0.00127 -0.00035 -0.00205
200 15G+4 0.00000 -0.00542 0.00038 0.00003 0.00003
201 15G-4 0.00568 0.00041 0.00000 -0.00130 0.00130
202 4 H 1S 0.00000 0.00000 -0.00669 -0.00669 0.00669
203 2S 0.00000 0.00000 -0.51141 -0.51141 0.51141
204 3S 0.00000 0.00000 5.30110 5.30110 -5.30110
205 4S 0.00000 0.00000 6.43015 6.43015 -6.43015
206 5S 0.00000 0.00000 0.34664 0.34664 -0.34664
207 6PX 0.03171 -0.03171 0.03343 0.03343 -0.00110
208 6PY 0.03171 0.00000 -0.03343 -0.00110 0.03343
209 6PZ 0.00000 -0.03171 -0.00110 -0.03343 0.03343
210 7PX -0.18452 0.18452 -0.14072 -0.14072 -0.02735
211 7PY -0.18452 0.00000 0.14072 -0.02735 -0.14072
212 7PZ 0.00000 0.18452 -0.02735 0.14072 -0.14072
213 8PX 1.71076 -1.71076 -0.13720 -0.13720 1.22306
214 8PY 1.71076 0.00000 0.13720 1.22306 -0.13720
215 8PZ 0.00000 -1.71076 1.22306 0.13720 -0.13720
216 9PX 1.19863 -1.19863 -1.31193 -1.31193 1.25355
217 9PY 1.19863 0.00000 1.31193 1.25355 -1.31193
218 9PZ 0.00000 -1.19863 1.25355 1.31193 -1.31193
219 10D 0 0.00000 -0.00342 0.00854 -0.00427 0.00427
220 10D+1 -0.01092 0.00000 0.01996 0.02014 -0.01996
221 10D-1 -0.01092 0.01092 -0.01996 -0.01996 0.02014
222 10D+2 -0.00395 0.00198 0.00000 -0.00740 -0.00740
223 10D-2 0.00000 0.01092 0.02014 0.01996 -0.01996
224 11D 0 0.00000 -0.02311 -0.03242 0.01621 -0.01621
225 11D+1 0.09200 0.00000 -0.18312 -0.17559 0.18312
226 11D-1 0.09200 -0.09200 0.18312 0.18312 -0.17559
227 11D+2 -0.02668 0.01334 0.00000 0.02808 0.02808
228 11D-2 0.00000 -0.09200 -0.17559 -0.18312 0.18312
229 12D 0 0.00000 -1.44980 0.35862 -0.17931 0.17931
230 12D+1 0.52180 0.00000 0.05039 0.22175 -0.05039
231 12D-1 0.52180 -0.52180 -0.05039 -0.05039 0.22175
232 12D+2 -1.67409 0.83704 0.00000 -0.31057 -0.31057
233 12D-2 0.00000 -0.52180 0.22175 0.05039 -0.05039
234 13F 0 0.00000 -0.00095 -0.00034 -0.00638 0.00638
235 13F+1 -0.00044 0.00072 -0.00765 -0.00016 0.00021
236 13F-1 -0.00044 -0.01283 0.00765 0.00021 -0.00016
237 13F+2 -0.01623 0.00018 0.00000 -0.00474 -0.00474
238 13F-2 0.00000 0.00000 -0.00567 -0.00567 0.00567
239 13F+3 0.00086 -0.00065 0.00214 0.00794 -0.00027
240 13F-3 -0.00086 0.00994 0.00214 0.00027 -0.00794
241 14F 0 0.00000 -0.03395 -0.02307 -0.01119 0.01119
242 14F+1 0.06200 0.10358 -0.00776 -0.00594 0.01413
243 14F-1 0.06200 -0.07836 0.00776 0.01413 -0.00594
244 14F+2 -0.09912 0.10472 0.00000 -0.00115 -0.00115
245 14F-2 0.00000 0.00000 -0.04660 -0.04660 0.04660
246 14F+3 0.09097 0.03729 0.00814 0.00955 -0.01824
247 14F-3 -0.09097 0.06070 0.00814 0.01824 -0.00955
248 15G 0 0.00000 0.00458 0.00010 -0.00024 0.00024
249 15G+1 0.00257 0.00531 -0.00091 0.00077 -0.00152
250 15G-1 0.00257 -0.00335 0.00091 -0.00152 0.00077
251 15G+2 -0.00819 0.00409 0.00000 0.00031 0.00031
252 15G-2 0.00000 0.00837 -0.00219 -0.00087 0.00087
253 15G+3 0.00798 -0.00201 0.00127 0.00205 -0.00035
254 15G-3 -0.00798 0.00768 0.00127 0.00035 -0.00205
255 15G+4 0.00000 -0.00542 -0.00038 0.00003 -0.00003
256 15G-4 0.00568 -0.00041 0.00000 0.00130 0.00130
257 5 H 1S 0.00000 0.00000 -0.00669 0.00669 -0.00669
258 2S 0.00000 0.00000 -0.51141 0.51141 -0.51141
259 3S 0.00000 0.00000 5.30110 -5.30110 5.30110
260 4S 0.00000 0.00000 6.43015 -6.43015 6.43015
261 5S 0.00000 0.00000 0.34664 -0.34664 0.34664
262 6PX -0.03171 -0.03171 -0.03343 0.03343 -0.00110
263 6PY -0.03171 0.00000 0.03343 -0.00110 0.03343
264 6PZ 0.00000 0.03171 -0.00110 0.03343 -0.03343
265 7PX 0.18452 0.18452 0.14072 -0.14072 -0.02735
266 7PY 0.18452 0.00000 -0.14072 -0.02735 -0.14072
267 7PZ 0.00000 -0.18452 -0.02735 -0.14072 0.14072
268 8PX -1.71076 -1.71076 0.13720 -0.13720 1.22306
269 8PY -1.71076 0.00000 -0.13720 1.22306 -0.13720
270 8PZ 0.00000 1.71076 1.22306 -0.13720 0.13720
271 9PX -1.19863 -1.19863 1.31193 -1.31193 1.25355
272 9PY -1.19863 0.00000 -1.31193 1.25355 -1.31193
273 9PZ 0.00000 1.19863 1.25355 -1.31193 1.31193
274 10D 0 0.00000 0.00342 0.00854 0.00427 -0.00427
275 10D+1 0.01092 0.00000 -0.01996 0.02014 -0.01996
276 10D-1 0.01092 0.01092 0.01996 -0.01996 0.02014
277 10D+2 -0.00395 -0.00198 0.00000 0.00740 0.00740
278 10D-2 0.00000 -0.01092 0.02014 -0.01996 0.01996
279 11D 0 0.00000 0.02311 -0.03242 -0.01621 0.01621
280 11D+1 -0.09200 0.00000 0.18312 -0.17559 0.18312
281 11D-1 -0.09200 -0.09200 -0.18312 0.18312 -0.17559
282 11D+2 -0.02668 -0.01334 0.00000 -0.02808 -0.02808
283 11D-2 0.00000 0.09200 -0.17559 0.18312 -0.18312
284 12D 0 0.00000 1.44980 0.35862 0.17931 -0.17931
285 12D+1 -0.52180 0.00000 -0.05039 0.22175 -0.05039
286 12D-1 -0.52180 -0.52180 0.05039 -0.05039 0.22175
287 12D+2 -1.67409 -0.83704 0.00000 0.31057 0.31057
288 12D-2 0.00000 0.52180 0.22175 -0.05039 0.05039
289 13F 0 0.00000 0.00095 -0.00034 0.00638 -0.00638
290 13F+1 0.00044 0.00072 0.00765 -0.00016 0.00021
291 13F-1 0.00044 -0.01283 -0.00765 0.00021 -0.00016
292 13F+2 -0.01623 -0.00018 0.00000 0.00474 0.00474
293 13F-2 0.00000 0.00000 -0.00567 0.00567 -0.00567
294 13F+3 -0.00086 -0.00065 -0.00214 0.00794 -0.00027
295 13F-3 0.00086 0.00994 -0.00214 0.00027 -0.00794
296 14F 0 0.00000 0.03395 -0.02307 0.01119 -0.01119
297 14F+1 -0.06200 0.10358 0.00776 -0.00594 0.01413
298 14F-1 -0.06200 -0.07836 -0.00776 0.01413 -0.00594
299 14F+2 -0.09912 -0.10472 0.00000 0.00115 0.00115
300 14F-2 0.00000 0.00000 -0.04660 0.04660 -0.04660
301 14F+3 -0.09097 0.03729 -0.00814 0.00955 -0.01824
302 14F-3 0.09097 0.06070 -0.00814 0.01824 -0.00955
303 15G 0 0.00000 -0.00458 0.00010 0.00024 -0.00024
304 15G+1 -0.00257 0.00531 0.00091 0.00077 -0.00152
305 15G-1 -0.00257 -0.00335 -0.00091 -0.00152 0.00077
306 15G+2 -0.00819 -0.00409 0.00000 -0.00031 -0.00031
307 15G-2 0.00000 -0.00837 -0.00219 0.00087 -0.00087
308 15G+3 -0.00798 -0.00201 -0.00127 0.00205 -0.00035
309 15G-3 0.00798 0.00768 -0.00127 0.00035 -0.00205
310 15G+4 0.00000 0.00542 -0.00038 -0.00003 0.00003
311 15G-4 0.00568 0.00041 0.00000 -0.00130 -0.00130
81 82 83 84 85
(A1)--V (T2)--V (T2)--V (T2)--V (E)--V
Eigenvalues -- 2.92272 3.16335 3.16335 3.16335 3.30216
1 1 C 1S 0.08113 0.00000 0.00000 0.00000 0.00000
2 2S -0.17360 0.00000 0.00000 0.00000 0.00000
3 3S 0.31757 0.00000 0.00000 0.00000 0.00000
4 4S -7.46962 0.00000 0.00000 0.00000 0.00000
5 5S 7.50488 0.00000 0.00000 0.00000 0.00000
6 6S -3.77340 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 0.14457 0.00000
8 7PY 0.00000 0.14457 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.14457 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 -0.73726 0.00000
11 8PY 0.00000 -0.73726 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 -0.73726 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 11.97445 0.00000
14 9PY 0.00000 11.97445 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 11.97445 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 9.66545 0.00000
17 10PY 0.00000 9.66545 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 9.66545 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 -0.18106 0.00000
20 11PY 0.00000 -0.18106 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 -0.18106 0.00000 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.05413
23 12D+1 0.00000 0.02273 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.02273 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 -0.00046
26 12D-2 0.00000 0.00000 0.02273 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.10736
28 13D+1 0.00000 -0.42321 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 -0.42321 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00092
31 13D-2 0.00000 0.00000 -0.42321 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 6.28337
33 14D+1 0.00000 12.12257 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 12.12257 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 -0.05384
36 14D-2 0.00000 0.00000 12.12257 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 5.08338
38 15D+1 0.00000 4.84274 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 4.84274 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 -0.04356
41 15D-2 0.00000 0.00000 4.84274 0.00000 0.00000
42 16F 0 0.00000 0.00000 0.11360 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.00000 -0.06957 0.00000
44 16F-1 0.00000 -0.06957 0.00000 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-2 -0.09218 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.00000 0.00000 0.08981 0.00000
48 16F-3 0.00000 -0.08981 0.00000 0.00000 0.00000
49 17F 0 0.00000 0.00000 -1.13942 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.00000 0.69775 0.00000
51 17F-1 0.00000 0.69775 0.00000 0.00000 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
53 17F-2 1.02111 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.00000 0.00000 0.00000 -0.90079 0.00000
55 17F-3 0.00000 0.90079 0.00000 0.00000 0.00000
56 18F 0 0.00000 0.00000 -4.04483 0.00000 0.00000
57 18F+1 0.00000 0.00000 0.00000 2.47694 0.00000
58 18F-1 0.00000 2.47694 0.00000 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
60 18F-2 2.14331 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.00000 0.00000 0.00000 -3.19772 0.00000
62 18F-3 0.00000 3.19772 0.00000 0.00000 0.00000
63 19G 0 -0.02913 0.00000 0.00000 0.00000 0.00442
64 19G+1 0.00000 0.00483 0.00000 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00483 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00006
67 19G-2 0.00000 0.00000 -0.01365 0.00000 0.00000
68 19G+3 0.00000 0.01277 0.00000 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 -0.01277 0.00000
70 19G+4 -0.02462 0.00000 0.00000 0.00000 -0.00523
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 -0.37609 0.00000 0.00000 0.00000 -0.28205
73 20G+1 0.00000 -0.22813 0.00000 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.00000 -0.22813 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 -0.00374
76 20G-2 0.00000 0.00000 0.64525 0.00000 0.00000
77 20G+3 0.00000 -0.60357 0.00000 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.60357 0.00000
79 20G+4 -0.31786 0.00000 0.00000 0.00000 0.33373
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.02881 0.00000 0.00000
82 21H+1 0.00000 0.00000 0.00000 -0.04575 0.00000
83 21H-1 0.00000 -0.04575 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 0.07841
86 21H+3 0.00000 0.00000 0.00000 -0.09796 0.00000
87 21H-3 0.00000 0.09796 0.00000 0.00000 0.00000
88 21H+4 0.00000 0.00000 -0.10421 0.00000 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000 -0.00067
90 21H+5 0.00000 0.00000 0.00000 -0.00039 0.00000
91 21H-5 0.00000 -0.00039 0.00000 0.00000 0.00000
92 2 H 1S 0.02596 0.01218 0.01218 0.01218 0.00000
93 2S 0.44371 0.38104 0.38104 0.38104 0.00000
94 3S -4.81839 -10.52385 -10.52385 -10.52385 0.00000
95 4S 2.98998 -7.72916 -7.72916 -7.72916 0.00000
96 5S -0.02605 0.45636 0.45636 0.45636 0.00000
97 6PX -0.03045 -0.00897 -0.00897 0.03431 0.02056
98 6PY -0.03045 0.03431 -0.00897 -0.00897 0.01996
99 6PZ -0.03045 -0.00897 0.03431 -0.00897 -0.04052
100 7PX 0.15205 0.03136 0.03136 -0.21730 -0.11865
101 7PY 0.15205 -0.21730 0.03136 0.03136 -0.11518
102 7PZ 0.15205 0.03136 -0.21730 0.03136 0.23382
103 8PX 0.33667 2.01877 2.01877 3.97362 0.82984
104 8PY 0.33667 3.97362 2.01877 2.01877 0.80557
105 8PZ 0.33667 2.01877 3.97362 2.01877 -1.63541
106 9PX -0.69019 1.56265 1.56265 3.20116 1.17999
107 9PY -0.69019 3.20116 1.56265 1.56265 1.14548
108 9PZ -0.69019 1.56265 3.20116 1.56265 -2.32547
109 10D 0 0.00000 0.00206 -0.00413 0.00206 0.00746
110 10D+1 0.02465 0.00675 0.00241 0.00241 0.00909
111 10D-1 0.02465 0.00241 0.00241 0.00675 0.00936
112 10D+2 0.00000 0.00357 0.00000 -0.00357 -0.00006
113 10D-2 0.02465 0.00241 0.00675 0.00241 -0.01845
114 11D 0 0.00000 -0.01028 0.02057 -0.01028 -0.01752
115 11D+1 -0.23555 -0.18038 -0.15465 -0.15465 -0.04794
116 11D-1 -0.23555 -0.15465 -0.15465 -0.18038 -0.04939
117 11D+2 0.00000 -0.01781 0.00000 0.01781 0.00015
118 11D-2 -0.23555 -0.15465 -0.18038 -0.15465 0.09733
119 12D 0 0.00000 0.44629 -0.89258 0.44629 1.42848
120 12D+1 0.68557 -0.02452 -1.31190 -1.31190 0.58090
121 12D-1 0.68557 -1.31190 -1.31190 -0.02452 0.59840
122 12D+2 0.00000 0.77300 0.00000 -0.77300 -0.01224
123 12D-2 0.68557 -1.31190 -0.02452 -1.31190 -1.17929
124 13F 0 -0.00601 -0.01481 -0.01275 -0.01481 -0.00118
125 13F+1 0.00368 0.00688 0.01126 0.00781 -0.00649
126 13F-1 0.00368 0.00781 0.01126 0.00688 -0.00654
127 13F+2 0.00000 -0.00277 0.00000 0.00277 0.00008
128 13F-2 0.00546 0.01045 0.01045 0.01045 0.00000
129 13F+3 -0.00475 -0.01340 -0.01001 -0.01008 -0.00427
130 13F-3 0.00475 0.01008 0.01001 0.01340 0.00434
131 14F 0 0.01210 0.00907 0.06322 0.00907 -0.08993
132 14F+1 -0.00741 -0.07826 0.06716 -0.03871 -0.09474
133 14F-1 -0.00741 -0.03871 0.06716 -0.07826 -0.09459
134 14F+2 0.00000 -0.09197 0.00000 0.09197 0.00084
135 14F-2 0.02901 0.05799 0.05799 0.05799 0.00000
136 14F+3 0.00957 -0.04915 0.06349 0.04998 -0.01566
137 14F-3 -0.00957 -0.04998 -0.06349 0.04915 0.01723
138 15G 0 -0.00313 -0.00283 0.00244 -0.00283 -0.00307
139 15G+1 -0.00064 0.00282 -0.00739 0.00450 0.00761
140 15G-1 -0.00064 0.00450 -0.00739 0.00282 0.00759
141 15G+2 0.00000 0.00471 0.00000 -0.00471 -0.00004
142 15G-2 0.00181 0.00409 -0.00799 0.00409 0.00795
143 15G+3 -0.00169 0.00747 -0.00157 -0.00607 0.00131
144 15G-3 0.00169 0.00607 0.00157 -0.00747 -0.00144
145 15G+4 -0.00265 0.00117 -0.00506 0.00117 0.00363
146 15G-4 0.00000 0.00636 0.00000 -0.00636 -0.00007
147 3 H 1S 0.02596 -0.01218 0.01218 -0.01218 0.00000
148 2S 0.44371 -0.38104 0.38104 -0.38104 0.00000
149 3S -4.81839 10.52385 -10.52385 10.52385 0.00000
150 4S 2.98998 7.72916 -7.72916 7.72916 0.00000
151 5S -0.02605 -0.45636 0.45636 -0.45636 0.00000
152 6PX 0.03045 -0.00897 0.00897 0.03431 -0.02056
153 6PY 0.03045 0.03431 0.00897 -0.00897 -0.01996
154 6PZ -0.03045 0.00897 0.03431 0.00897 -0.04052
155 7PX -0.15205 0.03136 -0.03136 -0.21730 0.11865
156 7PY -0.15205 -0.21730 -0.03136 0.03136 0.11518
157 7PZ 0.15205 -0.03136 -0.21730 -0.03136 0.23382
158 8PX -0.33667 2.01877 -2.01877 3.97362 -0.82984
159 8PY -0.33667 3.97362 -2.01877 2.01877 -0.80557
160 8PZ 0.33667 -2.01877 3.97362 -2.01877 -1.63541
161 9PX 0.69019 1.56265 -1.56265 3.20116 -1.17999
162 9PY 0.69019 3.20116 -1.56265 1.56265 -1.14548
163 9PZ -0.69019 -1.56265 3.20116 -1.56265 -2.32547
164 10D 0 0.00000 -0.00206 -0.00413 -0.00206 0.00746
165 10D+1 -0.02465 0.00675 -0.00241 0.00241 -0.00909
166 10D-1 -0.02465 0.00241 -0.00241 0.00675 -0.00936
167 10D+2 0.00000 -0.00357 0.00000 0.00357 -0.00006
168 10D-2 0.02465 -0.00241 0.00675 -0.00241 -0.01845
169 11D 0 0.00000 0.01028 0.02057 0.01028 -0.01752
170 11D+1 0.23555 -0.18038 0.15465 -0.15465 0.04794
171 11D-1 0.23555 -0.15465 0.15465 -0.18038 0.04939
172 11D+2 0.00000 0.01781 0.00000 -0.01781 0.00015
173 11D-2 -0.23555 0.15465 -0.18038 0.15465 0.09733
174 12D 0 0.00000 -0.44629 -0.89258 -0.44629 1.42848
175 12D+1 -0.68557 -0.02452 1.31190 -1.31190 -0.58090
176 12D-1 -0.68557 -1.31190 1.31190 -0.02452 -0.59840
177 12D+2 0.00000 -0.77300 0.00000 0.77300 -0.01224
178 12D-2 0.68557 1.31190 -0.02452 1.31190 -1.17929
179 13F 0 -0.00601 0.01481 -0.01275 0.01481 -0.00118
180 13F+1 -0.00368 0.00688 -0.01126 0.00781 0.00649
181 13F-1 -0.00368 0.00781 -0.01126 0.00688 0.00654
182 13F+2 0.00000 0.00277 0.00000 -0.00277 0.00008
183 13F-2 0.00546 -0.01045 0.01045 -0.01045 0.00000
184 13F+3 0.00475 -0.01340 0.01001 -0.01008 0.00427
185 13F-3 -0.00475 0.01008 -0.01001 0.01340 -0.00434
186 14F 0 0.01210 -0.00907 0.06322 -0.00907 -0.08993
187 14F+1 0.00741 -0.07826 -0.06716 -0.03871 0.09474
188 14F-1 0.00741 -0.03871 -0.06716 -0.07826 0.09459
189 14F+2 0.00000 0.09197 0.00000 -0.09197 0.00084
190 14F-2 0.02901 -0.05799 0.05799 -0.05799 0.00000
191 14F+3 -0.00957 -0.04915 -0.06349 0.04998 0.01566
192 14F-3 0.00957 -0.04998 0.06349 0.04915 -0.01723
193 15G 0 -0.00313 0.00283 0.00244 0.00283 -0.00307
194 15G+1 0.00064 0.00282 0.00739 0.00450 -0.00761
195 15G-1 0.00064 0.00450 0.00739 0.00282 -0.00759
196 15G+2 0.00000 -0.00471 0.00000 0.00471 -0.00004
197 15G-2 0.00181 -0.00409 -0.00799 -0.00409 0.00795
198 15G+3 0.00169 0.00747 0.00157 -0.00607 -0.00131
199 15G-3 -0.00169 0.00607 -0.00157 -0.00747 0.00144
200 15G+4 -0.00265 -0.00117 -0.00506 -0.00117 0.00363
201 15G-4 0.00000 -0.00636 0.00000 0.00636 -0.00007
202 4 H 1S 0.02596 -0.01218 -0.01218 0.01218 0.00000
203 2S 0.44371 -0.38104 -0.38104 0.38104 0.00000
204 3S -4.81839 10.52385 10.52385 -10.52385 0.00000
205 4S 2.98998 7.72916 7.72916 -7.72916 0.00000
206 5S -0.02605 -0.45636 -0.45636 0.45636 0.00000
207 6PX -0.03045 0.00897 0.00897 0.03431 0.02056
208 6PY 0.03045 0.03431 -0.00897 0.00897 -0.01996
209 6PZ 0.03045 -0.00897 0.03431 0.00897 0.04052
210 7PX 0.15205 -0.03136 -0.03136 -0.21730 -0.11865
211 7PY -0.15205 -0.21730 0.03136 -0.03136 0.11518
212 7PZ -0.15205 0.03136 -0.21730 -0.03136 -0.23382
213 8PX 0.33667 -2.01877 -2.01877 3.97362 0.82984
214 8PY -0.33667 3.97362 2.01877 -2.01877 -0.80557
215 8PZ -0.33667 2.01877 3.97362 -2.01877 1.63541
216 9PX -0.69019 -1.56265 -1.56265 3.20116 1.17999
217 9PY 0.69019 3.20116 1.56265 -1.56265 -1.14548
218 9PZ 0.69019 1.56265 3.20116 -1.56265 2.32547
219 10D 0 0.00000 -0.00206 0.00413 0.00206 0.00746
220 10D+1 -0.02465 0.00675 0.00241 -0.00241 -0.00909
221 10D-1 0.02465 -0.00241 -0.00241 0.00675 0.00936
222 10D+2 0.00000 -0.00357 0.00000 -0.00357 -0.00006
223 10D-2 -0.02465 0.00241 0.00675 -0.00241 0.01845
224 11D 0 0.00000 0.01028 -0.02057 -0.01028 -0.01752
225 11D+1 0.23555 -0.18038 -0.15465 0.15465 0.04794
226 11D-1 -0.23555 0.15465 0.15465 -0.18038 -0.04939
227 11D+2 0.00000 0.01781 0.00000 0.01781 0.00015
228 11D-2 0.23555 -0.15465 -0.18038 0.15465 -0.09733
229 12D 0 0.00000 -0.44629 0.89258 0.44629 1.42848
230 12D+1 -0.68557 -0.02452 -1.31190 1.31190 -0.58090
231 12D-1 0.68557 1.31190 1.31190 -0.02452 0.59840
232 12D+2 0.00000 -0.77300 0.00000 -0.77300 -0.01224
233 12D-2 -0.68557 -1.31190 -0.02452 1.31190 1.17929
234 13F 0 0.00601 -0.01481 -0.01275 0.01481 0.00118
235 13F+1 0.00368 -0.00688 -0.01126 0.00781 -0.00649
236 13F-1 -0.00368 0.00781 0.01126 -0.00688 0.00654
237 13F+2 0.00000 -0.00277 0.00000 -0.00277 -0.00008
238 13F-2 0.00546 -0.01045 -0.01045 0.01045 0.00000
239 13F+3 -0.00475 0.01340 0.01001 -0.01008 -0.00427
240 13F-3 -0.00475 0.01008 0.01001 -0.01340 -0.00434
241 14F 0 -0.01210 0.00907 0.06322 -0.00907 0.08993
242 14F+1 -0.00741 0.07826 -0.06716 -0.03871 -0.09474
243 14F-1 0.00741 -0.03871 0.06716 0.07826 0.09459
244 14F+2 0.00000 -0.09197 0.00000 -0.09197 -0.00084
245 14F-2 0.02901 -0.05799 -0.05799 0.05799 0.00000
246 14F+3 0.00957 0.04915 -0.06349 0.04998 -0.01566
247 14F-3 0.00957 -0.04998 -0.06349 -0.04915 -0.01723
248 15G 0 -0.00313 0.00283 -0.00244 -0.00283 -0.00307
249 15G+1 0.00064 0.00282 -0.00739 -0.00450 -0.00761
250 15G-1 -0.00064 -0.00450 0.00739 0.00282 0.00759
251 15G+2 0.00000 -0.00471 0.00000 -0.00471 -0.00004
252 15G-2 -0.00181 0.00409 -0.00799 -0.00409 -0.00795
253 15G+3 0.00169 0.00747 -0.00157 0.00607 -0.00131
254 15G-3 0.00169 -0.00607 -0.00157 -0.00747 -0.00144
255 15G+4 -0.00265 -0.00117 0.00506 0.00117 0.00363
256 15G-4 0.00000 0.00636 0.00000 0.00636 0.00007
257 5 H 1S 0.02596 0.01218 -0.01218 -0.01218 0.00000
258 2S 0.44371 0.38104 -0.38104 -0.38104 0.00000
259 3S -4.81839 -10.52385 10.52385 10.52385 0.00000
260 4S 2.98998 -7.72916 7.72916 7.72916 0.00000
261 5S -0.02605 0.45636 -0.45636 -0.45636 0.00000
262 6PX 0.03045 0.00897 -0.00897 0.03431 -0.02056
263 6PY -0.03045 0.03431 0.00897 0.00897 0.01996
264 6PZ 0.03045 0.00897 0.03431 -0.00897 0.04052
265 7PX -0.15205 -0.03136 0.03136 -0.21730 0.11865
266 7PY 0.15205 -0.21730 -0.03136 -0.03136 -0.11518
267 7PZ -0.15205 -0.03136 -0.21730 0.03136 -0.23382
268 8PX -0.33667 -2.01877 2.01877 3.97362 -0.82984
269 8PY 0.33667 3.97362 -2.01877 -2.01877 0.80557
270 8PZ -0.33667 -2.01877 3.97362 2.01877 1.63541
271 9PX 0.69019 -1.56265 1.56265 3.20116 -1.17999
272 9PY -0.69019 3.20116 -1.56265 -1.56265 1.14548
273 9PZ 0.69019 -1.56265 3.20116 1.56265 2.32547
274 10D 0 0.00000 0.00206 0.00413 -0.00206 0.00746
275 10D+1 0.02465 0.00675 -0.00241 -0.00241 0.00909
276 10D-1 -0.02465 -0.00241 0.00241 0.00675 -0.00936
277 10D+2 0.00000 0.00357 0.00000 0.00357 -0.00006
278 10D-2 -0.02465 -0.00241 0.00675 0.00241 0.01845
279 11D 0 0.00000 -0.01028 -0.02057 0.01028 -0.01752
280 11D+1 -0.23555 -0.18038 0.15465 0.15465 -0.04794
281 11D-1 0.23555 0.15465 -0.15465 -0.18038 0.04939
282 11D+2 0.00000 -0.01781 0.00000 -0.01781 0.00015
283 11D-2 0.23555 0.15465 -0.18038 -0.15465 -0.09733
284 12D 0 0.00000 0.44629 0.89258 -0.44629 1.42848
285 12D+1 0.68557 -0.02452 1.31190 1.31190 0.58090
286 12D-1 -0.68557 1.31190 -1.31190 -0.02452 -0.59840
287 12D+2 0.00000 0.77300 0.00000 0.77300 -0.01224
288 12D-2 -0.68557 1.31190 -0.02452 -1.31190 1.17929
289 13F 0 0.00601 0.01481 -0.01275 -0.01481 0.00118
290 13F+1 -0.00368 -0.00688 0.01126 0.00781 0.00649
291 13F-1 0.00368 0.00781 -0.01126 -0.00688 -0.00654
292 13F+2 0.00000 0.00277 0.00000 0.00277 -0.00008
293 13F-2 0.00546 0.01045 -0.01045 -0.01045 0.00000
294 13F+3 0.00475 0.01340 -0.01001 -0.01008 0.00427
295 13F-3 0.00475 0.01008 -0.01001 -0.01340 0.00434
296 14F 0 -0.01210 -0.00907 0.06322 0.00907 0.08993
297 14F+1 0.00741 0.07826 0.06716 -0.03871 0.09474
298 14F-1 -0.00741 -0.03871 -0.06716 0.07826 -0.09459
299 14F+2 0.00000 0.09197 0.00000 0.09197 -0.00084
300 14F-2 0.02901 0.05799 -0.05799 -0.05799 0.00000
301 14F+3 -0.00957 0.04915 0.06349 0.04998 0.01566
302 14F-3 -0.00957 -0.04998 0.06349 -0.04915 0.01723
303 15G 0 -0.00313 -0.00283 -0.00244 0.00283 -0.00307
304 15G+1 -0.00064 0.00282 0.00739 -0.00450 0.00761
305 15G-1 0.00064 -0.00450 -0.00739 0.00282 -0.00759
306 15G+2 0.00000 0.00471 0.00000 0.00471 -0.00004
307 15G-2 -0.00181 -0.00409 -0.00799 0.00409 -0.00795
308 15G+3 -0.00169 0.00747 0.00157 0.00607 0.00131
309 15G-3 -0.00169 -0.00607 0.00157 -0.00747 0.00144
310 15G+4 -0.00265 0.00117 0.00506 -0.00117 0.00363
311 15G-4 0.00000 -0.00636 0.00000 -0.00636 0.00007
86 87 88 89 90
(E)--V (T2)--V (T2)--V (T2)--V (T1)--V
Eigenvalues -- 3.30216 3.46221 3.46221 3.46221 3.73727
1 1 C 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 -0.06995 0.00000 0.00000
8 7PY 0.00000 -0.06995 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 -0.06995 0.00000
10 8PX 0.00000 0.00000 -0.72762 0.00000 0.00000
11 8PY 0.00000 -0.72762 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 -0.72762 0.00000
13 9PX 0.00000 0.00000 7.36774 0.00000 0.00000
14 9PY 0.00000 7.36774 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 7.36774 0.00000
16 10PX 0.00000 0.00000 -4.80655 0.00000 0.00000
17 10PY 0.00000 -4.80655 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 -4.80655 0.00000
19 11PX 0.00000 0.00000 -0.00755 0.00000 0.00000
20 11PY 0.00000 -0.00755 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 -0.00755 0.00000
22 12D 0 0.00046 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 -0.01770 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 -0.01770 0.00000 0.00000
25 12D+2 0.05413 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 -0.01770 0.00000
27 13D 0 -0.00092 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.09300 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.09300 0.00000 0.00000
30 13D+2 -0.10736 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.09300 0.00000
32 14D 0 0.05384 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 6.98972 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 6.98972 0.00000 0.00000
35 14D+2 6.28337 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 6.98972 0.00000
37 15D 0 0.04356 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 1.11105 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.00000 1.11105 0.00000 0.00000
40 15D+2 5.08338 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 1.11105 0.00000
42 16F 0 0.00000 0.00000 0.00000 -0.01121 0.00000
43 16F+1 0.00000 0.00000 0.00686 0.00000 -0.06845
44 16F-1 0.00000 0.00686 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 -0.00886 0.00000 -0.05302
48 16F-3 0.00000 0.00886 0.00000 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 -0.37901 0.00000
50 17F+1 0.00000 0.00000 0.23210 0.00000 0.72205
51 17F-1 0.00000 0.23210 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 -0.29964 0.00000 0.55930
55 17F-3 0.00000 0.29964 0.00000 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 -2.98151 0.00000
57 18F+1 0.00000 0.00000 1.82579 0.00000 2.25536
58 18F-1 0.00000 1.82579 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 -2.35709 0.00000 1.74699
62 18F-3 0.00000 2.35709 0.00000 0.00000 0.00000
63 19G 0 0.00004 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 -0.02489 0.00000 0.00000 0.00000
65 19G-1 0.00000 0.00000 -0.02489 0.00000 -0.05184
66 19G+2 -0.00685 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.07040 0.00000
68 19G+3 0.00000 -0.06585 0.00000 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.06585 0.00000 -0.01959
70 19G+4 -0.00004 0.00000 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 -0.00242 0.00000 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.19987 0.00000 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.19987 0.00000 1.58926
75 20G+2 0.43695 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 -0.56531 0.00000
77 20G+3 0.00000 0.52880 0.00000 0.00000 0.00000
78 20G-3 0.00000 0.00000 -0.52880 0.00000 0.60068
79 20G+4 0.00286 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 0.11915 0.00000
82 21H+1 0.00000 0.00000 0.04021 0.00000 0.03939
83 21H-1 0.00000 0.04021 0.00000 0.00000 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 21H-2 0.00067 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.00000 0.00000 -0.08658 0.00000 -0.01823
87 21H-3 0.00000 0.08658 0.00000 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 -0.03051 0.00000
89 21H-4 0.07841 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00000 0.00000 0.07756 0.00000 -0.04077
91 21H-5 0.00000 0.07756 0.00000 0.00000 0.00000
92 2 H 1S 0.00000 -0.01302 -0.01302 -0.01302 0.00000
93 2S 0.00000 0.06690 0.06690 0.06690 0.00000
94 3S 0.00000 -5.74212 -5.74212 -5.74212 0.00000
95 4S 0.00000 2.44024 2.44024 2.44024 0.00000
96 5S 0.00000 -0.22058 -0.22058 -0.22058 0.00000
97 6PX -0.03492 0.01547 0.02337 0.01547 0.00000
98 6PY 0.03526 0.02337 0.01547 0.01547 0.00285
99 6PZ -0.00035 0.01547 0.01547 0.02337 -0.00285
100 7PX 0.20150 -0.13115 -0.21209 -0.13115 0.00000
101 7PY -0.20350 -0.21209 -0.13115 -0.13115 -0.05795
102 7PZ 0.00200 -0.13115 -0.13115 -0.21209 0.05795
103 8PX -1.40930 1.43202 2.85517 1.43202 0.00000
104 8PY 1.42331 2.85517 1.43202 1.43202 1.34593
105 8PZ -0.01401 1.43202 1.43202 2.85517 -1.34593
106 9PX -2.00396 -1.00941 0.57932 -1.00941 0.00000
107 9PY 2.02388 0.57932 -1.00941 -1.00941 0.59821
108 9PZ -0.01993 -1.00941 -1.00941 0.57932 -0.59821
109 10D 0 0.00006 -0.00658 -0.00658 0.01315 -0.05148
110 10D+1 0.01606 0.00630 0.03522 0.03522 -0.02525
111 10D-1 -0.01590 0.03522 0.00630 0.03522 0.00000
112 10D+2 0.00746 -0.01139 0.01139 0.00000 -0.02972
113 10D-2 -0.00016 0.03522 0.03522 0.00630 0.02525
114 11D 0 -0.00015 0.06906 0.06906 -0.13812 0.34633
115 11D+1 -0.08470 -0.04314 -0.24530 -0.24530 0.19145
116 11D-1 0.08387 -0.24530 -0.04314 -0.24530 0.00000
117 11D+2 -0.01752 0.11961 -0.11961 0.00000 0.19995
118 11D-2 0.00083 -0.24530 -0.24530 -0.04314 -0.19145
119 12D 0 0.01224 0.21987 0.21987 -0.43974 0.56239
120 12D+1 1.02635 0.21327 -0.51569 -0.51569 0.34789
121 12D-1 -1.01624 -0.51569 0.21327 -0.51569 0.00000
122 12D+2 1.42848 0.38082 -0.38082 0.00000 0.32470
123 12D-2 -0.01010 -0.51569 -0.51569 0.21327 -0.34789
124 13F 0 -0.00001 0.00221 0.00221 0.02367 0.01326
125 13F+1 -0.00299 -0.00062 -0.01450 -0.00209 0.01946
126 13F-1 0.00288 -0.01450 -0.00062 -0.00209 -0.00229
127 13F+2 -0.00899 0.00093 -0.00093 0.00000 -0.01316
128 13F-2 0.00000 0.00747 0.00747 0.00747 0.00000
129 13F+3 -0.00360 0.00232 0.01871 0.00118 0.01507
130 13F-3 -0.00352 -0.01871 -0.00232 -0.00118 0.01854
131 14F 0 -0.00077 -0.11295 -0.11295 -0.15863 -0.10886
132 14F+1 0.00813 -0.03951 0.09714 0.17784 -0.39291
133 14F-1 -0.00975 0.09714 -0.03951 0.17784 -0.12932
134 14F+2 -0.09805 -0.13746 0.13746 0.00000 -0.07925
135 14F-2 0.00000 0.08403 0.08403 0.08403 0.00000
136 14F+3 -0.09173 -0.17347 -0.12541 -0.00511 -0.30435
137 14F-3 -0.09145 0.12541 0.17347 0.00511 -0.03753
138 15G 0 -0.00003 0.00050 0.00050 0.00055 -0.01090
139 15G+1 -0.00108 0.00271 0.00403 -0.00339 -0.00030
140 15G-1 0.00121 0.00403 0.00271 -0.00339 0.00191
141 15G+2 0.00475 0.00005 -0.00005 0.00000 0.00975
142 15G-2 0.00007 -0.00091 -0.00091 -0.00768 0.00939
143 15G+3 0.00780 0.00718 -0.00055 0.00226 0.01015
144 15G-3 0.00778 0.00055 -0.00718 -0.00226 0.00072
145 15G+4 0.00003 0.00046 0.00046 0.00039 0.01290
146 15G-4 0.00765 0.00396 -0.00396 0.00000 -0.00387
147 3 H 1S 0.00000 0.01302 0.01302 -0.01302 0.00000
148 2S 0.00000 -0.06690 -0.06690 0.06690 0.00000
149 3S 0.00000 5.74212 5.74212 -5.74212 0.00000
150 4S 0.00000 -2.44024 -2.44024 2.44024 0.00000
151 5S 0.00000 0.22058 0.22058 -0.22058 0.00000
152 6PX 0.03492 0.01547 0.02337 -0.01547 0.00000
153 6PY -0.03526 0.02337 0.01547 -0.01547 0.00285
154 6PZ -0.00035 -0.01547 -0.01547 0.02337 0.00285
155 7PX -0.20150 -0.13115 -0.21209 0.13115 0.00000
156 7PY 0.20350 -0.21209 -0.13115 0.13115 -0.05795
157 7PZ 0.00200 0.13115 0.13115 -0.21209 -0.05795
158 8PX 1.40930 1.43202 2.85517 -1.43202 0.00000
159 8PY -1.42331 2.85517 1.43202 -1.43202 1.34593
160 8PZ -0.01401 -1.43202 -1.43202 2.85517 1.34593
161 9PX 2.00396 -1.00941 0.57932 1.00941 0.00000
162 9PY -2.02388 0.57932 -1.00941 1.00941 0.59821
163 9PZ -0.01993 1.00941 1.00941 0.57932 0.59821
164 10D 0 0.00006 0.00658 0.00658 0.01315 0.05148
165 10D+1 -0.01606 0.00630 0.03522 -0.03522 -0.02525
166 10D-1 0.01590 0.03522 0.00630 -0.03522 0.00000
167 10D+2 0.00746 0.01139 -0.01139 0.00000 0.02972
168 10D-2 -0.00016 -0.03522 -0.03522 0.00630 -0.02525
169 11D 0 -0.00015 -0.06906 -0.06906 -0.13812 -0.34633
170 11D+1 0.08470 -0.04314 -0.24530 0.24530 0.19145
171 11D-1 -0.08387 -0.24530 -0.04314 0.24530 0.00000
172 11D+2 -0.01752 -0.11961 0.11961 0.00000 -0.19995
173 11D-2 0.00083 0.24530 0.24530 -0.04314 0.19145
174 12D 0 0.01224 -0.21987 -0.21987 -0.43974 -0.56239
175 12D+1 -1.02635 0.21327 -0.51569 0.51569 0.34789
176 12D-1 1.01624 -0.51569 0.21327 0.51569 0.00000
177 12D+2 1.42848 -0.38082 0.38082 0.00000 -0.32470
178 12D-2 -0.01010 0.51569 0.51569 0.21327 0.34789
179 13F 0 -0.00001 -0.00221 -0.00221 0.02367 -0.01326
180 13F+1 0.00299 -0.00062 -0.01450 0.00209 0.01946
181 13F-1 -0.00288 -0.01450 -0.00062 0.00209 -0.00229
182 13F+2 -0.00899 -0.00093 0.00093 0.00000 0.01316
183 13F-2 0.00000 -0.00747 -0.00747 0.00747 0.00000
184 13F+3 0.00360 0.00232 0.01871 -0.00118 0.01507
185 13F-3 0.00352 -0.01871 -0.00232 0.00118 0.01854
186 14F 0 -0.00077 0.11295 0.11295 -0.15863 0.10886
187 14F+1 -0.00813 -0.03951 0.09714 -0.17784 -0.39291
188 14F-1 0.00975 0.09714 -0.03951 -0.17784 -0.12932
189 14F+2 -0.09805 0.13746 -0.13746 0.00000 0.07925
190 14F-2 0.00000 -0.08403 -0.08403 0.08403 0.00000
191 14F+3 0.09173 -0.17347 -0.12541 0.00511 -0.30435
192 14F-3 0.09145 0.12541 0.17347 -0.00511 -0.03753
193 15G 0 -0.00003 -0.00050 -0.00050 0.00055 0.01090
194 15G+1 0.00108 0.00271 0.00403 0.00339 -0.00030
195 15G-1 -0.00121 0.00403 0.00271 0.00339 0.00191
196 15G+2 0.00475 -0.00005 0.00005 0.00000 -0.00975
197 15G-2 0.00007 0.00091 0.00091 -0.00768 -0.00939
198 15G+3 -0.00780 0.00718 -0.00055 -0.00226 0.01015
199 15G-3 -0.00778 0.00055 -0.00718 0.00226 0.00072
200 15G+4 0.00003 -0.00046 -0.00046 0.00039 -0.01290
201 15G-4 0.00765 -0.00396 0.00396 0.00000 0.00387
202 4 H 1S 0.00000 0.01302 -0.01302 0.01302 0.00000
203 2S 0.00000 -0.06690 0.06690 -0.06690 0.00000
204 3S 0.00000 5.74212 -5.74212 5.74212 0.00000
205 4S 0.00000 -2.44024 2.44024 -2.44024 0.00000
206 5S 0.00000 0.22058 -0.22058 0.22058 0.00000
207 6PX -0.03492 -0.01547 0.02337 -0.01547 0.00000
208 6PY -0.03526 0.02337 -0.01547 0.01547 -0.00285
209 6PZ 0.00035 0.01547 -0.01547 0.02337 0.00285
210 7PX 0.20150 0.13115 -0.21209 0.13115 0.00000
211 7PY 0.20350 -0.21209 0.13115 -0.13115 0.05795
212 7PZ -0.00200 -0.13115 0.13115 -0.21209 -0.05795
213 8PX -1.40930 -1.43202 2.85517 -1.43202 0.00000
214 8PY -1.42331 2.85517 -1.43202 1.43202 -1.34593
215 8PZ 0.01401 1.43202 -1.43202 2.85517 1.34593
216 9PX -2.00396 1.00941 0.57932 1.00941 0.00000
217 9PY -2.02388 0.57932 1.00941 -1.00941 -0.59821
218 9PZ 0.01993 -1.00941 1.00941 0.57932 0.59821
219 10D 0 0.00006 0.00658 -0.00658 -0.01315 -0.05148
220 10D+1 -0.01606 0.00630 -0.03522 0.03522 0.02525
221 10D-1 -0.01590 -0.03522 0.00630 -0.03522 0.00000
222 10D+2 0.00746 0.01139 0.01139 0.00000 -0.02972
223 10D-2 0.00016 0.03522 -0.03522 0.00630 -0.02525
224 11D 0 -0.00015 -0.06906 0.06906 0.13812 0.34633
225 11D+1 0.08470 -0.04314 0.24530 -0.24530 -0.19145
226 11D-1 0.08387 0.24530 -0.04314 0.24530 0.00000
227 11D+2 -0.01752 -0.11961 -0.11961 0.00000 0.19995
228 11D-2 -0.00083 -0.24530 0.24530 -0.04314 0.19145
229 12D 0 0.01224 -0.21987 0.21987 0.43974 0.56239
230 12D+1 -1.02635 0.21327 0.51569 -0.51569 -0.34789
231 12D-1 -1.01624 0.51569 0.21327 0.51569 0.00000
232 12D+2 1.42848 -0.38082 -0.38082 0.00000 0.32470
233 12D-2 0.01010 -0.51569 0.51569 0.21327 0.34789
234 13F 0 0.00001 0.00221 -0.00221 0.02367 -0.01326
235 13F+1 -0.00299 0.00062 -0.01450 0.00209 0.01946
236 13F-1 -0.00288 -0.01450 0.00062 -0.00209 0.00229
237 13F+2 0.00899 0.00093 0.00093 0.00000 0.01316
238 13F-2 0.00000 -0.00747 0.00747 -0.00747 0.00000
239 13F+3 -0.00360 -0.00232 0.01871 -0.00118 0.01507
240 13F-3 0.00352 -0.01871 0.00232 -0.00118 -0.01854
241 14F 0 0.00077 -0.11295 0.11295 -0.15863 0.10886
242 14F+1 0.00813 0.03951 0.09714 -0.17784 -0.39291
243 14F-1 0.00975 0.09714 0.03951 0.17784 0.12932
244 14F+2 0.09805 -0.13746 -0.13746 0.00000 0.07925
245 14F-2 0.00000 -0.08403 0.08403 -0.08403 0.00000
246 14F+3 -0.09173 0.17347 -0.12541 0.00511 -0.30435
247 14F-3 0.09145 0.12541 -0.17347 0.00511 0.03753
248 15G 0 -0.00003 -0.00050 0.00050 -0.00055 -0.01090
249 15G+1 0.00108 0.00271 -0.00403 -0.00339 0.00030
250 15G-1 0.00121 -0.00403 0.00271 0.00339 0.00191
251 15G+2 0.00475 -0.00005 -0.00005 0.00000 0.00975
252 15G-2 -0.00007 -0.00091 0.00091 -0.00768 -0.00939
253 15G+3 -0.00780 0.00718 0.00055 0.00226 -0.01015
254 15G-3 0.00778 -0.00055 -0.00718 0.00226 0.00072
255 15G+4 0.00003 -0.00046 0.00046 -0.00039 0.01290
256 15G-4 -0.00765 0.00396 0.00396 0.00000 0.00387
257 5 H 1S 0.00000 -0.01302 0.01302 0.01302 0.00000
258 2S 0.00000 0.06690 -0.06690 -0.06690 0.00000
259 3S 0.00000 -5.74212 5.74212 5.74212 0.00000
260 4S 0.00000 2.44024 -2.44024 -2.44024 0.00000
261 5S 0.00000 -0.22058 0.22058 0.22058 0.00000
262 6PX 0.03492 -0.01547 0.02337 0.01547 0.00000
263 6PY 0.03526 0.02337 -0.01547 -0.01547 -0.00285
264 6PZ 0.00035 -0.01547 0.01547 0.02337 -0.00285
265 7PX -0.20150 0.13115 -0.21209 -0.13115 0.00000
266 7PY -0.20350 -0.21209 0.13115 0.13115 0.05795
267 7PZ -0.00200 0.13115 -0.13115 -0.21209 0.05795
268 8PX 1.40930 -1.43202 2.85517 1.43202 0.00000
269 8PY 1.42331 2.85517 -1.43202 -1.43202 -1.34593
270 8PZ 0.01401 -1.43202 1.43202 2.85517 -1.34593
271 9PX 2.00396 1.00941 0.57932 -1.00941 0.00000
272 9PY 2.02388 0.57932 1.00941 1.00941 -0.59821
273 9PZ 0.01993 1.00941 -1.00941 0.57932 -0.59821
274 10D 0 0.00006 -0.00658 0.00658 -0.01315 0.05148
275 10D+1 0.01606 0.00630 -0.03522 -0.03522 0.02525
276 10D-1 0.01590 -0.03522 0.00630 0.03522 0.00000
277 10D+2 0.00746 -0.01139 -0.01139 0.00000 0.02972
278 10D-2 0.00016 -0.03522 0.03522 0.00630 0.02525
279 11D 0 -0.00015 0.06906 -0.06906 0.13812 -0.34633
280 11D+1 -0.08470 -0.04314 0.24530 0.24530 -0.19145
281 11D-1 -0.08387 0.24530 -0.04314 -0.24530 0.00000
282 11D+2 -0.01752 0.11961 0.11961 0.00000 -0.19995
283 11D-2 -0.00083 0.24530 -0.24530 -0.04314 -0.19145
284 12D 0 0.01224 0.21987 -0.21987 0.43974 -0.56239
285 12D+1 1.02635 0.21327 0.51569 0.51569 -0.34789
286 12D-1 1.01624 0.51569 0.21327 -0.51569 0.00000
287 12D+2 1.42848 0.38082 0.38082 0.00000 -0.32470
288 12D-2 0.01010 0.51569 -0.51569 0.21327 -0.34789
289 13F 0 0.00001 -0.00221 0.00221 0.02367 0.01326
290 13F+1 0.00299 0.00062 -0.01450 -0.00209 0.01946
291 13F-1 0.00288 -0.01450 0.00062 0.00209 0.00229
292 13F+2 0.00899 -0.00093 -0.00093 0.00000 -0.01316
293 13F-2 0.00000 0.00747 -0.00747 -0.00747 0.00000
294 13F+3 0.00360 -0.00232 0.01871 0.00118 0.01507
295 13F-3 -0.00352 -0.01871 0.00232 0.00118 -0.01854
296 14F 0 0.00077 0.11295 -0.11295 -0.15863 -0.10886
297 14F+1 -0.00813 0.03951 0.09714 0.17784 -0.39291
298 14F-1 -0.00975 0.09714 0.03951 -0.17784 0.12932
299 14F+2 0.09805 0.13746 0.13746 0.00000 -0.07925
300 14F-2 0.00000 0.08403 -0.08403 -0.08403 0.00000
301 14F+3 0.09173 0.17347 -0.12541 -0.00511 -0.30435
302 14F-3 -0.09145 0.12541 -0.17347 -0.00511 0.03753
303 15G 0 -0.00003 0.00050 -0.00050 -0.00055 0.01090
304 15G+1 -0.00108 0.00271 -0.00403 0.00339 0.00030
305 15G-1 -0.00121 -0.00403 0.00271 -0.00339 0.00191
306 15G+2 0.00475 0.00005 0.00005 0.00000 -0.00975
307 15G-2 -0.00007 0.00091 -0.00091 -0.00768 0.00939
308 15G+3 0.00780 0.00718 0.00055 -0.00226 -0.01015
309 15G-3 -0.00778 -0.00055 -0.00718 -0.00226 0.00072
310 15G+4 0.00003 0.00046 -0.00046 -0.00039 -0.01290
311 15G-4 -0.00765 -0.00396 -0.00396 0.00000 -0.00387
91 92 93 94 95
(T1)--V (T1)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 3.73727 3.73727 3.77309 3.77309 3.77309
1 1 C 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 0.00000 0.00000 0.02256
8 7PY 0.00000 0.00000 0.00000 0.02256 0.00000
9 7PZ 0.00000 0.00000 0.02256 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 0.00000 -3.55639
11 8PY 0.00000 0.00000 0.00000 -3.55639 0.00000
12 8PZ 0.00000 0.00000 -3.55639 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 34.21437
14 9PY 0.00000 0.00000 0.00000 34.21437 0.00000
15 9PZ 0.00000 0.00000 34.21437 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 29.27470
17 10PY 0.00000 0.00000 0.00000 29.27470 0.00000
18 10PZ 0.00000 0.00000 29.27470 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 0.11285
20 11PY 0.00000 0.00000 0.00000 0.11285 0.00000
21 11PZ 0.00000 0.00000 0.11285 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 -0.13518 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 -0.13518
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 -0.13518 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 -0.00071 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 -0.00071
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 -0.00071 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 15.36606 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 15.36606
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 15.36606 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 7.44501 0.00000
39 15D-1 0.00000 0.00000 0.00000 0.00000 7.44501
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 7.44501 0.00000 0.00000
42 16F 0 0.00000 0.00000 0.14019 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.00000 0.00000 -0.08585
44 16F-1 0.00000 -0.06845 0.00000 -0.08585 0.00000
45 16F+2 -0.08658 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 0.11083
48 16F-3 0.00000 0.05302 0.00000 -0.11083 0.00000
49 17F 0 0.00000 0.00000 -2.05762 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.00000 0.00000 1.26003
51 17F-1 0.00000 0.72205 0.00000 1.26003 0.00000
52 17F+2 0.91333 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 -1.62669
55 17F-3 0.00000 -0.55930 0.00000 1.62669 0.00000
56 18F 0 0.00000 0.00000 -1.91955 0.00000 0.00000
57 18F+1 0.00000 0.00000 0.00000 0.00000 1.17548
58 18F-1 0.00000 2.25536 0.00000 1.17548 0.00000
59 18F+2 2.85282 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 -1.51754
62 18F-3 0.00000 -1.74699 0.00000 1.51754 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 -0.05184 0.00000 -0.04213 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00000 -0.04213
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.11915 0.00000 0.00000
68 19G+3 0.00000 0.01959 0.00000 -0.11146 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.11146
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
71 19G-4 -0.05541 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 1.58926 0.00000 -0.74789 0.00000
74 20G-1 0.00000 0.00000 0.00000 0.00000 -0.74789
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 2.11534 0.00000 0.00000
77 20G+3 0.00000 -0.60068 0.00000 -1.97872 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.00000 1.97872
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
80 20G-4 1.69899 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 0.00000 -0.09331 0.00000 0.00000
82 21H+1 0.00000 0.00000 0.00000 0.00000 -0.16019
83 21H-1 0.00000 0.03939 0.00000 -0.16019 0.00000
84 21H+2 -0.05955 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 -0.11093
87 21H-3 0.00000 0.01823 0.00000 0.11093 0.00000
88 21H+4 0.00000 0.00000 -0.20078 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 -0.10515
91 21H-5 0.00000 -0.04077 0.00000 -0.10515 0.00000
92 2 H 1S 0.00000 0.00000 0.01569 0.01569 0.01569
93 2S 0.00000 0.00000 1.64720 1.64720 1.64720
94 3S 0.00000 0.00000 -20.14718 -20.14718 -20.14718
95 4S 0.00000 0.00000 -17.80944 -17.80944 -17.80944
96 5S 0.00000 0.00000 0.77956 0.77956 0.77956
97 6PX -0.00285 0.00285 -0.00460 -0.00460 -0.03023
98 6PY 0.00285 0.00000 -0.00460 -0.03023 -0.00460
99 6PZ 0.00000 -0.00285 -0.03023 -0.00460 -0.00460
100 7PX 0.05795 -0.05795 -0.06709 -0.06709 0.08905
101 7PY -0.05795 0.00000 -0.06709 0.08905 -0.06709
102 7PZ 0.00000 0.05795 0.08905 -0.06709 -0.06709
103 8PX -1.34593 1.34593 5.49128 5.49128 4.12882
104 8PY 1.34593 0.00000 5.49128 4.12882 5.49128
105 8PZ 0.00000 -1.34593 4.12882 5.49128 5.49128
106 9PX -0.59821 0.59821 5.15296 5.15296 3.84237
107 9PY 0.59821 0.00000 5.15296 3.84237 5.15296
108 9PZ 0.00000 -0.59821 3.84237 5.15296 5.15296
109 10D 0 0.00000 -0.05148 -0.00494 0.00247 0.00247
110 10D+1 -0.02525 0.00000 0.04900 0.04091 0.04900
111 10D-1 0.02525 -0.02525 0.04900 0.04900 0.04091
112 10D+2 -0.05944 0.02972 0.00000 0.00428 -0.00428
113 10D-2 0.00000 0.02525 0.04091 0.04900 0.04900
114 11D 0 0.00000 0.34633 0.05654 -0.02827 -0.02827
115 11D+1 0.19145 0.00000 -0.57025 -0.53708 -0.57025
116 11D-1 -0.19145 0.19145 -0.57025 -0.57025 -0.53708
117 11D+2 0.39991 -0.19995 0.00000 -0.04896 0.04896
118 11D-2 0.00000 -0.19145 -0.53708 -0.57025 -0.57025
119 12D 0 0.00000 0.56239 0.68194 -0.34097 -0.34097
120 12D+1 0.34789 0.00000 -1.11383 -2.07518 -1.11383
121 12D-1 -0.34789 0.34789 -1.11383 -1.11383 -2.07518
122 12D+2 0.64939 -0.32470 0.00000 -0.59057 0.59057
123 12D-2 0.00000 -0.34789 -2.07518 -1.11383 -1.11383
124 13F 0 0.00000 0.01326 -0.00516 -0.01142 -0.01142
125 13F+1 -0.01853 -0.00229 0.00797 0.00601 0.00316
126 13F-1 0.01853 0.01946 0.00797 0.00316 0.00601
127 13F+2 0.02461 0.01316 0.00000 -0.00124 0.00124
128 13F-2 0.00000 0.00000 0.03792 0.03792 0.03792
129 13F+3 0.00242 -0.01854 -0.00827 -0.00979 -0.00408
130 13F-3 0.00242 -0.01507 0.00827 0.00408 0.00979
131 14F 0 0.00000 -0.10886 -0.27360 -0.13961 -0.13961
132 14F+1 0.00400 -0.12932 -0.00243 0.17342 0.16754
133 14F-1 -0.00400 -0.39291 -0.00243 0.16754 0.17342
134 14F+2 -0.49700 0.07925 0.00000 0.11122 -0.11122
135 14F-2 0.00000 0.00000 0.20282 0.20282 0.20282
136 14F+3 -0.13459 0.03753 -0.17848 -0.04227 -0.21630
137 14F-3 -0.13459 0.30435 0.17848 0.21630 0.04227
138 15G 0 0.00000 -0.01090 0.00554 0.01117 0.01117
139 15G+1 0.00694 0.00191 0.00907 0.00234 -0.00057
140 15G-1 -0.00694 -0.00030 0.00907 -0.00057 0.00234
141 15G+2 0.01950 -0.00975 0.00000 -0.00504 0.00504
142 15G-2 0.00000 0.00939 -0.00661 -0.01202 -0.01202
143 15G+3 0.00742 -0.00072 0.00943 0.00618 0.01307
144 15G-3 0.00742 -0.01015 -0.00943 -0.01307 -0.00618
145 15G+4 0.00000 0.01290 0.01230 0.00563 0.00563
146 15G-4 0.00204 0.00387 0.00000 -0.00515 0.00515
147 3 H 1S 0.00000 0.00000 0.01569 -0.01569 -0.01569
148 2S 0.00000 0.00000 1.64720 -1.64720 -1.64720
149 3S 0.00000 0.00000 -20.14718 20.14718 20.14718
150 4S 0.00000 0.00000 -17.80944 17.80944 17.80944
151 5S 0.00000 0.00000 0.77956 -0.77956 -0.77956
152 6PX 0.00285 0.00285 0.00460 -0.00460 -0.03023
153 6PY -0.00285 0.00000 0.00460 -0.03023 -0.00460
154 6PZ 0.00000 0.00285 -0.03023 0.00460 0.00460
155 7PX -0.05795 -0.05795 0.06709 -0.06709 0.08905
156 7PY 0.05795 0.00000 0.06709 0.08905 -0.06709
157 7PZ 0.00000 -0.05795 0.08905 0.06709 0.06709
158 8PX 1.34593 1.34593 -5.49128 5.49128 4.12882
159 8PY -1.34593 0.00000 -5.49128 4.12882 5.49128
160 8PZ 0.00000 1.34593 4.12882 -5.49128 -5.49128
161 9PX 0.59821 0.59821 -5.15296 5.15296 3.84237
162 9PY -0.59821 0.00000 -5.15296 3.84237 5.15296
163 9PZ 0.00000 0.59821 3.84237 -5.15296 -5.15296
164 10D 0 0.00000 0.05148 -0.00494 -0.00247 -0.00247
165 10D+1 0.02525 0.00000 -0.04900 0.04091 0.04900
166 10D-1 -0.02525 -0.02525 -0.04900 0.04900 0.04091
167 10D+2 -0.05944 -0.02972 0.00000 -0.00428 0.00428
168 10D-2 0.00000 -0.02525 0.04091 -0.04900 -0.04900
169 11D 0 0.00000 -0.34633 0.05654 0.02827 0.02827
170 11D+1 -0.19145 0.00000 0.57025 -0.53708 -0.57025
171 11D-1 0.19145 0.19145 0.57025 -0.57025 -0.53708
172 11D+2 0.39991 0.19995 0.00000 0.04896 -0.04896
173 11D-2 0.00000 0.19145 -0.53708 0.57025 0.57025
174 12D 0 0.00000 -0.56239 0.68194 0.34097 0.34097
175 12D+1 -0.34789 0.00000 1.11383 -2.07518 -1.11383
176 12D-1 0.34789 0.34789 1.11383 -1.11383 -2.07518
177 12D+2 0.64939 0.32470 0.00000 0.59057 -0.59057
178 12D-2 0.00000 0.34789 -2.07518 1.11383 1.11383
179 13F 0 0.00000 -0.01326 -0.00516 0.01142 0.01142
180 13F+1 0.01853 -0.00229 -0.00797 0.00601 0.00316
181 13F-1 -0.01853 0.01946 -0.00797 0.00316 0.00601
182 13F+2 0.02461 -0.01316 0.00000 0.00124 -0.00124
183 13F-2 0.00000 0.00000 0.03792 -0.03792 -0.03792
184 13F+3 -0.00242 -0.01854 0.00827 -0.00979 -0.00408
185 13F-3 -0.00242 -0.01507 -0.00827 0.00408 0.00979
186 14F 0 0.00000 0.10886 -0.27360 0.13961 0.13961
187 14F+1 -0.00400 -0.12932 0.00243 0.17342 0.16754
188 14F-1 0.00400 -0.39291 0.00243 0.16754 0.17342
189 14F+2 -0.49700 -0.07925 0.00000 -0.11122 0.11122
190 14F-2 0.00000 0.00000 0.20282 -0.20282 -0.20282
191 14F+3 0.13459 0.03753 0.17848 -0.04227 -0.21630
192 14F-3 0.13459 0.30435 -0.17848 0.21630 0.04227
193 15G 0 0.00000 0.01090 0.00554 -0.01117 -0.01117
194 15G+1 -0.00694 0.00191 -0.00907 0.00234 -0.00057
195 15G-1 0.00694 -0.00030 -0.00907 -0.00057 0.00234
196 15G+2 0.01950 0.00975 0.00000 0.00504 -0.00504
197 15G-2 0.00000 -0.00939 -0.00661 0.01202 0.01202
198 15G+3 -0.00742 -0.00072 -0.00943 0.00618 0.01307
199 15G-3 -0.00742 -0.01015 0.00943 -0.01307 -0.00618
200 15G+4 0.00000 -0.01290 0.01230 -0.00563 -0.00563
201 15G-4 0.00204 -0.00387 0.00000 0.00515 -0.00515
202 4 H 1S 0.00000 0.00000 -0.01569 -0.01569 0.01569
203 2S 0.00000 0.00000 -1.64720 -1.64720 1.64720
204 3S 0.00000 0.00000 20.14718 20.14718 -20.14718
205 4S 0.00000 0.00000 17.80944 17.80944 -17.80944
206 5S 0.00000 0.00000 -0.77956 -0.77956 0.77956
207 6PX 0.00285 -0.00285 0.00460 0.00460 -0.03023
208 6PY 0.00285 0.00000 -0.00460 -0.03023 0.00460
209 6PZ 0.00000 -0.00285 -0.03023 -0.00460 0.00460
210 7PX -0.05795 0.05795 0.06709 0.06709 0.08905
211 7PY -0.05795 0.00000 -0.06709 0.08905 0.06709
212 7PZ 0.00000 0.05795 0.08905 -0.06709 0.06709
213 8PX 1.34593 -1.34593 -5.49128 -5.49128 4.12882
214 8PY 1.34593 0.00000 5.49128 4.12882 -5.49128
215 8PZ 0.00000 -1.34593 4.12882 5.49128 -5.49128
216 9PX 0.59821 -0.59821 -5.15296 -5.15296 3.84237
217 9PY 0.59821 0.00000 5.15296 3.84237 -5.15296
218 9PZ 0.00000 -0.59821 3.84237 5.15296 -5.15296
219 10D 0 0.00000 0.05148 0.00494 -0.00247 0.00247
220 10D+1 -0.02525 0.00000 0.04900 0.04091 -0.04900
221 10D-1 -0.02525 0.02525 -0.04900 -0.04900 0.04091
222 10D+2 0.05944 -0.02972 0.00000 -0.00428 -0.00428
223 10D-2 0.00000 0.02525 0.04091 0.04900 -0.04900
224 11D 0 0.00000 -0.34633 -0.05654 0.02827 -0.02827
225 11D+1 0.19145 0.00000 -0.57025 -0.53708 0.57025
226 11D-1 0.19145 -0.19145 0.57025 0.57025 -0.53708
227 11D+2 -0.39991 0.19995 0.00000 0.04896 0.04896
228 11D-2 0.00000 -0.19145 -0.53708 -0.57025 0.57025
229 12D 0 0.00000 -0.56239 -0.68194 0.34097 -0.34097
230 12D+1 0.34789 0.00000 -1.11383 -2.07518 1.11383
231 12D-1 0.34789 -0.34789 1.11383 1.11383 -2.07518
232 12D+2 -0.64939 0.32470 0.00000 0.59057 0.59057
233 12D-2 0.00000 -0.34789 -2.07518 -1.11383 1.11383
234 13F 0 0.00000 0.01326 -0.00516 -0.01142 0.01142
235 13F+1 0.01853 0.00229 -0.00797 -0.00601 0.00316
236 13F-1 0.01853 0.01946 0.00797 0.00316 -0.00601
237 13F+2 0.02461 0.01316 0.00000 -0.00124 -0.00124
238 13F-2 0.00000 0.00000 -0.03792 -0.03792 0.03792
239 13F+3 -0.00242 0.01854 0.00827 0.00979 -0.00408
240 13F-3 0.00242 -0.01507 0.00827 0.00408 -0.00979
241 14F 0 0.00000 -0.10886 -0.27360 -0.13961 0.13961
242 14F+1 -0.00400 0.12932 0.00243 -0.17342 0.16754
243 14F-1 -0.00400 -0.39291 -0.00243 0.16754 -0.17342
244 14F+2 -0.49700 0.07925 0.00000 0.11122 0.11122
245 14F-2 0.00000 0.00000 -0.20282 -0.20282 0.20282
246 14F+3 0.13459 -0.03753 0.17848 0.04227 -0.21630
247 14F-3 -0.13459 0.30435 0.17848 0.21630 -0.04227
248 15G 0 0.00000 0.01090 -0.00554 -0.01117 0.01117
249 15G+1 0.00694 0.00191 0.00907 0.00234 0.00057
250 15G-1 0.00694 0.00030 -0.00907 0.00057 0.00234
251 15G+2 -0.01950 0.00975 0.00000 0.00504 0.00504
252 15G-2 0.00000 0.00939 -0.00661 -0.01202 0.01202
253 15G+3 0.00742 -0.00072 0.00943 0.00618 -0.01307
254 15G-3 -0.00742 0.01015 0.00943 0.01307 -0.00618
255 15G+4 0.00000 -0.01290 -0.01230 -0.00563 0.00563
256 15G-4 0.00204 0.00387 0.00000 -0.00515 -0.00515
257 5 H 1S 0.00000 0.00000 -0.01569 0.01569 -0.01569
258 2S 0.00000 0.00000 -1.64720 1.64720 -1.64720
259 3S 0.00000 0.00000 20.14718 -20.14718 20.14718
260 4S 0.00000 0.00000 17.80944 -17.80944 17.80944
261 5S 0.00000 0.00000 -0.77956 0.77956 -0.77956
262 6PX -0.00285 -0.00285 -0.00460 0.00460 -0.03023
263 6PY -0.00285 0.00000 0.00460 -0.03023 0.00460
264 6PZ 0.00000 0.00285 -0.03023 0.00460 -0.00460
265 7PX 0.05795 0.05795 -0.06709 0.06709 0.08905
266 7PY 0.05795 0.00000 0.06709 0.08905 0.06709
267 7PZ 0.00000 -0.05795 0.08905 0.06709 -0.06709
268 8PX -1.34593 -1.34593 5.49128 -5.49128 4.12882
269 8PY -1.34593 0.00000 -5.49128 4.12882 -5.49128
270 8PZ 0.00000 1.34593 4.12882 -5.49128 5.49128
271 9PX -0.59821 -0.59821 5.15296 -5.15296 3.84237
272 9PY -0.59821 0.00000 -5.15296 3.84237 -5.15296
273 9PZ 0.00000 0.59821 3.84237 -5.15296 5.15296
274 10D 0 0.00000 -0.05148 0.00494 0.00247 -0.00247
275 10D+1 0.02525 0.00000 -0.04900 0.04091 -0.04900
276 10D-1 0.02525 0.02525 0.04900 -0.04900 0.04091
277 10D+2 0.05944 0.02972 0.00000 0.00428 0.00428
278 10D-2 0.00000 -0.02525 0.04091 -0.04900 0.04900
279 11D 0 0.00000 0.34633 -0.05654 -0.02827 0.02827
280 11D+1 -0.19145 0.00000 0.57025 -0.53708 0.57025
281 11D-1 -0.19145 -0.19145 -0.57025 0.57025 -0.53708
282 11D+2 -0.39991 -0.19995 0.00000 -0.04896 -0.04896
283 11D-2 0.00000 0.19145 -0.53708 0.57025 -0.57025
284 12D 0 0.00000 0.56239 -0.68194 -0.34097 0.34097
285 12D+1 -0.34789 0.00000 1.11383 -2.07518 1.11383
286 12D-1 -0.34789 -0.34789 -1.11383 1.11383 -2.07518
287 12D+2 -0.64939 -0.32470 0.00000 -0.59057 -0.59057
288 12D-2 0.00000 0.34789 -2.07518 1.11383 -1.11383
289 13F 0 0.00000 -0.01326 -0.00516 0.01142 -0.01142
290 13F+1 -0.01853 0.00229 0.00797 -0.00601 0.00316
291 13F-1 -0.01853 0.01946 -0.00797 0.00316 -0.00601
292 13F+2 0.02461 -0.01316 0.00000 0.00124 0.00124
293 13F-2 0.00000 0.00000 -0.03792 0.03792 -0.03792
294 13F+3 0.00242 0.01854 -0.00827 0.00979 -0.00408
295 13F-3 -0.00242 -0.01507 -0.00827 0.00408 -0.00979
296 14F 0 0.00000 0.10886 -0.27360 0.13961 -0.13961
297 14F+1 0.00400 0.12932 -0.00243 -0.17342 0.16754
298 14F-1 0.00400 -0.39291 0.00243 0.16754 -0.17342
299 14F+2 -0.49700 -0.07925 0.00000 -0.11122 -0.11122
300 14F-2 0.00000 0.00000 -0.20282 0.20282 -0.20282
301 14F+3 -0.13459 -0.03753 -0.17848 0.04227 -0.21630
302 14F-3 0.13459 0.30435 -0.17848 0.21630 -0.04227
303 15G 0 0.00000 -0.01090 -0.00554 0.01117 -0.01117
304 15G+1 -0.00694 0.00191 -0.00907 0.00234 0.00057
305 15G-1 -0.00694 0.00030 0.00907 0.00057 0.00234
306 15G+2 -0.01950 -0.00975 0.00000 -0.00504 -0.00504
307 15G-2 0.00000 -0.00939 -0.00661 0.01202 -0.01202
308 15G+3 -0.00742 -0.00072 -0.00943 0.00618 -0.01307
309 15G-3 0.00742 0.01015 -0.00943 0.01307 -0.00618
310 15G+4 0.00000 0.01290 -0.01230 0.00563 -0.00563
311 15G-4 0.00204 -0.00387 0.00000 0.00515 0.00515
96 97 98 99 100
(A1)--V (T2)--V (T2)--V (T2)--V (A2)--V
Eigenvalues -- 3.91657 4.07599 4.07599 4.07599 4.11620
1 1 C 1S -0.00900 0.00000 0.00000 0.00000 0.00000
2 2S -0.02813 0.00000 0.00000 0.00000 0.00000
3 3S 0.19093 0.00000 0.00000 0.00000 0.00000
4 4S -8.39730 0.00000 0.00000 0.00000 0.00000
5 5S 34.98840 0.00000 0.00000 0.00000 0.00000
6 6S 5.97333 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 -0.04180 0.00000
8 7PY 0.00000 0.00000 -0.04180 0.00000 0.00000
9 7PZ 0.00000 -0.04180 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 -1.44017 0.00000
11 8PY 0.00000 0.00000 -1.44017 0.00000 0.00000
12 8PZ 0.00000 -1.44017 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 8.13400 0.00000
14 9PY 0.00000 0.00000 8.13400 0.00000 0.00000
15 9PZ 0.00000 8.13400 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 6.13951 0.00000
17 10PY 0.00000 0.00000 6.13951 0.00000 0.00000
18 10PZ 0.00000 6.13951 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 0.12374 0.00000
20 11PY 0.00000 0.00000 0.12374 0.00000 0.00000
21 11PZ 0.00000 0.12374 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 -0.02829 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 0.00000 0.00000
26 12D-2 0.00000 -0.02829 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 0.21794 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.21794 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.21794 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 1.59146 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 1.59146 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 1.59146 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 1.93790 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 1.93790 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 1.93790 0.00000 0.00000 0.00000
42 16F 0 0.00000 -0.04639 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.00000 0.02841 0.00000
44 16F-1 0.00000 0.00000 0.02841 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-2 -0.08318 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.00000 0.00000 -0.03668 0.00000
48 16F-3 0.00000 0.00000 0.03668 0.00000 0.00000
49 17F 0 0.00000 0.23440 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.00000 -0.14354 0.00000
51 17F-1 0.00000 0.00000 -0.14354 0.00000 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
53 17F-2 0.49136 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.00000 0.00000 0.00000 0.18531 0.00000
55 17F-3 0.00000 0.00000 -0.18531 0.00000 0.00000
56 18F 0 0.00000 -1.86612 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 0.00000 1.14276 0.00000
58 18F-1 0.00000 0.00000 1.14276 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
60 18F-2 5.00082 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.00000 0.00000 0.00000 -1.47530 0.00000
62 18F-3 0.00000 0.00000 1.47530 0.00000 0.00000
63 19G 0 0.08947 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00344 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00344 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 -0.00972 0.00000 0.00000 0.00000
68 19G+3 0.00000 0.00000 0.00910 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 -0.00910 0.00000
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173 11D-2 -0.05807 -0.12738 0.08603 0.08603 0.00000
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181 13F-1 0.00442 -0.00164 0.01476 0.03534 0.03410
182 13F+2 0.00000 0.00000 -0.02131 0.02131 -0.04313
183 13F-2 0.02412 -0.04054 0.04054 0.04054 0.00000
184 13F+3 -0.00571 0.03692 -0.01082 -0.01905 -0.02641
185 13F-3 0.00571 -0.03692 0.01905 0.01082 -0.02641
186 14F 0 -0.05559 0.02837 -0.24967 -0.24967 0.00000
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188 14F-1 -0.03404 0.14069 -0.01737 -0.16510 -0.26346
189 14F+2 0.00000 0.00000 0.01544 -0.01544 0.33325
190 14F-2 -0.15242 0.39065 -0.39065 -0.39065 0.00000
191 14F+3 0.04394 -0.20684 0.18793 0.02243 0.20407
192 14F-3 -0.04394 0.20684 -0.02243 -0.18793 0.20407
193 15G 0 -0.00673 -0.00059 -0.00144 -0.00144 0.00000
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195 15G-1 -0.00048 -0.01094 -0.00624 -0.00221 -0.00285
196 15G+2 0.00000 0.00000 0.00181 -0.00181 0.00000
197 15G-2 -0.00135 0.00625 0.00665 0.00665 0.00000
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199 15G-3 0.00127 0.00297 -0.00947 0.00585 -0.00108
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201 15G-4 0.00000 0.00000 0.00919 -0.00919 -0.00304
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203 2S 0.31258 -0.00104 -0.00104 0.00104 0.00000
204 3S -8.68786 4.16029 4.16029 -4.16029 0.00000
205 4S -3.43737 2.64115 2.64115 -2.64115 0.00000
206 5S -0.33738 -0.11063 -0.11063 0.11063 0.00000
207 6PX -0.01153 0.00094 0.00094 0.00457 0.00000
208 6PY 0.01153 -0.00094 0.00457 0.00094 0.00000
209 6PZ 0.01153 0.00457 -0.00094 0.00094 0.00000
210 7PX 0.09520 0.01831 0.01831 -0.02265 0.00000
211 7PY -0.09520 -0.01831 -0.02265 0.01831 0.00000
212 7PZ -0.09520 -0.02265 -0.01831 0.01831 0.00000
213 8PX 1.24404 -1.18215 -1.18215 0.45928 0.00000
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218 9PZ -1.01954 0.04201 0.64915 -0.64915 0.00000
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227 11D+2 0.00000 0.00000 0.09887 0.09887 0.00000
228 11D-2 0.05807 -0.12738 -0.08603 0.08603 0.00000
229 12D 0 0.00000 -0.75543 0.37771 -0.37771 0.00000
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231 12D-1 -0.13867 0.08896 0.08896 -0.25759 0.00000
232 12D+2 0.00000 0.00000 0.65422 0.65422 0.00000
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236 13F-1 0.00442 0.00164 0.01476 -0.03534 0.03410
237 13F+2 0.00000 0.00000 0.02131 0.02131 0.04313
238 13F-2 0.02412 0.04054 0.04054 -0.04054 0.00000
239 13F+3 0.00571 0.03692 0.01082 -0.01905 0.02641
240 13F-3 0.00571 0.03692 0.01905 -0.01082 -0.02641
241 14F 0 0.05559 0.02837 0.24967 -0.24967 0.00000
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243 14F-1 -0.03404 -0.14069 -0.01737 0.16510 -0.26346
244 14F+2 0.00000 0.00000 -0.01544 -0.01544 -0.33325
245 14F-2 -0.15242 -0.39065 -0.39065 0.39065 0.00000
246 14F+3 -0.04394 -0.20684 -0.18793 0.02243 -0.20407
247 14F-3 -0.04394 -0.20684 -0.02243 0.18793 0.20407
248 15G 0 -0.00673 0.00059 -0.00144 0.00144 0.00000
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253 15G+3 -0.00127 0.00297 -0.00585 -0.00947 -0.00108
254 15G-3 -0.00127 0.00297 0.00947 0.00585 0.00108
255 15G+4 -0.00569 -0.00224 0.00015 -0.00015 0.00000
256 15G-4 0.00000 0.00000 -0.00919 -0.00919 0.00304
257 5 H 1S 0.01487 -0.00254 0.00254 -0.00254 0.00000
258 2S 0.31258 -0.00104 0.00104 -0.00104 0.00000
259 3S -8.68786 4.16029 -4.16029 4.16029 0.00000
260 4S -3.43737 2.64115 -2.64115 2.64115 0.00000
261 5S -0.33738 -0.11063 0.11063 -0.11063 0.00000
262 6PX 0.01153 -0.00094 0.00094 0.00457 0.00000
263 6PY -0.01153 0.00094 0.00457 0.00094 0.00000
264 6PZ 0.01153 0.00457 0.00094 -0.00094 0.00000
265 7PX -0.09520 -0.01831 0.01831 -0.02265 0.00000
266 7PY 0.09520 0.01831 -0.02265 0.01831 0.00000
267 7PZ -0.09520 -0.02265 0.01831 -0.01831 0.00000
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278 10D-2 0.00502 0.00728 -0.01263 0.01263 0.00000
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288 12D-2 0.13867 -0.25759 0.08896 -0.08896 0.00000
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291 13F-1 -0.00442 -0.00164 0.01476 -0.03534 -0.03410
292 13F+2 0.00000 0.00000 -0.02131 -0.02131 0.04313
293 13F-2 0.02412 0.04054 -0.04054 0.04054 0.00000
294 13F+3 -0.00571 -0.03692 0.01082 -0.01905 -0.02641
295 13F-3 -0.00571 -0.03692 0.01905 -0.01082 0.02641
296 14F 0 0.05559 0.02837 -0.24967 0.24967 0.00000
297 14F+1 -0.03404 -0.14069 0.16510 -0.01737 0.26346
298 14F-1 0.03404 0.14069 -0.01737 0.16510 0.26346
299 14F+2 0.00000 0.00000 0.01544 0.01544 -0.33325
300 14F-2 -0.15242 -0.39065 0.39065 -0.39065 0.00000
301 14F+3 0.04394 0.20684 -0.18793 0.02243 0.20407
302 14F-3 0.04394 0.20684 -0.02243 0.18793 -0.20407
303 15G 0 -0.00673 0.00059 0.00144 -0.00144 0.00000
304 15G+1 0.00048 -0.01094 -0.00221 0.00624 -0.00285
305 15G-1 -0.00048 0.01094 0.00624 -0.00221 -0.00285
306 15G+2 0.00000 0.00000 -0.00181 -0.00181 0.00000
307 15G-2 0.00135 0.00625 0.00665 -0.00665 0.00000
308 15G+3 0.00127 -0.00297 -0.00585 -0.00947 0.00108
309 15G-3 0.00127 -0.00297 0.00947 0.00585 -0.00108
310 15G+4 -0.00569 -0.00224 -0.00015 0.00015 0.00000
311 15G-4 0.00000 0.00000 0.00919 0.00919 0.00304
101 102 103 104 105
(E)--V (E)--V (E)--V (E)--V (A1)--V
Eigenvalues -- 4.12625 4.12625 4.16386 4.16386 4.19988
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3 3S 0.00000 0.00000 0.00000 0.00000 -2.38095
4 4S 0.00000 0.00000 0.00000 0.00000 2.74449
5 5S 0.00000 0.00000 0.00000 0.00000 54.19321
6 6S 0.00000 0.00000 0.00000 0.00000 13.65199
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29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.07707 -0.67343 0.16884 -0.71894 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
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34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
35 14D+2 -0.57748 5.04609 -2.64523 11.26358 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15D 0 2.30598 0.26390 1.97980 0.46495 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 -0.26390 2.30598 -0.46495 1.97980 0.00000
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
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48 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
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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 2.78518
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
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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 1.57952
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 -0.06936 -0.00794 0.02504 0.00588 -0.08116
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 -0.01230 0.10746 0.00911 -0.03880 0.00000
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68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00000
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79 20G+4 0.01387 0.00159 1.79111 0.42064 -0.40565
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
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85 21H-2 0.19755 0.02261 0.46229 0.10857 0.00000
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89 21H-4 -0.02261 0.19755 -0.10857 0.46229 0.00000
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97 6PX -0.00607 0.00819 0.00567 -0.00604 0.00076
98 6PY -0.00406 -0.00935 0.00239 0.00793 0.00076
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102 7PZ -0.03097 -0.00354 0.13550 0.03182 -0.08344
103 8PX 0.58523 -0.79007 2.04310 -2.17444 2.80963
104 8PY 0.39161 0.90186 0.86157 2.85660 2.80963
105 8PZ -0.97684 -0.11179 -2.90467 -0.68216 2.80963
106 9PX 0.79963 -1.07951 1.09787 -1.16845 3.13695
107 9PY 0.53507 1.23225 0.46297 1.53501 3.13695
108 9PZ -1.33469 -0.15274 -1.56084 -0.36656 3.13695
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110 10D+1 -0.00096 -0.00220 -0.01317 -0.04368 0.02086
111 10D-1 -0.00143 0.00193 -0.03124 0.03325 0.02086
112 10D+2 0.00564 -0.04933 0.01138 -0.04848 0.00000
113 10D-2 0.00239 0.00027 0.04442 0.01043 0.02086
114 11D 0 0.33342 0.03816 0.45934 0.10787 0.00000
115 11D+1 0.01769 0.04074 0.09981 0.33091 -0.26741
116 11D-1 0.02644 -0.03569 0.23667 -0.25189 -0.26741
117 11D+2 -0.03816 0.33342 -0.10787 0.45934 0.00000
118 11D-2 -0.04413 -0.00505 -0.33648 -0.07902 -0.26741
119 12D 0 0.86423 0.09890 2.31362 0.54335 0.00000
120 12D+1 0.30872 0.71098 0.30983 1.02725 -1.13339
121 12D-1 0.46136 -0.62285 0.73471 -0.78194 -1.13339
122 12D+2 -0.09890 0.86423 -0.54335 2.31362 0.00000
123 12D-2 -0.77009 -0.08813 -1.04453 -0.24531 -1.13339
124 13F 0 0.03336 0.00382 -0.00301 -0.00071 -0.02537
125 13F+1 0.00779 -0.01982 -0.00009 0.00251 0.01553
126 13F-1 0.00311 0.02107 0.00104 -0.00229 0.01553
127 13F+2 0.00080 -0.00696 -0.00048 0.00203 0.00000
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00193
129 13F+3 -0.01925 0.01878 0.00260 -0.00090 -0.02005
130 13F-3 0.01451 0.02264 -0.00193 -0.00197 0.02005
131 14F 0 -0.35565 -0.04070 -0.43330 -0.10176 -0.02012
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133 14F-1 -0.26170 -0.12535 -0.60050 -0.10357 0.01232
134 14F+2 0.02734 -0.23892 0.15761 -0.67113 0.00000
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.42051
136 14F+3 0.05011 -0.31506 -0.06672 -0.54551 -0.01591
137 14F-3 0.02236 -0.31824 0.30257 -0.45879 0.01591
138 15G 0 -0.01129 -0.00129 -0.00693 -0.00163 0.01296
139 15G+1 0.00922 0.00245 0.03760 -0.00038 0.00564
140 15G-1 0.00953 -0.00030 0.03350 0.01707 0.00564
141 15G+2 -0.00200 0.01749 -0.00252 0.01073 0.00000
142 15G-2 0.01663 0.00190 0.02890 0.00679 -0.01596
143 15G+3 0.00364 0.01549 -0.00505 0.03053 0.01493
144 15G-3 -0.00705 0.01426 -0.00907 0.02958 -0.01493
145 15G+4 0.01336 0.00153 0.00820 0.00193 0.01096
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148 2S 0.00000 0.00000 0.00000 0.00000 1.41140
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150 4S 0.00000 0.00000 0.00000 0.00000 -10.22265
151 5S 0.00000 0.00000 0.00000 0.00000 -0.47806
152 6PX 0.00607 -0.00819 -0.00567 0.00604 -0.00076
153 6PY 0.00406 0.00935 -0.00239 -0.00793 -0.00076
154 6PZ 0.01013 0.00116 -0.00806 -0.00189 0.00076
155 7PX -0.01855 0.02505 0.09531 -0.10144 0.08344
156 7PY -0.01242 -0.02859 0.04019 0.13326 0.08344
157 7PZ -0.03097 -0.00354 0.13550 0.03182 -0.08344
158 8PX -0.58523 0.79007 -2.04310 2.17444 -2.80963
159 8PY -0.39161 -0.90186 -0.86157 -2.85660 -2.80963
160 8PZ -0.97684 -0.11179 -2.90467 -0.68216 2.80963
161 9PX -0.79963 1.07951 -1.09787 1.16845 -3.13695
162 9PY -0.53507 -1.23225 -0.46297 -1.53501 -3.13695
163 9PZ -1.33469 -0.15274 -1.56084 -0.36656 3.13695
164 10D 0 -0.04933 -0.00564 -0.04848 -0.01138 0.00000
165 10D+1 0.00096 0.00220 0.01317 0.04368 -0.02086
166 10D-1 0.00143 -0.00193 0.03124 -0.03325 -0.02086
167 10D+2 0.00564 -0.04933 0.01138 -0.04848 0.00000
168 10D-2 0.00239 0.00027 0.04442 0.01043 0.02086
169 11D 0 0.33342 0.03816 0.45934 0.10787 0.00000
170 11D+1 -0.01769 -0.04074 -0.09981 -0.33091 0.26741
171 11D-1 -0.02644 0.03569 -0.23667 0.25189 0.26741
172 11D+2 -0.03816 0.33342 -0.10787 0.45934 0.00000
173 11D-2 -0.04413 -0.00505 -0.33648 -0.07902 -0.26741
174 12D 0 0.86423 0.09890 2.31362 0.54335 0.00000
175 12D+1 -0.30872 -0.71098 -0.30983 -1.02725 1.13339
176 12D-1 -0.46136 0.62285 -0.73471 0.78194 1.13339
177 12D+2 -0.09890 0.86423 -0.54335 2.31362 0.00000
178 12D-2 -0.77009 -0.08813 -1.04453 -0.24531 -1.13339
179 13F 0 0.03336 0.00382 -0.00301 -0.00071 -0.02537
180 13F+1 -0.00779 0.01982 0.00009 -0.00251 -0.01553
181 13F-1 -0.00311 -0.02107 -0.00104 0.00229 -0.01553
182 13F+2 0.00080 -0.00696 -0.00048 0.00203 0.00000
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00193
184 13F+3 0.01925 -0.01878 -0.00260 0.00090 0.02005
185 13F-3 -0.01451 -0.02264 0.00193 0.00197 -0.02005
186 14F 0 -0.35565 -0.04070 -0.43330 -0.10176 -0.02012
187 14F+1 0.28325 -0.06299 0.58382 0.17456 -0.01232
188 14F-1 0.26170 0.12535 0.60050 0.10357 -0.01232
189 14F+2 0.02734 -0.23892 0.15761 -0.67113 0.00000
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.42051
191 14F+3 -0.05011 0.31506 0.06672 0.54551 0.01591
192 14F-3 -0.02236 0.31824 -0.30257 0.45879 -0.01591
193 15G 0 -0.01129 -0.00129 -0.00693 -0.00163 0.01296
194 15G+1 -0.00922 -0.00245 -0.03760 0.00038 -0.00564
195 15G-1 -0.00953 0.00030 -0.03350 -0.01707 -0.00564
196 15G+2 -0.00200 0.01749 -0.00252 0.01073 0.00000
197 15G-2 0.01663 0.00190 0.02890 0.00679 -0.01596
198 15G+3 -0.00364 -0.01549 0.00505 -0.03053 -0.01493
199 15G-3 0.00705 -0.01426 0.00907 -0.02958 0.01493
200 15G+4 0.01336 0.00153 0.00820 0.00193 0.01096
201 15G-4 -0.00091 0.00794 -0.00882 0.03757 0.00000
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 -0.01182
203 2S 0.00000 0.00000 0.00000 0.00000 1.41140
204 3S 0.00000 0.00000 0.00000 0.00000 -10.34011
205 4S 0.00000 0.00000 0.00000 0.00000 -10.22265
206 5S 0.00000 0.00000 0.00000 0.00000 -0.47806
207 6PX -0.00607 0.00819 0.00567 -0.00604 0.00076
208 6PY 0.00406 0.00935 -0.00239 -0.00793 -0.00076
209 6PZ -0.01013 -0.00116 0.00806 0.00189 -0.00076
210 7PX 0.01855 -0.02505 -0.09531 0.10144 -0.08344
211 7PY -0.01242 -0.02859 0.04019 0.13326 0.08344
212 7PZ 0.03097 0.00354 -0.13550 -0.03182 0.08344
213 8PX 0.58523 -0.79007 2.04310 -2.17444 2.80963
214 8PY -0.39161 -0.90186 -0.86157 -2.85660 -2.80963
215 8PZ 0.97684 0.11179 2.90467 0.68216 -2.80963
216 9PX 0.79963 -1.07951 1.09787 -1.16845 3.13695
217 9PY -0.53507 -1.23225 -0.46297 -1.53501 -3.13695
218 9PZ 1.33469 0.15274 1.56084 0.36656 -3.13695
219 10D 0 -0.04933 -0.00564 -0.04848 -0.01138 0.00000
220 10D+1 0.00096 0.00220 0.01317 0.04368 -0.02086
221 10D-1 -0.00143 0.00193 -0.03124 0.03325 0.02086
222 10D+2 0.00564 -0.04933 0.01138 -0.04848 0.00000
223 10D-2 -0.00239 -0.00027 -0.04442 -0.01043 -0.02086
224 11D 0 0.33342 0.03816 0.45934 0.10787 0.00000
225 11D+1 -0.01769 -0.04074 -0.09981 -0.33091 0.26741
226 11D-1 0.02644 -0.03569 0.23667 -0.25189 -0.26741
227 11D+2 -0.03816 0.33342 -0.10787 0.45934 0.00000
228 11D-2 0.04413 0.00505 0.33648 0.07902 0.26741
229 12D 0 0.86423 0.09890 2.31362 0.54335 0.00000
230 12D+1 -0.30872 -0.71098 -0.30983 -1.02725 1.13339
231 12D-1 0.46136 -0.62285 0.73471 -0.78194 -1.13339
232 12D+2 -0.09890 0.86423 -0.54335 2.31362 0.00000
233 12D-2 0.77009 0.08813 1.04453 0.24531 1.13339
234 13F 0 -0.03336 -0.00382 0.00301 0.00071 0.02537
235 13F+1 0.00779 -0.01982 -0.00009 0.00251 0.01553
236 13F-1 -0.00311 -0.02107 -0.00104 0.00229 -0.01553
237 13F+2 -0.00080 0.00696 0.00048 -0.00203 0.00000
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00193
239 13F+3 -0.01925 0.01878 0.00260 -0.00090 -0.02005
240 13F-3 -0.01451 -0.02264 0.00193 0.00197 -0.02005
241 14F 0 0.35565 0.04070 0.43330 0.10176 0.02012
242 14F+1 -0.28325 0.06299 -0.58382 -0.17456 0.01232
243 14F-1 0.26170 0.12535 0.60050 0.10357 -0.01232
244 14F+2 -0.02734 0.23892 -0.15761 0.67113 0.00000
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.42051
246 14F+3 0.05011 -0.31506 -0.06672 -0.54551 -0.01591
247 14F-3 -0.02236 0.31824 -0.30257 0.45879 -0.01591
248 15G 0 -0.01129 -0.00129 -0.00693 -0.00163 0.01296
249 15G+1 -0.00922 -0.00245 -0.03760 0.00038 -0.00564
250 15G-1 0.00953 -0.00030 0.03350 0.01707 0.00564
251 15G+2 -0.00200 0.01749 -0.00252 0.01073 0.00000
252 15G-2 -0.01663 -0.00190 -0.02890 -0.00679 0.01596
253 15G+3 -0.00364 -0.01549 0.00505 -0.03053 -0.01493
254 15G-3 -0.00705 0.01426 -0.00907 0.02958 -0.01493
255 15G+4 0.01336 0.00153 0.00820 0.00193 0.01096
256 15G-4 0.00091 -0.00794 0.00882 -0.03757 0.00000
257 5 H 1S 0.00000 0.00000 0.00000 0.00000 -0.01182
258 2S 0.00000 0.00000 0.00000 0.00000 1.41140
259 3S 0.00000 0.00000 0.00000 0.00000 -10.34011
260 4S 0.00000 0.00000 0.00000 0.00000 -10.22265
261 5S 0.00000 0.00000 0.00000 0.00000 -0.47806
262 6PX 0.00607 -0.00819 -0.00567 0.00604 -0.00076
263 6PY -0.00406 -0.00935 0.00239 0.00793 0.00076
264 6PZ -0.01013 -0.00116 0.00806 0.00189 -0.00076
265 7PX -0.01855 0.02505 0.09531 -0.10144 0.08344
266 7PY 0.01242 0.02859 -0.04019 -0.13326 -0.08344
267 7PZ 0.03097 0.00354 -0.13550 -0.03182 0.08344
268 8PX -0.58523 0.79007 -2.04310 2.17444 -2.80963
269 8PY 0.39161 0.90186 0.86157 2.85660 2.80963
270 8PZ 0.97684 0.11179 2.90467 0.68216 -2.80963
271 9PX -0.79963 1.07951 -1.09787 1.16845 -3.13695
272 9PY 0.53507 1.23225 0.46297 1.53501 3.13695
273 9PZ 1.33469 0.15274 1.56084 0.36656 -3.13695
274 10D 0 -0.04933 -0.00564 -0.04848 -0.01138 0.00000
275 10D+1 -0.00096 -0.00220 -0.01317 -0.04368 0.02086
276 10D-1 0.00143 -0.00193 0.03124 -0.03325 -0.02086
277 10D+2 0.00564 -0.04933 0.01138 -0.04848 0.00000
278 10D-2 -0.00239 -0.00027 -0.04442 -0.01043 -0.02086
279 11D 0 0.33342 0.03816 0.45934 0.10787 0.00000
280 11D+1 0.01769 0.04074 0.09981 0.33091 -0.26741
281 11D-1 -0.02644 0.03569 -0.23667 0.25189 0.26741
282 11D+2 -0.03816 0.33342 -0.10787 0.45934 0.00000
283 11D-2 0.04413 0.00505 0.33648 0.07902 0.26741
284 12D 0 0.86423 0.09890 2.31362 0.54335 0.00000
285 12D+1 0.30872 0.71098 0.30983 1.02725 -1.13339
286 12D-1 -0.46136 0.62285 -0.73471 0.78194 1.13339
287 12D+2 -0.09890 0.86423 -0.54335 2.31362 0.00000
288 12D-2 0.77009 0.08813 1.04453 0.24531 1.13339
289 13F 0 -0.03336 -0.00382 0.00301 0.00071 0.02537
290 13F+1 -0.00779 0.01982 0.00009 -0.00251 -0.01553
291 13F-1 0.00311 0.02107 0.00104 -0.00229 0.01553
292 13F+2 -0.00080 0.00696 0.00048 -0.00203 0.00000
293 13F-2 0.00000 0.00000 0.00000 0.00000 0.00193
294 13F+3 0.01925 -0.01878 -0.00260 0.00090 0.02005
295 13F-3 0.01451 0.02264 -0.00193 -0.00197 0.02005
296 14F 0 0.35565 0.04070 0.43330 0.10176 0.02012
297 14F+1 0.28325 -0.06299 0.58382 0.17456 -0.01232
298 14F-1 -0.26170 -0.12535 -0.60050 -0.10357 0.01232
299 14F+2 -0.02734 0.23892 -0.15761 0.67113 0.00000
300 14F-2 0.00000 0.00000 0.00000 0.00000 0.42051
301 14F+3 -0.05011 0.31506 0.06672 0.54551 0.01591
302 14F-3 0.02236 -0.31824 0.30257 -0.45879 0.01591
303 15G 0 -0.01129 -0.00129 -0.00693 -0.00163 0.01296
304 15G+1 0.00922 0.00245 0.03760 -0.00038 0.00564
305 15G-1 -0.00953 0.00030 -0.03350 -0.01707 -0.00564
306 15G+2 -0.00200 0.01749 -0.00252 0.01073 0.00000
307 15G-2 -0.01663 -0.00190 -0.02890 -0.00679 0.01596
308 15G+3 0.00364 0.01549 -0.00505 0.03053 0.01493
309 15G-3 0.00705 -0.01426 0.00907 -0.02958 0.01493
310 15G+4 0.01336 0.00153 0.00820 0.00193 0.01096
311 15G-4 0.00091 -0.00794 0.00882 -0.03757 0.00000
106 107 108 109 110
(T1)--V (T1)--V (T1)--V (T2)--V (T2)--V
Eigenvalues -- 4.25816 4.25816 4.25816 4.54858 4.54858
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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 0.00000 0.00000 0.02842
8 7PY 0.00000 0.00000 0.00000 0.02842 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
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11 8PY 0.00000 0.00000 0.00000 -1.93017 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 15.33496
14 9PY 0.00000 0.00000 0.00000 15.33496 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 6.97584
17 10PY 0.00000 0.00000 0.00000 6.97584 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 0.72020
20 11PY 0.00000 0.00000 0.00000 0.72020 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
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24 12D-1 0.00000 0.00000 0.00000 0.00000 -0.00801
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 0.74394 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.74394
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 -5.00046 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 -5.00046
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 -0.20336 0.00000
39 15D-1 0.00000 0.00000 0.00000 0.00000 -0.20336
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 0.00576 0.00000 0.00000 0.00000 0.08626
44 16F-1 0.00000 0.00576 0.00000 0.08626 0.00000
45 16F+2 0.00000 0.00000 0.00728 0.00000 0.00000
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00446 0.00000 0.00000 0.00000 -0.11136
48 16F-3 0.00000 -0.00446 0.00000 0.11136 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.02485 0.00000 0.00000 0.00000 -0.86740
51 17F-1 0.00000 0.02485 0.00000 -0.86740 0.00000
52 17F+2 0.00000 0.00000 0.03143 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.01925 0.00000 0.00000 0.00000 1.11980
55 17F-3 0.00000 -0.01925 0.00000 -1.11980 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.94476 0.00000 0.00000 0.00000 -0.85450
58 18F-1 0.00000 0.94476 0.00000 -0.85450 0.00000
59 18F+2 0.00000 0.00000 1.19503 0.00000 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.73181 0.00000 0.00000 0.00000 1.10316
62 18F-3 0.00000 -0.73181 0.00000 -1.10316 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.03339 0.00000 -0.02046 0.00000
65 19G-1 0.03339 0.00000 0.00000 0.00000 -0.02046
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 -0.01262 0.00000 -0.05414 0.00000
69 19G-3 0.01262 0.00000 0.00000 0.00000 0.05414
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.03569 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
73 20G+1 0.00000 -0.40092 0.00000 -0.76463 0.00000
74 20G-1 -0.40092 0.00000 0.00000 0.00000 -0.76463
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 0.15153 0.00000 -2.02301 0.00000
78 20G-3 -0.15153 0.00000 0.00000 0.00000 2.02301
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
80 20G-4 0.00000 0.00000 -0.42860 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.05487 0.00000 0.00000 0.00000 -0.05038
83 21H-1 0.00000 0.05487 0.00000 -0.05038 0.00000
84 21H+2 0.00000 0.00000 -0.08296 0.00000 0.00000
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 -0.02540 0.00000 0.00000 0.00000 0.25894
87 21H-3 0.00000 0.02540 0.00000 -0.25894 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 -0.05680 0.00000 0.00000 0.00000 -0.16447
91 21H-5 0.00000 -0.05680 0.00000 -0.16447 0.00000
92 2 H 1S 0.00000 0.00000 0.00000 -0.00904 -0.00904
93 2S 0.00000 0.00000 0.00000 0.13975 0.13975
94 3S 0.00000 0.00000 0.00000 -1.99580 -1.99580
95 4S 0.00000 0.00000 0.00000 -3.51012 -3.51012
96 5S 0.00000 0.00000 0.00000 -0.05454 -0.05454
97 6PX 0.00000 -0.00086 0.00086 0.01737 0.00632
98 6PY -0.00086 0.00000 -0.00086 0.00632 0.01737
99 6PZ 0.00086 0.00086 0.00000 0.01737 0.01737
100 7PX 0.00000 0.01993 -0.01993 -0.15915 0.02173
101 7PY 0.01993 0.00000 0.01993 0.02173 -0.15915
102 7PZ -0.01993 -0.01993 0.00000 -0.15915 -0.15915
103 8PX 0.00000 0.23099 -0.23099 2.09949 -1.88517
104 8PY 0.23099 0.00000 0.23099 -1.88517 2.09949
105 8PZ -0.23099 -0.23099 0.00000 2.09949 2.09949
106 9PX 0.00000 0.35730 -0.35730 1.80605 -0.87657
107 9PY 0.35730 0.00000 0.35730 -0.87657 1.80605
108 9PZ -0.35730 -0.35730 0.00000 1.80605 1.80605
109 10D 0 0.04078 0.04078 0.00000 0.02444 0.02444
110 10D+1 -0.01178 0.00000 -0.01178 0.01325 -0.00937
111 10D-1 0.00000 -0.01178 0.01178 -0.00937 0.01325
112 10D+2 0.02355 -0.02355 0.04709 0.04233 -0.04233
113 10D-2 0.01178 0.01178 0.00000 -0.00937 -0.00937
114 11D 0 -0.25018 -0.25018 0.00000 -0.19494 -0.19494
115 11D+1 0.05367 0.00000 0.05367 -0.10356 0.11028
116 11D-1 0.00000 0.05367 -0.05367 0.11028 -0.10356
117 11D+2 -0.14444 0.14444 -0.28888 -0.33765 0.33765
118 11D-2 -0.05367 -0.05367 0.00000 0.11028 0.11028
119 12D 0 0.42940 0.42940 0.00000 -1.14091 -1.14091
120 12D+1 0.03749 0.00000 0.03749 -1.71710 0.25610
121 12D-1 0.00000 0.03749 -0.03749 0.25610 -1.71710
122 12D+2 0.24792 -0.24792 0.49583 -1.97611 1.97611
123 12D-2 -0.03749 -0.03749 0.00000 0.25610 0.25610
124 13F 0 -0.01213 -0.01213 0.00000 -0.00301 -0.00301
125 13F+1 0.03823 -0.03185 -0.01700 -0.01509 -0.00940
126 13F-1 -0.03185 0.03823 0.01700 -0.00940 -0.01509
127 13F+2 -0.03089 0.03089 0.04835 -0.02142 0.02142
128 13F-2 0.00000 0.00000 0.00000 0.01685 0.01685
129 13F+3 0.02961 -0.00933 -0.02851 -0.01550 0.01213
130 13F-3 0.00933 -0.02961 -0.02851 -0.01213 0.01550
131 14F 0 0.12474 0.12474 0.00000 0.15746 0.15746
132 14F+1 -0.28211 0.27927 0.12650 0.48659 0.30502
133 14F-1 0.27927 -0.28211 -0.12650 0.30502 0.48659
134 14F+2 0.25663 -0.25663 -0.35685 0.73747 -0.73747
135 14F-2 0.00000 0.00000 0.00000 -0.07966 -0.07966
136 14F+3 -0.21852 0.05854 0.25577 0.57609 -0.39377
137 14F-3 -0.05854 0.21852 0.25577 0.39377 -0.57609
138 15G 0 -0.00158 -0.00158 0.00000 0.00992 0.00992
139 15G+1 0.00315 -0.00046 -0.00222 -0.00897 -0.01846
140 15G-1 -0.00046 0.00315 0.00222 -0.01846 -0.00897
141 15G+2 0.00142 -0.00142 0.00283 -0.01707 0.01707
142 15G-2 0.00131 0.00131 0.00000 -0.02142 -0.02142
143 15G+3 0.00021 0.00018 0.00224 -0.02373 0.02988
144 15G-3 -0.00018 -0.00021 0.00224 -0.02988 0.02373
145 15G+4 0.00187 0.00187 0.00000 -0.00452 -0.00452
146 15G-4 0.00287 -0.00287 -0.00050 -0.02784 0.02784
147 3 H 1S 0.00000 0.00000 0.00000 0.00904 0.00904
148 2S 0.00000 0.00000 0.00000 -0.13975 -0.13975
149 3S 0.00000 0.00000 0.00000 1.99580 1.99580
150 4S 0.00000 0.00000 0.00000 3.51012 3.51012
151 5S 0.00000 0.00000 0.00000 0.05454 0.05454
152 6PX 0.00000 -0.00086 -0.00086 0.01737 0.00632
153 6PY -0.00086 0.00000 0.00086 0.00632 0.01737
154 6PZ -0.00086 -0.00086 0.00000 -0.01737 -0.01737
155 7PX 0.00000 0.01993 0.01993 -0.15915 0.02173
156 7PY 0.01993 0.00000 -0.01993 0.02173 -0.15915
157 7PZ 0.01993 0.01993 0.00000 0.15915 0.15915
158 8PX 0.00000 0.23099 0.23099 2.09949 -1.88517
159 8PY 0.23099 0.00000 -0.23099 -1.88517 2.09949
160 8PZ 0.23099 0.23099 0.00000 -2.09949 -2.09949
161 9PX 0.00000 0.35730 0.35730 1.80605 -0.87657
162 9PY 0.35730 0.00000 -0.35730 -0.87657 1.80605
163 9PZ 0.35730 0.35730 0.00000 -1.80605 -1.80605
164 10D 0 -0.04078 -0.04078 0.00000 -0.02444 -0.02444
165 10D+1 -0.01178 0.00000 0.01178 0.01325 -0.00937
166 10D-1 0.00000 -0.01178 -0.01178 -0.00937 0.01325
167 10D+2 -0.02355 0.02355 0.04709 -0.04233 0.04233
168 10D-2 -0.01178 -0.01178 0.00000 0.00937 0.00937
169 11D 0 0.25018 0.25018 0.00000 0.19494 0.19494
170 11D+1 0.05367 0.00000 -0.05367 -0.10356 0.11028
171 11D-1 0.00000 0.05367 0.05367 0.11028 -0.10356
172 11D+2 0.14444 -0.14444 -0.28888 0.33765 -0.33765
173 11D-2 0.05367 0.05367 0.00000 -0.11028 -0.11028
174 12D 0 -0.42940 -0.42940 0.00000 1.14091 1.14091
175 12D+1 0.03749 0.00000 -0.03749 -1.71710 0.25610
176 12D-1 0.00000 0.03749 0.03749 0.25610 -1.71710
177 12D+2 -0.24792 0.24792 0.49583 1.97611 -1.97611
178 12D-2 0.03749 0.03749 0.00000 -0.25610 -0.25610
179 13F 0 0.01213 0.01213 0.00000 0.00301 0.00301
180 13F+1 0.03823 -0.03185 0.01700 -0.01509 -0.00940
181 13F-1 -0.03185 0.03823 -0.01700 -0.00940 -0.01509
182 13F+2 0.03089 -0.03089 0.04835 0.02142 -0.02142
183 13F-2 0.00000 0.00000 0.00000 -0.01685 -0.01685
184 13F+3 0.02961 -0.00933 0.02851 -0.01550 0.01213
185 13F-3 0.00933 -0.02961 0.02851 -0.01213 0.01550
186 14F 0 -0.12474 -0.12474 0.00000 -0.15746 -0.15746
187 14F+1 -0.28211 0.27927 -0.12650 0.48659 0.30502
188 14F-1 0.27927 -0.28211 0.12650 0.30502 0.48659
189 14F+2 -0.25663 0.25663 -0.35685 -0.73747 0.73747
190 14F-2 0.00000 0.00000 0.00000 0.07966 0.07966
191 14F+3 -0.21852 0.05854 -0.25577 0.57609 -0.39377
192 14F-3 -0.05854 0.21852 -0.25577 0.39377 -0.57609
193 15G 0 0.00158 0.00158 0.00000 -0.00992 -0.00992
194 15G+1 0.00315 -0.00046 0.00222 -0.00897 -0.01846
195 15G-1 -0.00046 0.00315 -0.00222 -0.01846 -0.00897
196 15G+2 -0.00142 0.00142 0.00283 0.01707 -0.01707
197 15G-2 -0.00131 -0.00131 0.00000 0.02142 0.02142
198 15G+3 0.00021 0.00018 -0.00224 -0.02373 0.02988
199 15G-3 -0.00018 -0.00021 -0.00224 -0.02988 0.02373
200 15G+4 -0.00187 -0.00187 0.00000 0.00452 0.00452
201 15G-4 -0.00287 0.00287 -0.00050 0.02784 -0.02784
202 4 H 1S 0.00000 0.00000 0.00000 0.00904 -0.00904
203 2S 0.00000 0.00000 0.00000 -0.13975 0.13975
204 3S 0.00000 0.00000 0.00000 1.99580 -1.99580
205 4S 0.00000 0.00000 0.00000 3.51012 -3.51012
206 5S 0.00000 0.00000 0.00000 0.05454 -0.05454
207 6PX 0.00000 0.00086 -0.00086 -0.01737 0.00632
208 6PY 0.00086 0.00000 -0.00086 0.00632 -0.01737
209 6PZ -0.00086 0.00086 0.00000 0.01737 -0.01737
210 7PX 0.00000 -0.01993 0.01993 0.15915 0.02173
211 7PY -0.01993 0.00000 0.01993 0.02173 0.15915
212 7PZ 0.01993 -0.01993 0.00000 -0.15915 0.15915
213 8PX 0.00000 -0.23099 0.23099 -2.09949 -1.88517
214 8PY -0.23099 0.00000 0.23099 -1.88517 -2.09949
215 8PZ 0.23099 -0.23099 0.00000 2.09949 -2.09949
216 9PX 0.00000 -0.35730 0.35730 -1.80605 -0.87657
217 9PY -0.35730 0.00000 0.35730 -0.87657 -1.80605
218 9PZ 0.35730 -0.35730 0.00000 1.80605 -1.80605
219 10D 0 0.04078 -0.04078 0.00000 -0.02444 0.02444
220 10D+1 0.01178 0.00000 -0.01178 0.01325 0.00937
221 10D-1 0.00000 0.01178 -0.01178 0.00937 0.01325
222 10D+2 0.02355 0.02355 -0.04709 -0.04233 -0.04233
223 10D-2 -0.01178 0.01178 0.00000 -0.00937 0.00937
224 11D 0 -0.25018 0.25018 0.00000 0.19494 -0.19494
225 11D+1 -0.05367 0.00000 0.05367 -0.10356 -0.11028
226 11D-1 0.00000 -0.05367 0.05367 -0.11028 -0.10356
227 11D+2 -0.14444 -0.14444 0.28888 0.33765 0.33765
228 11D-2 0.05367 -0.05367 0.00000 0.11028 -0.11028
229 12D 0 0.42940 -0.42940 0.00000 1.14091 -1.14091
230 12D+1 -0.03749 0.00000 0.03749 -1.71710 -0.25610
231 12D-1 0.00000 -0.03749 0.03749 -0.25610 -1.71710
232 12D+2 0.24792 0.24792 -0.49583 1.97611 1.97611
233 12D-2 0.03749 -0.03749 0.00000 0.25610 -0.25610
234 13F 0 0.01213 -0.01213 0.00000 -0.00301 0.00301
235 13F+1 0.03823 0.03185 0.01700 0.01509 -0.00940
236 13F-1 0.03185 0.03823 0.01700 -0.00940 0.01509
237 13F+2 0.03089 0.03089 0.04835 -0.02142 -0.02142
238 13F-2 0.00000 0.00000 0.00000 -0.01685 0.01685
239 13F+3 0.02961 0.00933 0.02851 0.01550 0.01213
240 13F-3 -0.00933 -0.02961 -0.02851 -0.01213 -0.01550
241 14F 0 -0.12474 0.12474 0.00000 0.15746 -0.15746
242 14F+1 -0.28211 -0.27927 -0.12650 -0.48659 0.30502
243 14F-1 -0.27927 -0.28211 -0.12650 0.30502 -0.48659
244 14F+2 -0.25663 -0.25663 -0.35685 0.73747 0.73747
245 14F-2 0.00000 0.00000 0.00000 0.07966 -0.07966
246 14F+3 -0.21852 -0.05854 -0.25577 -0.57609 -0.39377
247 14F-3 0.05854 0.21852 0.25577 0.39377 0.57609
248 15G 0 -0.00158 0.00158 0.00000 -0.00992 0.00992
249 15G+1 -0.00315 -0.00046 -0.00222 -0.00897 0.01846
250 15G-1 -0.00046 -0.00315 -0.00222 0.01846 -0.00897
251 15G+2 0.00142 0.00142 -0.00283 0.01707 0.01707
252 15G-2 -0.00131 0.00131 0.00000 -0.02142 0.02142
253 15G+3 -0.00021 0.00018 0.00224 -0.02373 -0.02988
254 15G-3 -0.00018 0.00021 -0.00224 0.02988 0.02373
255 15G+4 0.00187 -0.00187 0.00000 0.00452 -0.00452
256 15G-4 -0.00287 -0.00287 -0.00050 -0.02784 -0.02784
257 5 H 1S 0.00000 0.00000 0.00000 -0.00904 0.00904
258 2S 0.00000 0.00000 0.00000 0.13975 -0.13975
259 3S 0.00000 0.00000 0.00000 -1.99580 1.99580
260 4S 0.00000 0.00000 0.00000 -3.51012 3.51012
261 5S 0.00000 0.00000 0.00000 -0.05454 0.05454
262 6PX 0.00000 0.00086 0.00086 -0.01737 0.00632
263 6PY 0.00086 0.00000 0.00086 0.00632 -0.01737
264 6PZ 0.00086 -0.00086 0.00000 -0.01737 0.01737
265 7PX 0.00000 -0.01993 -0.01993 0.15915 0.02173
266 7PY -0.01993 0.00000 -0.01993 0.02173 0.15915
267 7PZ -0.01993 0.01993 0.00000 0.15915 -0.15915
268 8PX 0.00000 -0.23099 -0.23099 -2.09949 -1.88517
269 8PY -0.23099 0.00000 -0.23099 -1.88517 -2.09949
270 8PZ -0.23099 0.23099 0.00000 -2.09949 2.09949
271 9PX 0.00000 -0.35730 -0.35730 -1.80605 -0.87657
272 9PY -0.35730 0.00000 -0.35730 -0.87657 -1.80605
273 9PZ -0.35730 0.35730 0.00000 -1.80605 1.80605
274 10D 0 -0.04078 0.04078 0.00000 0.02444 -0.02444
275 10D+1 0.01178 0.00000 0.01178 0.01325 0.00937
276 10D-1 0.00000 0.01178 0.01178 0.00937 0.01325
277 10D+2 -0.02355 -0.02355 -0.04709 0.04233 0.04233
278 10D-2 0.01178 -0.01178 0.00000 0.00937 -0.00937
279 11D 0 0.25018 -0.25018 0.00000 -0.19494 0.19494
280 11D+1 -0.05367 0.00000 -0.05367 -0.10356 -0.11028
281 11D-1 0.00000 -0.05367 -0.05367 -0.11028 -0.10356
282 11D+2 0.14444 0.14444 0.28888 -0.33765 -0.33765
283 11D-2 -0.05367 0.05367 0.00000 -0.11028 0.11028
284 12D 0 -0.42940 0.42940 0.00000 -1.14091 1.14091
285 12D+1 -0.03749 0.00000 -0.03749 -1.71710 -0.25610
286 12D-1 0.00000 -0.03749 -0.03749 -0.25610 -1.71710
287 12D+2 -0.24792 -0.24792 -0.49583 -1.97611 -1.97611
288 12D-2 -0.03749 0.03749 0.00000 -0.25610 0.25610
289 13F 0 -0.01213 0.01213 0.00000 0.00301 -0.00301
290 13F+1 0.03823 0.03185 -0.01700 0.01509 -0.00940
291 13F-1 0.03185 0.03823 -0.01700 -0.00940 0.01509
292 13F+2 -0.03089 -0.03089 0.04835 0.02142 0.02142
293 13F-2 0.00000 0.00000 0.00000 0.01685 -0.01685
294 13F+3 0.02961 0.00933 -0.02851 0.01550 0.01213
295 13F-3 -0.00933 -0.02961 0.02851 -0.01213 -0.01550
296 14F 0 0.12474 -0.12474 0.00000 -0.15746 0.15746
297 14F+1 -0.28211 -0.27927 0.12650 -0.48659 0.30502
298 14F-1 -0.27927 -0.28211 0.12650 0.30502 -0.48659
299 14F+2 0.25663 0.25663 -0.35685 -0.73747 -0.73747
300 14F-2 0.00000 0.00000 0.00000 -0.07966 0.07966
301 14F+3 -0.21852 -0.05854 0.25577 -0.57609 -0.39377
302 14F-3 0.05854 0.21852 -0.25577 0.39377 0.57609
303 15G 0 0.00158 -0.00158 0.00000 0.00992 -0.00992
304 15G+1 -0.00315 -0.00046 0.00222 -0.00897 0.01846
305 15G-1 -0.00046 -0.00315 0.00222 0.01846 -0.00897
306 15G+2 -0.00142 -0.00142 -0.00283 -0.01707 -0.01707
307 15G-2 0.00131 -0.00131 0.00000 0.02142 -0.02142
308 15G+3 -0.00021 0.00018 -0.00224 -0.02373 -0.02988
309 15G-3 -0.00018 0.00021 0.00224 0.02988 0.02373
310 15G+4 -0.00187 0.00187 0.00000 -0.00452 0.00452
311 15G-4 0.00287 0.00287 -0.00050 0.02784 0.02784
111 112 113 114 115
(T2)--V (E)--V (E)--V (T2)--V (T2)--V
Eigenvalues -- 4.54858 4.72558 4.72558 4.72678 4.72678
1 1 C 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 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 -0.05943 0.00000
9 7PZ 0.02842 0.00000 0.00000 0.00000 -0.05943
10 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
11 8PY 0.00000 0.00000 0.00000 -1.05212 0.00000
12 8PZ -1.93017 0.00000 0.00000 0.00000 -1.05212
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
14 9PY 0.00000 0.00000 0.00000 -2.25948 0.00000
15 9PZ 15.33496 0.00000 0.00000 0.00000 -2.25948
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
17 10PY 0.00000 0.00000 0.00000 -1.95803 0.00000
18 10PZ 6.97584 0.00000 0.00000 0.00000 -1.95803
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
20 11PY 0.00000 0.00000 0.00000 -0.74039 0.00000
21 11PZ 0.72020 0.00000 0.00000 0.00000 -0.74039
22 12D 0 0.00000 0.01007 0.00001 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.08673 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
25 12D+2 0.00000 -0.00001 0.01007 0.00000 0.00000
26 12D-2 -0.00801 0.00000 0.00000 0.00000 0.08673
27 13D 0 0.00000 -0.16533 -0.00021 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 -0.83777 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00021 -0.16533 0.00000 0.00000
31 13D-2 0.74394 0.00000 0.00000 0.00000 -0.83777
32 14D 0 0.00000 4.01138 0.00520 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 -2.97376 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.00000 -0.00520 4.01138 0.00000 0.00000
36 14D-2 -5.00046 0.00000 0.00000 0.00000 -2.97376
37 15D 0 0.00000 3.70645 0.00480 0.00000 0.00000
38 15D+1 0.00000 0.00000 0.00000 -1.48993 0.00000
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
40 15D+2 0.00000 -0.00480 3.70645 0.00000 0.00000
41 15D-2 -0.20336 0.00000 0.00000 0.00000 -1.48993
42 16F 0 -0.14086 0.00000 0.00000 0.00000 -0.04512
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F-1 0.00000 0.00000 0.00000 0.02763 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 0.03567 0.00000
49 17F 0 1.41645 0.00000 0.00000 0.00000 0.90166
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.00000 -0.55215 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 -0.71282 0.00000
56 18F 0 1.39540 0.00000 0.00000 0.00000 0.50125
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.00000 0.00000 -0.30695 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 -0.39627 0.00000
63 19G 0 0.00000 -0.06968 -0.00009 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 0.04442 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
66 19G+2 0.00000 -0.00014 0.10794 0.00000 0.00000
67 19G-2 0.05788 0.00000 0.00000 0.00000 -0.12564
68 19G+3 0.00000 0.00000 0.00000 0.11752 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.08244 0.00011 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 1.16041 0.00150 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.00000 -0.64968 0.00000
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
75 20G+2 0.00000 0.00233 -1.79771 0.00000 0.00000
76 20G-2 2.16269 0.00000 0.00000 0.00000 1.83759
77 20G+3 0.00000 0.00000 0.00000 -1.71890 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
79 20G+4 0.00000 -1.37302 -0.00178 0.00000 0.00000
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 -0.27518 0.00000 0.00000 0.00000 -0.08652
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
83 21H-1 0.00000 0.00000 0.00000 -0.09371 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 21H-2 0.00000 0.03091 0.00004 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 0.02673 0.00000
88 21H+4 0.14463 0.00000 0.00000 0.00000 -0.09048
89 21H-4 0.00000 -0.00004 0.03091 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 -0.07858 0.00000
92 2 H 1S -0.00904 0.00000 0.00000 0.04743 0.04743
93 2S 0.13975 0.00000 0.00000 -1.55299 -1.55299
94 3S -1.99580 0.00000 0.00000 3.56876 3.56876
95 4S -3.51012 0.00000 0.00000 3.67593 3.67593
96 5S -0.05454 0.00000 0.00000 0.30006 0.30006
97 6PX 0.01737 0.00327 -0.00565 -0.01204 -0.01204
98 6PY 0.01737 0.00326 0.00566 -0.03981 -0.01204
99 6PZ 0.00632 -0.00653 -0.00001 -0.01204 -0.03981
100 7PX -0.15915 -0.01411 0.02437 0.12833 0.12833
101 7PY -0.15915 -0.01405 -0.02441 0.36338 0.12833
102 7PZ 0.02173 0.02816 0.00004 0.12833 0.36338
103 8PX 2.09949 0.20465 -0.35341 -0.51021 -0.51021
104 8PY 2.09949 0.20374 0.35394 -2.25794 -0.51021
105 8PZ -1.88517 -0.40839 -0.00053 -0.51021 -2.25794
106 9PX 1.80605 0.85140 -1.47027 -1.16872 -1.16872
107 9PY 1.80605 0.84759 1.47247 -1.82752 -1.16872
108 9PZ -0.87657 -1.69899 -0.00220 -1.16872 -1.82752
109 10D 0 -0.04888 -0.02377 -0.00003 -0.00532 0.01064
110 10D+1 -0.00937 0.01460 0.02537 0.00635 -0.00758
111 10D-1 -0.00937 0.01467 -0.02533 -0.00758 -0.00758
112 10D+2 0.00000 0.00003 -0.02377 -0.00921 0.00000
113 10D-2 0.01325 -0.02927 -0.00004 -0.00758 0.00635
114 11D 0 0.38989 0.06126 0.00008 -0.00526 0.01053
115 11D+1 0.11028 -0.12559 -0.21818 -0.15788 -0.02094
116 11D-1 0.11028 -0.12615 0.21785 -0.02094 -0.02094
117 11D+2 0.00000 -0.00008 0.06126 -0.00912 0.00000
118 11D-2 -0.10356 0.25174 0.00033 -0.02094 -0.15788
119 12D 0 2.28181 0.17624 0.00023 -0.34179 0.68359
120 12D+1 0.25610 0.63588 1.10469 0.36073 0.92634
121 12D-1 0.25610 0.63874 -1.10303 0.92634 0.92634
122 12D+2 0.00000 -0.00023 0.17624 -0.59200 0.00000
123 12D-2 -1.71710 -1.27463 -0.00165 0.92634 0.36073
124 13F 0 0.01534 -0.04855 -0.00006 0.01842 0.00230
125 13F+1 0.01878 0.02021 0.04606 -0.00542 -0.01714
126 13F-1 0.01878 0.02033 -0.04601 -0.00141 -0.01714
127 13F+2 0.00000 -0.00007 0.05132 0.00741 0.00000
128 13F-2 0.01685 0.00000 0.00000 0.00970 0.00970
129 13F+3 0.01074 0.04643 -0.01747 0.01910 0.01002
130 13F-3 -0.01074 -0.04639 -0.01759 -0.00182 -0.01002
131 14F 0 -0.49809 0.61615 0.00080 -0.05007 -0.02329
132 14F+1 -0.67944 -0.18537 -0.54336 0.14629 -0.08497
133 14F-1 -0.67944 -0.18678 0.54287 0.01426 -0.08497
134 14F+2 0.00000 0.00071 -0.54733 0.14626 0.00000
135 14F-2 -0.07966 0.00000 0.00000 -0.21446 -0.21446
136 14F+3 -0.32712 -0.53415 0.25357 0.04999 -0.12915
137 14F-3 0.32712 0.53349 0.25495 0.01841 0.12915
138 15G 0 -0.00916 -0.02003 -0.00003 -0.00131 -0.00978
139 15G+1 0.03361 -0.00656 0.00636 -0.00608 -0.00144
140 15G-1 0.03361 -0.00654 -0.00637 -0.00105 -0.00144
141 15G+2 0.00000 -0.00004 0.03103 -0.00758 0.00000
142 15G-2 0.02537 0.00632 0.00001 0.00352 0.01720
143 15G+3 0.01020 0.00585 0.00346 -0.01609 -0.00322
144 15G-3 -0.01020 -0.00586 0.00344 0.00337 0.00322
145 15G+4 0.01807 0.02370 0.00003 -0.00684 0.00320
146 15G-4 0.00000 0.00001 -0.00947 0.00021 0.00000
147 3 H 1S -0.00904 0.00000 0.00000 -0.04743 0.04743
148 2S 0.13975 0.00000 0.00000 1.55299 -1.55299
149 3S -1.99580 0.00000 0.00000 -3.56876 3.56876
150 4S -3.51012 0.00000 0.00000 -3.67593 3.67593
151 5S -0.05454 0.00000 0.00000 -0.30006 0.30006
152 6PX -0.01737 -0.00327 0.00565 -0.01204 0.01204
153 6PY -0.01737 -0.00326 -0.00566 -0.03981 0.01204
154 6PZ 0.00632 -0.00653 -0.00001 0.01204 -0.03981
155 7PX 0.15915 0.01411 -0.02437 0.12833 -0.12833
156 7PY 0.15915 0.01405 0.02441 0.36338 -0.12833
157 7PZ 0.02173 0.02816 0.00004 -0.12833 0.36338
158 8PX -2.09949 -0.20465 0.35341 -0.51021 0.51021
159 8PY -2.09949 -0.20374 -0.35394 -2.25794 0.51021
160 8PZ -1.88517 -0.40839 -0.00053 0.51021 -2.25794
161 9PX -1.80605 -0.85140 1.47027 -1.16872 1.16872
162 9PY -1.80605 -0.84759 -1.47247 -1.82752 1.16872
163 9PZ -0.87657 -1.69899 -0.00220 1.16872 -1.82752
164 10D 0 -0.04888 -0.02377 -0.00003 0.00532 0.01064
165 10D+1 0.00937 -0.01460 -0.02537 0.00635 0.00758
166 10D-1 0.00937 -0.01467 0.02533 -0.00758 0.00758
167 10D+2 0.00000 0.00003 -0.02377 0.00921 0.00000
168 10D-2 0.01325 -0.02927 -0.00004 0.00758 0.00635
169 11D 0 0.38989 0.06126 0.00008 0.00526 0.01053
170 11D+1 -0.11028 0.12559 0.21818 -0.15788 0.02094
171 11D-1 -0.11028 0.12615 -0.21785 -0.02094 0.02094
172 11D+2 0.00000 -0.00008 0.06126 0.00912 0.00000
173 11D-2 -0.10356 0.25174 0.00033 0.02094 -0.15788
174 12D 0 2.28181 0.17624 0.00023 0.34179 0.68359
175 12D+1 -0.25610 -0.63588 -1.10469 0.36073 -0.92634
176 12D-1 -0.25610 -0.63874 1.10303 0.92634 -0.92634
177 12D+2 0.00000 -0.00023 0.17624 0.59200 0.00000
178 12D-2 -1.71710 -1.27463 -0.00165 -0.92634 0.36073
179 13F 0 0.01534 -0.04855 -0.00006 -0.01842 0.00230
180 13F+1 -0.01878 -0.02021 -0.04606 -0.00542 0.01714
181 13F-1 -0.01878 -0.02033 0.04601 -0.00141 0.01714
182 13F+2 0.00000 -0.00007 0.05132 -0.00741 0.00000
183 13F-2 0.01685 0.00000 0.00000 -0.00970 0.00970
184 13F+3 -0.01074 -0.04643 0.01747 0.01910 -0.01002
185 13F-3 0.01074 0.04639 0.01759 -0.00182 0.01002
186 14F 0 -0.49809 0.61615 0.00080 0.05007 -0.02329
187 14F+1 0.67944 0.18537 0.54336 0.14629 0.08497
188 14F-1 0.67944 0.18678 -0.54287 0.01426 0.08497
189 14F+2 0.00000 0.00071 -0.54733 -0.14626 0.00000
190 14F-2 -0.07966 0.00000 0.00000 0.21446 -0.21446
191 14F+3 0.32712 0.53415 -0.25357 0.04999 0.12915
192 14F-3 -0.32712 -0.53349 -0.25495 0.01841 -0.12915
193 15G 0 -0.00916 -0.02003 -0.00003 0.00131 -0.00978
194 15G+1 -0.03361 0.00656 -0.00636 -0.00608 0.00144
195 15G-1 -0.03361 0.00654 0.00637 -0.00105 0.00144
196 15G+2 0.00000 -0.00004 0.03103 0.00758 0.00000
197 15G-2 0.02537 0.00632 0.00001 -0.00352 0.01720
198 15G+3 -0.01020 -0.00585 -0.00346 -0.01609 0.00322
199 15G-3 0.01020 0.00586 -0.00344 0.00337 -0.00322
200 15G+4 0.01807 0.02370 0.00003 0.00684 0.00320
201 15G-4 0.00000 0.00001 -0.00947 -0.00021 0.00000
202 4 H 1S 0.00904 0.00000 0.00000 -0.04743 -0.04743
203 2S -0.13975 0.00000 0.00000 1.55299 1.55299
204 3S 1.99580 0.00000 0.00000 -3.56876 -3.56876
205 4S 3.51012 0.00000 0.00000 -3.67593 -3.67593
206 5S 0.05454 0.00000 0.00000 -0.30006 -0.30006
207 6PX -0.01737 0.00327 -0.00565 0.01204 0.01204
208 6PY 0.01737 -0.00326 -0.00566 -0.03981 -0.01204
209 6PZ 0.00632 0.00653 0.00001 -0.01204 -0.03981
210 7PX 0.15915 -0.01411 0.02437 -0.12833 -0.12833
211 7PY -0.15915 0.01405 0.02441 0.36338 0.12833
212 7PZ 0.02173 -0.02816 -0.00004 0.12833 0.36338
213 8PX -2.09949 0.20465 -0.35341 0.51021 0.51021
214 8PY 2.09949 -0.20374 -0.35394 -2.25794 -0.51021
215 8PZ -1.88517 0.40839 0.00053 -0.51021 -2.25794
216 9PX -1.80605 0.85140 -1.47027 1.16872 1.16872
217 9PY 1.80605 -0.84759 -1.47247 -1.82752 -1.16872
218 9PZ -0.87657 1.69899 0.00220 -1.16872 -1.82752
219 10D 0 0.04888 -0.02377 -0.00003 0.00532 -0.01064
220 10D+1 -0.00937 -0.01460 -0.02537 0.00635 -0.00758
221 10D-1 0.00937 0.01467 -0.02533 0.00758 0.00758
222 10D+2 0.00000 0.00003 -0.02377 0.00921 0.00000
223 10D-2 0.01325 0.02927 0.00004 -0.00758 0.00635
224 11D 0 -0.38989 0.06126 0.00008 0.00526 -0.01053
225 11D+1 0.11028 0.12559 0.21818 -0.15788 -0.02094
226 11D-1 -0.11028 -0.12615 0.21785 0.02094 0.02094
227 11D+2 0.00000 -0.00008 0.06126 0.00912 0.00000
228 11D-2 -0.10356 -0.25174 -0.00033 -0.02094 -0.15788
229 12D 0 -2.28181 0.17624 0.00023 0.34179 -0.68359
230 12D+1 0.25610 -0.63588 -1.10469 0.36073 0.92634
231 12D-1 -0.25610 0.63874 -1.10303 -0.92634 -0.92634
232 12D+2 0.00000 -0.00023 0.17624 0.59200 0.00000
233 12D-2 -1.71710 1.27463 0.00165 0.92634 0.36073
234 13F 0 0.01534 0.04855 0.00006 0.01842 0.00230
235 13F+1 -0.01878 0.02021 0.04606 0.00542 0.01714
236 13F-1 0.01878 -0.02033 0.04601 -0.00141 -0.01714
237 13F+2 0.00000 0.00007 -0.05132 0.00741 0.00000
238 13F-2 -0.01685 0.00000 0.00000 -0.00970 -0.00970
239 13F+3 -0.01074 0.04643 -0.01747 -0.01910 -0.01002
240 13F-3 -0.01074 0.04639 0.01759 -0.00182 -0.01002
241 14F 0 -0.49809 -0.61615 -0.00080 -0.05007 -0.02329
242 14F+1 0.67944 -0.18537 -0.54336 -0.14629 0.08497
243 14F-1 -0.67944 0.18678 -0.54287 0.01426 -0.08497
244 14F+2 0.00000 -0.00071 0.54733 0.14626 0.00000
245 14F-2 0.07966 0.00000 0.00000 0.21446 0.21446
246 14F+3 0.32712 -0.53415 0.25357 -0.04999 0.12915
247 14F-3 0.32712 -0.53349 -0.25495 0.01841 0.12915
248 15G 0 0.00916 -0.02003 -0.00003 0.00131 0.00978
249 15G+1 0.03361 0.00656 -0.00636 -0.00608 -0.00144
250 15G-1 -0.03361 -0.00654 -0.00637 0.00105 0.00144
251 15G+2 0.00000 -0.00004 0.03103 0.00758 0.00000
252 15G-2 0.02537 -0.00632 -0.00001 0.00352 0.01720
253 15G+3 0.01020 -0.00585 -0.00346 -0.01609 -0.00322
254 15G-3 0.01020 -0.00586 0.00344 -0.00337 -0.00322
255 15G+4 -0.01807 0.02370 0.00003 0.00684 -0.00320
256 15G-4 0.00000 -0.00001 0.00947 0.00021 0.00000
257 5 H 1S 0.00904 0.00000 0.00000 0.04743 -0.04743
258 2S -0.13975 0.00000 0.00000 -1.55299 1.55299
259 3S 1.99580 0.00000 0.00000 3.56876 -3.56876
260 4S 3.51012 0.00000 0.00000 3.67593 -3.67593
261 5S 0.05454 0.00000 0.00000 0.30006 -0.30006
262 6PX 0.01737 -0.00327 0.00565 0.01204 -0.01204
263 6PY -0.01737 0.00326 0.00566 -0.03981 0.01204
264 6PZ 0.00632 0.00653 0.00001 0.01204 -0.03981
265 7PX -0.15915 0.01411 -0.02437 -0.12833 0.12833
266 7PY 0.15915 -0.01405 -0.02441 0.36338 -0.12833
267 7PZ 0.02173 -0.02816 -0.00004 -0.12833 0.36338
268 8PX 2.09949 -0.20465 0.35341 0.51021 -0.51021
269 8PY -2.09949 0.20374 0.35394 -2.25794 0.51021
270 8PZ -1.88517 0.40839 0.00053 0.51021 -2.25794
271 9PX 1.80605 -0.85140 1.47027 1.16872 -1.16872
272 9PY -1.80605 0.84759 1.47247 -1.82752 1.16872
273 9PZ -0.87657 1.69899 0.00220 1.16872 -1.82752
274 10D 0 0.04888 -0.02377 -0.00003 -0.00532 -0.01064
275 10D+1 0.00937 0.01460 0.02537 0.00635 0.00758
276 10D-1 -0.00937 -0.01467 0.02533 0.00758 -0.00758
277 10D+2 0.00000 0.00003 -0.02377 -0.00921 0.00000
278 10D-2 0.01325 0.02927 0.00004 0.00758 0.00635
279 11D 0 -0.38989 0.06126 0.00008 -0.00526 -0.01053
280 11D+1 -0.11028 -0.12559 -0.21818 -0.15788 0.02094
281 11D-1 0.11028 0.12615 -0.21785 0.02094 -0.02094
282 11D+2 0.00000 -0.00008 0.06126 -0.00912 0.00000
283 11D-2 -0.10356 -0.25174 -0.00033 0.02094 -0.15788
284 12D 0 -2.28181 0.17624 0.00023 -0.34179 -0.68359
285 12D+1 -0.25610 0.63588 1.10469 0.36073 -0.92634
286 12D-1 0.25610 -0.63874 1.10303 -0.92634 0.92634
287 12D+2 0.00000 -0.00023 0.17624 -0.59200 0.00000
288 12D-2 -1.71710 1.27463 0.00165 -0.92634 0.36073
289 13F 0 0.01534 0.04855 0.00006 -0.01842 0.00230
290 13F+1 0.01878 -0.02021 -0.04606 0.00542 -0.01714
291 13F-1 -0.01878 0.02033 -0.04601 -0.00141 0.01714
292 13F+2 0.00000 0.00007 -0.05132 -0.00741 0.00000
293 13F-2 -0.01685 0.00000 0.00000 0.00970 -0.00970
294 13F+3 0.01074 -0.04643 0.01747 -0.01910 0.01002
295 13F-3 0.01074 -0.04639 -0.01759 -0.00182 0.01002
296 14F 0 -0.49809 -0.61615 -0.00080 0.05007 -0.02329
297 14F+1 -0.67944 0.18537 0.54336 -0.14629 -0.08497
298 14F-1 0.67944 -0.18678 0.54287 0.01426 0.08497
299 14F+2 0.00000 -0.00071 0.54733 -0.14626 0.00000
300 14F-2 0.07966 0.00000 0.00000 -0.21446 0.21446
301 14F+3 -0.32712 0.53415 -0.25357 -0.04999 -0.12915
302 14F-3 -0.32712 0.53349 0.25495 0.01841 -0.12915
303 15G 0 0.00916 -0.02003 -0.00003 -0.00131 0.00978
304 15G+1 -0.03361 -0.00656 0.00636 -0.00608 0.00144
305 15G-1 0.03361 0.00654 0.00637 0.00105 -0.00144
306 15G+2 0.00000 -0.00004 0.03103 -0.00758 0.00000
307 15G-2 0.02537 -0.00632 -0.00001 -0.00352 0.01720
308 15G+3 -0.01020 0.00585 0.00346 -0.01609 0.00322
309 15G-3 -0.01020 0.00586 -0.00344 -0.00337 0.00322
310 15G+4 -0.01807 0.02370 0.00003 -0.00684 -0.00320
311 15G-4 0.00000 -0.00001 0.00947 -0.00021 0.00000
116 117 118 119 120
(T2)--V (A1)--V (T1)--V (T1)--V (T1)--V
Eigenvalues -- 4.72678 4.75704 4.81206 4.81206 4.81206
1 1 C 1S 0.00000 -0.07588 0.00000 0.00000 0.00000
2 2S 0.00000 -0.13702 0.00000 0.00000 0.00000
3 3S 0.00000 -2.17338 0.00000 0.00000 0.00000
4 4S 0.00000 4.11369 0.00000 0.00000 0.00000
5 5S 0.00000 33.47420 0.00000 0.00000 0.00000
6 6S 0.00000 6.59108 0.00000 0.00000 0.00000
7 7PX -0.05943 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 -1.05212 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 -2.25948 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 -1.95803 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 -0.74039 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 0.08673 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 -0.83777 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 -2.97376 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 -1.48993 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 0.02763 0.00000 -0.17390 0.00000 0.00000
44 16F-1 0.00000 0.00000 0.00000 -0.17390 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 -0.21997
46 16F-2 0.00000 0.01049 0.00000 0.00000 0.00000
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48 16F-3 0.00000 0.00000 0.00000 0.13470 0.00000
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157 7PZ -0.12833 -0.19535 -0.10568 -0.10568 0.00000
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162 9PY -1.16872 -1.56064 1.05569 0.00000 -1.05569
163 9PZ 1.16872 1.56064 1.05569 1.05569 0.00000
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172 11D+2 -0.00912 0.00000 0.07880 -0.07880 -0.15760
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176 12D-1 0.36073 0.79942 0.00000 0.85962 0.85962
177 12D+2 -0.59200 0.00000 -0.91134 0.91134 1.82269
178 12D-2 -0.92634 -0.79942 0.85962 0.85962 0.00000
179 13F 0 -0.01842 0.03288 -0.01837 -0.01837 0.00000
180 13F+1 -0.00141 0.02014 0.00822 0.01761 0.00489
181 13F-1 -0.00542 0.02014 0.01761 0.00822 -0.00489
182 13F+2 0.00741 0.00000 -0.00804 0.00804 0.01040
183 13F-2 -0.00970 0.03538 0.00000 0.00000 0.00000
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185 13F-3 -0.01910 0.02600 0.00960 -0.00637 -0.01945
186 14F 0 0.05007 -0.49340 0.34756 0.34756 0.00000
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188 14F-1 0.14629 -0.30214 -0.44108 -0.39335 -0.01540
189 14F+2 0.14626 0.00000 0.28870 -0.28870 -0.49756
190 14F-2 0.21446 0.09707 0.00000 0.00000 0.00000
191 14F+3 -0.01841 0.39006 -0.30469 0.09798 0.45157
192 14F-3 -0.04999 -0.39006 -0.09798 0.30469 0.45157
193 15G 0 0.00131 0.01152 0.00793 0.00793 0.00000
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195 15G-1 -0.00608 -0.00540 0.02820 0.02190 -0.00455
196 15G+2 -0.00758 0.00000 -0.00709 0.00709 0.01418
197 15G-2 -0.00352 -0.01528 -0.02453 -0.02453 0.00000
198 15G+3 -0.00337 -0.01429 0.01795 -0.01066 -0.02795
199 15G-3 0.01609 0.01429 0.01066 -0.01795 -0.02795
200 15G+4 0.00684 0.00974 -0.00938 -0.00938 0.00000
201 15G-4 0.00021 0.00000 -0.01414 0.01414 0.03015
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203 2S -1.55299 0.90053 0.00000 0.00000 0.00000
204 3S 3.56876 -8.40336 0.00000 0.00000 0.00000
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206 5S 0.30006 -0.23708 0.00000 0.00000 0.00000
207 6PX -0.03981 0.01473 0.00000 -0.01048 0.01048
208 6PY 0.01204 -0.01473 -0.01048 0.00000 0.01048
209 6PZ 0.01204 -0.01473 0.01048 -0.01048 0.00000
210 7PX 0.36338 -0.19535 0.00000 0.10568 -0.10568
211 7PY -0.12833 0.19535 0.10568 0.00000 -0.10568
212 7PZ -0.12833 0.19535 -0.10568 0.10568 0.00000
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215 8PZ 0.51021 -2.29452 1.40960 -1.40960 0.00000
216 9PX -1.82752 1.56064 0.00000 -1.05569 1.05569
217 9PY 1.16872 -1.56064 -1.05569 0.00000 1.05569
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232 12D+2 0.59200 0.00000 0.91134 0.91134 -1.82269
233 12D-2 -0.92634 0.79942 0.85962 -0.85962 0.00000
234 13F 0 -0.01842 -0.03288 -0.01837 0.01837 0.00000
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236 13F-1 0.00542 0.02014 -0.01761 0.00822 0.00489
237 13F+2 0.00741 0.00000 -0.00804 -0.00804 0.01040
238 13F-2 0.00970 0.03538 0.00000 0.00000 0.00000
239 13F+3 0.00182 0.02600 0.00637 0.00960 -0.01945
240 13F-3 0.01910 0.02600 -0.00960 -0.00637 0.01945
241 14F 0 0.05007 0.49340 0.34756 -0.34756 0.00000
242 14F+1 0.01426 0.30214 -0.39335 0.44108 0.01540
243 14F-1 -0.14629 -0.30214 0.44108 -0.39335 0.01540
244 14F+2 0.14626 0.00000 0.28870 0.28870 -0.49756
245 14F-2 -0.21446 0.09707 0.00000 0.00000 0.00000
246 14F+3 -0.01841 -0.39006 -0.30469 -0.09798 0.45157
247 14F-3 0.04999 -0.39006 0.09798 0.30469 -0.45157
248 15G 0 -0.00131 0.01152 -0.00793 0.00793 0.00000
249 15G+1 0.00105 -0.00540 -0.02190 0.02820 -0.00455
250 15G-1 -0.00608 0.00540 0.02820 -0.02190 -0.00455
251 15G+2 0.00758 0.00000 0.00709 0.00709 -0.01418
252 15G-2 -0.00352 0.01528 -0.02453 0.02453 0.00000
253 15G+3 0.00337 -0.01429 -0.01795 -0.01066 0.02795
254 15G-3 0.01609 -0.01429 0.01066 0.01795 -0.02795
255 15G+4 -0.00684 0.00974 0.00938 -0.00938 0.00000
256 15G-4 0.00021 0.00000 -0.01414 -0.01414 0.03015
257 5 H 1S -0.04743 -0.02412 0.00000 0.00000 0.00000
258 2S 1.55299 0.90053 0.00000 0.00000 0.00000
259 3S -3.56876 -8.40336 0.00000 0.00000 0.00000
260 4S -3.67593 -4.93300 0.00000 0.00000 0.00000
261 5S -0.30006 -0.23708 0.00000 0.00000 0.00000
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263 6PY 0.01204 0.01473 -0.01048 0.00000 -0.01048
264 6PZ -0.01204 -0.01473 -0.01048 0.01048 0.00000
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266 7PY -0.12833 -0.19535 0.10568 0.00000 0.10568
267 7PZ 0.12833 0.19535 0.10568 -0.10568 0.00000
268 8PX -2.25794 -2.29452 0.00000 -1.40960 -1.40960
269 8PY 0.51021 2.29452 -1.40960 0.00000 -1.40960
270 8PZ -0.51021 -2.29452 -1.40960 1.40960 0.00000
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272 9PY 1.16872 1.56064 -1.05569 0.00000 -1.05569
273 9PZ -1.16872 -1.56064 -1.05569 1.05569 0.00000
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276 10D-1 0.00635 -0.03064 0.00000 -0.01793 -0.01793
277 10D+2 -0.00921 0.00000 -0.01254 -0.01254 -0.02508
278 10D-2 -0.00758 -0.03064 -0.01793 0.01793 0.00000
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281 11D-1 -0.15788 0.23699 0.00000 0.10167 0.10167
282 11D+2 -0.00912 0.00000 0.07880 0.07880 0.15760
283 11D-2 -0.02094 0.23699 0.10167 -0.10167 0.00000
284 12D 0 0.34179 0.00000 -1.57849 1.57849 0.00000
285 12D+1 -0.92634 -0.79942 -0.85962 0.00000 -0.85962
286 12D-1 0.36073 0.79942 0.00000 -0.85962 -0.85962
287 12D+2 -0.59200 0.00000 -0.91134 -0.91134 -1.82269
288 12D-2 0.92634 0.79942 -0.85962 0.85962 0.00000
289 13F 0 0.01842 -0.03288 0.01837 -0.01837 0.00000
290 13F+1 -0.00141 0.02014 0.00822 -0.01761 -0.00489
291 13F-1 0.00542 -0.02014 -0.01761 0.00822 -0.00489
292 13F+2 -0.00741 0.00000 0.00804 0.00804 0.01040
293 13F-2 -0.00970 0.03538 0.00000 0.00000 0.00000
294 13F+3 0.00182 -0.02600 0.00637 0.00960 0.01945
295 13F-3 0.01910 -0.02600 -0.00960 -0.00637 -0.01945
296 14F 0 -0.05007 0.49340 -0.34756 0.34756 0.00000
297 14F+1 0.01426 -0.30214 -0.39335 0.44108 -0.01540
298 14F-1 -0.14629 0.30214 0.44108 -0.39335 -0.01540
299 14F+2 -0.14626 0.00000 -0.28870 -0.28870 -0.49756
300 14F-2 0.21446 0.09707 0.00000 0.00000 0.00000
301 14F+3 -0.01841 0.39006 -0.30469 -0.09798 -0.45157
302 14F-3 0.04999 0.39006 0.09798 0.30469 0.45157
303 15G 0 0.00131 0.01152 0.00793 -0.00793 0.00000
304 15G+1 0.00105 0.00540 -0.02190 0.02820 0.00455
305 15G-1 -0.00608 -0.00540 0.02820 -0.02190 0.00455
306 15G+2 -0.00758 0.00000 -0.00709 -0.00709 -0.01418
307 15G-2 0.00352 0.01528 0.02453 -0.02453 0.00000
308 15G+3 0.00337 0.01429 -0.01795 -0.01066 -0.02795
309 15G-3 0.01609 0.01429 0.01066 0.01795 0.02795
310 15G+4 0.00684 0.00974 -0.00938 0.00938 0.00000
311 15G-4 -0.00021 0.00000 0.01414 0.01414 0.03015
121 122 123 124 125
(T1)--V (T1)--V (T1)--V (T2)--V (T2)--V
Eigenvalues -- 4.87807 4.87807 4.87807 4.91405 4.91405
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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 0.00000 0.00000 0.00000
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12 8PZ 0.00000 0.00000 0.00000 0.00000 -1.07139
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
14 9PY 0.00000 0.00000 0.00000 25.19907 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 25.19907
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
17 10PY 0.00000 0.00000 0.00000 11.33656 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 11.33656
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
20 11PY 0.00000 0.00000 0.00000 0.31592 0.00000
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25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 -0.11231
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 0.90634 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 0.90634
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 10.35112 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 10.35112
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 0.00000 2.73933 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 2.73933
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00496
43 16F+1 -0.00289 0.00000 0.00000 0.00000 0.00000
44 16F-1 0.00000 -0.00289 0.00000 -0.00304 0.00000
45 16F+2 0.00000 0.00000 -0.00365 0.00000 0.00000
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95 4S 0.00000 0.00000 0.00000 -8.51987 -8.51987
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99 6PZ -0.02074 -0.02074 0.00000 0.00985 0.01805
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101 7PY -0.14946 0.00000 -0.14946 -0.16227 -0.16318
102 7PZ 0.14946 0.14946 0.00000 -0.16318 -0.16227
103 8PX 0.00000 0.58512 -0.58512 4.34024 4.34024
104 8PY 0.58512 0.00000 0.58512 3.34085 4.34024
105 8PZ -0.58512 -0.58512 0.00000 4.34024 3.34085
106 9PX 0.00000 0.05434 -0.05434 2.95991 2.95991
107 9PY 0.05434 0.00000 0.05434 2.60216 2.95991
108 9PZ -0.05434 -0.05434 0.00000 2.95991 2.60216
109 10D 0 -0.02381 -0.02381 0.00000 0.01002 -0.02005
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112 10D+2 -0.01375 0.01375 -0.02749 0.01736 0.00000
113 10D-2 -0.03158 -0.03158 0.00000 0.00866 0.05828
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115 11D+1 -0.16555 0.00000 -0.16555 -0.51522 -0.12659
116 11D-1 0.00000 -0.16555 0.16555 -0.12659 -0.12659
117 11D+2 0.10616 -0.10616 0.21231 -0.18523 0.00000
118 11D-2 0.16555 0.16555 0.00000 -0.12659 -0.51522
119 12D 0 -0.25490 -0.25490 0.00000 -0.20151 0.40303
120 12D+1 0.23580 0.00000 0.23580 -1.83803 -1.50777
121 12D-1 0.00000 0.23580 -0.23580 -1.50777 -1.50777
122 12D+2 -0.14717 0.14717 -0.29433 -0.34903 0.00000
123 12D-2 -0.23580 -0.23580 0.00000 -1.50777 -1.83803
124 13F 0 -0.03303 -0.03303 0.00000 0.02639 -0.00998
125 13F+1 -0.02870 -0.03593 0.00452 -0.02101 -0.01131
126 13F-1 -0.03593 -0.02870 -0.00452 0.00611 -0.01131
127 13F+2 -0.01987 0.01987 -0.03631 -0.00613 0.00000
128 13F-2 0.00000 0.00000 0.00000 -0.03007 -0.03007
129 13F+3 -0.02223 0.01394 -0.03828 0.01711 0.02462
130 13F-3 -0.01394 0.02223 -0.03828 0.00789 -0.02462
131 14F 0 0.40294 0.40294 0.00000 -0.42268 -0.26118
132 14F+1 0.17868 0.36095 -0.13254 0.46011 0.05756
133 14F-1 0.36095 0.17868 0.13254 0.15994 0.05756
134 14F+2 0.14446 -0.14446 0.22602 0.25459 0.00000
135 14F-2 0.00000 0.00000 0.00000 0.74378 0.74378
136 14F+3 0.13841 -0.23009 0.40701 -0.17825 -0.49006
137 14F-3 0.23009 -0.13841 0.40701 0.20648 0.49006
138 15G 0 -0.00809 -0.00809 0.00000 0.01540 0.01728
139 15G+1 -0.01107 -0.01239 0.00942 0.00366 0.01151
140 15G-1 -0.01239 -0.01107 -0.00942 0.00328 0.01151
141 15G+2 0.00723 -0.00723 0.01447 0.00168 0.00000
142 15G-2 -0.00234 -0.00234 0.00000 -0.02092 -0.01035
143 15G+3 0.00168 0.00468 -0.00606 0.00968 0.01802
144 15G-3 -0.00468 -0.00168 -0.00606 -0.02113 -0.01802
145 15G+4 0.00957 0.00957 0.00000 0.01429 0.01206
146 15G-4 -0.01095 0.01095 -0.01325 -0.00440 0.00000
147 3 H 1S 0.00000 0.00000 0.00000 0.01730 -0.01730
148 2S 0.00000 0.00000 0.00000 -0.58700 0.58700
149 3S 0.00000 0.00000 0.00000 12.90916 -12.90916
150 4S 0.00000 0.00000 0.00000 8.51987 -8.51987
151 5S 0.00000 0.00000 0.00000 -0.14949 0.14949
152 6PX 0.00000 0.02074 0.02074 0.00985 -0.00985
153 6PY 0.02074 0.00000 -0.02074 0.01805 -0.00985
154 6PZ 0.02074 0.02074 0.00000 -0.00985 0.01805
155 7PX 0.00000 -0.14946 -0.14946 -0.16318 0.16318
156 7PY -0.14946 0.00000 0.14946 -0.16227 0.16318
157 7PZ -0.14946 -0.14946 0.00000 0.16318 -0.16227
158 8PX 0.00000 0.58512 0.58512 4.34024 -4.34024
159 8PY 0.58512 0.00000 -0.58512 3.34085 -4.34024
160 8PZ 0.58512 0.58512 0.00000 -4.34024 3.34085
161 9PX 0.00000 0.05434 0.05434 2.95991 -2.95991
162 9PY 0.05434 0.00000 -0.05434 2.60216 -2.95991
163 9PZ 0.05434 0.05434 0.00000 -2.95991 2.60216
164 10D 0 0.02381 0.02381 0.00000 -0.01002 -0.02005
165 10D+1 0.03158 0.00000 -0.03158 0.05828 -0.00866
166 10D-1 0.00000 0.03158 0.03158 0.00866 -0.00866
167 10D+2 0.01375 -0.01375 -0.02749 -0.01736 0.00000
168 10D-2 0.03158 0.03158 0.00000 -0.00866 0.05828
169 11D 0 -0.18387 -0.18387 0.00000 0.10694 0.21388
170 11D+1 -0.16555 0.00000 0.16555 -0.51522 0.12659
171 11D-1 0.00000 -0.16555 -0.16555 -0.12659 0.12659
172 11D+2 -0.10616 0.10616 0.21231 0.18523 0.00000
173 11D-2 -0.16555 -0.16555 0.00000 0.12659 -0.51522
174 12D 0 0.25490 0.25490 0.00000 0.20151 0.40303
175 12D+1 0.23580 0.00000 -0.23580 -1.83803 1.50777
176 12D-1 0.00000 0.23580 0.23580 -1.50777 1.50777
177 12D+2 0.14717 -0.14717 -0.29433 0.34903 0.00000
178 12D-2 0.23580 0.23580 0.00000 1.50777 -1.83803
179 13F 0 0.03303 0.03303 0.00000 -0.02639 -0.00998
180 13F+1 -0.02870 -0.03593 -0.00452 -0.02101 0.01131
181 13F-1 -0.03593 -0.02870 0.00452 0.00611 0.01131
182 13F+2 0.01987 -0.01987 -0.03631 0.00613 0.00000
183 13F-2 0.00000 0.00000 0.00000 0.03007 -0.03007
184 13F+3 -0.02223 0.01394 0.03828 0.01711 -0.02462
185 13F-3 -0.01394 0.02223 0.03828 0.00789 0.02462
186 14F 0 -0.40294 -0.40294 0.00000 0.42268 -0.26118
187 14F+1 0.17868 0.36095 0.13254 0.46011 -0.05756
188 14F-1 0.36095 0.17868 -0.13254 0.15994 -0.05756
189 14F+2 -0.14446 0.14446 0.22602 -0.25459 0.00000
190 14F-2 0.00000 0.00000 0.00000 -0.74378 0.74378
191 14F+3 0.13841 -0.23009 -0.40701 -0.17825 0.49006
192 14F-3 0.23009 -0.13841 -0.40701 0.20648 -0.49006
193 15G 0 0.00809 0.00809 0.00000 -0.01540 0.01728
194 15G+1 -0.01107 -0.01239 -0.00942 0.00366 -0.01151
195 15G-1 -0.01239 -0.01107 0.00942 0.00328 -0.01151
196 15G+2 -0.00723 0.00723 0.01447 -0.00168 0.00000
197 15G-2 0.00234 0.00234 0.00000 0.02092 -0.01035
198 15G+3 0.00168 0.00468 0.00606 0.00968 -0.01802
199 15G-3 -0.00468 -0.00168 0.00606 -0.02113 0.01802
200 15G+4 -0.00957 -0.00957 0.00000 -0.01429 0.01206
201 15G-4 0.01095 -0.01095 -0.01325 0.00440 0.00000
202 4 H 1S 0.00000 0.00000 0.00000 0.01730 0.01730
203 2S 0.00000 0.00000 0.00000 -0.58700 -0.58700
204 3S 0.00000 0.00000 0.00000 12.90916 12.90916
205 4S 0.00000 0.00000 0.00000 8.51987 8.51987
206 5S 0.00000 0.00000 0.00000 -0.14949 -0.14949
207 6PX 0.00000 -0.02074 0.02074 -0.00985 -0.00985
208 6PY -0.02074 0.00000 0.02074 0.01805 0.00985
209 6PZ 0.02074 -0.02074 0.00000 0.00985 0.01805
210 7PX 0.00000 0.14946 -0.14946 0.16318 0.16318
211 7PY 0.14946 0.00000 -0.14946 -0.16227 -0.16318
212 7PZ -0.14946 0.14946 0.00000 -0.16318 -0.16227
213 8PX 0.00000 -0.58512 0.58512 -4.34024 -4.34024
214 8PY -0.58512 0.00000 0.58512 3.34085 4.34024
215 8PZ 0.58512 -0.58512 0.00000 4.34024 3.34085
216 9PX 0.00000 -0.05434 0.05434 -2.95991 -2.95991
217 9PY -0.05434 0.00000 0.05434 2.60216 2.95991
218 9PZ 0.05434 -0.05434 0.00000 2.95991 2.60216
219 10D 0 -0.02381 0.02381 0.00000 -0.01002 0.02005
220 10D+1 -0.03158 0.00000 0.03158 0.05828 0.00866
221 10D-1 0.00000 -0.03158 0.03158 -0.00866 -0.00866
222 10D+2 -0.01375 -0.01375 0.02749 -0.01736 0.00000
223 10D-2 0.03158 -0.03158 0.00000 0.00866 0.05828
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225 11D+1 0.16555 0.00000 -0.16555 -0.51522 -0.12659
226 11D-1 0.00000 0.16555 -0.16555 0.12659 0.12659
227 11D+2 0.10616 0.10616 -0.21231 0.18523 0.00000
228 11D-2 -0.16555 0.16555 0.00000 -0.12659 -0.51522
229 12D 0 -0.25490 0.25490 0.00000 0.20151 -0.40303
230 12D+1 -0.23580 0.00000 0.23580 -1.83803 -1.50777
231 12D-1 0.00000 -0.23580 0.23580 1.50777 1.50777
232 12D+2 -0.14717 -0.14717 0.29433 0.34903 0.00000
233 12D-2 0.23580 -0.23580 0.00000 -1.50777 -1.83803
234 13F 0 0.03303 -0.03303 0.00000 0.02639 -0.00998
235 13F+1 -0.02870 0.03593 -0.00452 0.02101 0.01131
236 13F-1 0.03593 -0.02870 -0.00452 0.00611 -0.01131
237 13F+2 0.01987 0.01987 -0.03631 -0.00613 0.00000
238 13F-2 0.00000 0.00000 0.00000 0.03007 0.03007
239 13F+3 -0.02223 -0.01394 0.03828 -0.01711 -0.02462
240 13F-3 0.01394 0.02223 -0.03828 0.00789 -0.02462
241 14F 0 -0.40294 0.40294 0.00000 -0.42268 -0.26118
242 14F+1 0.17868 -0.36095 0.13254 -0.46011 -0.05756
243 14F-1 -0.36095 0.17868 0.13254 0.15994 0.05756
244 14F+2 -0.14446 -0.14446 0.22602 0.25459 0.00000
245 14F-2 0.00000 0.00000 0.00000 -0.74378 -0.74378
246 14F+3 0.13841 0.23009 -0.40701 0.17825 0.49006
247 14F-3 -0.23009 -0.13841 0.40701 0.20648 0.49006
248 15G 0 -0.00809 0.00809 0.00000 -0.01540 -0.01728
249 15G+1 0.01107 -0.01239 0.00942 0.00366 0.01151
250 15G-1 -0.01239 0.01107 0.00942 -0.00328 -0.01151
251 15G+2 0.00723 0.00723 -0.01447 -0.00168 0.00000
252 15G-2 0.00234 -0.00234 0.00000 -0.02092 -0.01035
253 15G+3 -0.00168 0.00468 -0.00606 0.00968 0.01802
254 15G-3 -0.00468 0.00168 0.00606 0.02113 0.01802
255 15G+4 0.00957 -0.00957 0.00000 -0.01429 -0.01206
256 15G-4 0.01095 0.01095 -0.01325 -0.00440 0.00000
257 5 H 1S 0.00000 0.00000 0.00000 -0.01730 0.01730
258 2S 0.00000 0.00000 0.00000 0.58700 -0.58700
259 3S 0.00000 0.00000 0.00000 -12.90916 12.90916
260 4S 0.00000 0.00000 0.00000 -8.51987 8.51987
261 5S 0.00000 0.00000 0.00000 0.14949 -0.14949
262 6PX 0.00000 -0.02074 -0.02074 -0.00985 0.00985
263 6PY -0.02074 0.00000 -0.02074 0.01805 -0.00985
264 6PZ -0.02074 0.02074 0.00000 -0.00985 0.01805
265 7PX 0.00000 0.14946 0.14946 0.16318 -0.16318
266 7PY 0.14946 0.00000 0.14946 -0.16227 0.16318
267 7PZ 0.14946 -0.14946 0.00000 0.16318 -0.16227
268 8PX 0.00000 -0.58512 -0.58512 -4.34024 4.34024
269 8PY -0.58512 0.00000 -0.58512 3.34085 -4.34024
270 8PZ -0.58512 0.58512 0.00000 -4.34024 3.34085
271 9PX 0.00000 -0.05434 -0.05434 -2.95991 2.95991
272 9PY -0.05434 0.00000 -0.05434 2.60216 -2.95991
273 9PZ -0.05434 0.05434 0.00000 -2.95991 2.60216
274 10D 0 0.02381 -0.02381 0.00000 0.01002 0.02005
275 10D+1 -0.03158 0.00000 -0.03158 0.05828 -0.00866
276 10D-1 0.00000 -0.03158 -0.03158 -0.00866 0.00866
277 10D+2 0.01375 0.01375 0.02749 0.01736 0.00000
278 10D-2 -0.03158 0.03158 0.00000 -0.00866 0.05828
279 11D 0 -0.18387 0.18387 0.00000 -0.10694 -0.21388
280 11D+1 0.16555 0.00000 0.16555 -0.51522 0.12659
281 11D-1 0.00000 0.16555 0.16555 0.12659 -0.12659
282 11D+2 -0.10616 -0.10616 -0.21231 -0.18523 0.00000
283 11D-2 0.16555 -0.16555 0.00000 0.12659 -0.51522
284 12D 0 0.25490 -0.25490 0.00000 -0.20151 -0.40303
285 12D+1 -0.23580 0.00000 -0.23580 -1.83803 1.50777
286 12D-1 0.00000 -0.23580 -0.23580 1.50777 -1.50777
287 12D+2 0.14717 0.14717 0.29433 -0.34903 0.00000
288 12D-2 -0.23580 0.23580 0.00000 1.50777 -1.83803
289 13F 0 -0.03303 0.03303 0.00000 -0.02639 -0.00998
290 13F+1 -0.02870 0.03593 0.00452 0.02101 -0.01131
291 13F-1 0.03593 -0.02870 0.00452 0.00611 0.01131
292 13F+2 -0.01987 -0.01987 -0.03631 0.00613 0.00000
293 13F-2 0.00000 0.00000 0.00000 -0.03007 0.03007
294 13F+3 -0.02223 -0.01394 -0.03828 -0.01711 0.02462
295 13F-3 0.01394 0.02223 0.03828 0.00789 0.02462
296 14F 0 0.40294 -0.40294 0.00000 0.42268 -0.26118
297 14F+1 0.17868 -0.36095 -0.13254 -0.46011 0.05756
298 14F-1 -0.36095 0.17868 -0.13254 0.15994 -0.05756
299 14F+2 0.14446 0.14446 0.22602 -0.25459 0.00000
300 14F-2 0.00000 0.00000 0.00000 0.74378 -0.74378
301 14F+3 0.13841 0.23009 0.40701 0.17825 -0.49006
302 14F-3 -0.23009 -0.13841 -0.40701 0.20648 -0.49006
303 15G 0 0.00809 -0.00809 0.00000 0.01540 -0.01728
304 15G+1 0.01107 -0.01239 -0.00942 0.00366 -0.01151
305 15G-1 -0.01239 0.01107 -0.00942 -0.00328 0.01151
306 15G+2 -0.00723 -0.00723 -0.01447 0.00168 0.00000
307 15G-2 -0.00234 0.00234 0.00000 0.02092 -0.01035
308 15G+3 -0.00168 0.00468 0.00606 0.00968 -0.01802
309 15G-3 -0.00468 0.00168 -0.00606 0.02113 -0.01802
310 15G+4 -0.00957 0.00957 0.00000 0.01429 -0.01206
311 15G-4 -0.01095 -0.01095 -0.01325 0.00440 0.00000
126 127 128 129 130
(T2)--V (A1)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 4.91405 5.19328 5.37278 5.37278 5.37278
1 1 C 1S 0.00000 -0.03273 0.00000 0.00000 0.00000
2 2S 0.00000 0.08389 0.00000 0.00000 0.00000
3 3S 0.00000 0.40477 0.00000 0.00000 0.00000
4 4S 0.00000 -12.32544 0.00000 0.00000 0.00000
5 5S 0.00000 40.53042 0.00000 0.00000 0.00000
6 6S 0.00000 4.25837 0.00000 0.00000 0.00000
7 7PX -0.01658 0.00000 0.00000 0.00000 0.04005
8 7PY 0.00000 0.00000 0.00000 0.04005 0.00000
9 7PZ 0.00000 0.00000 0.04005 0.00000 0.00000
10 8PX -1.07139 0.00000 0.00000 0.00000 -0.20779
11 8PY 0.00000 0.00000 0.00000 -0.20779 0.00000
12 8PZ 0.00000 0.00000 -0.20779 0.00000 0.00000
13 9PX 25.19907 0.00000 0.00000 0.00000 2.57363
14 9PY 0.00000 0.00000 0.00000 2.57363 0.00000
15 9PZ 0.00000 0.00000 2.57363 0.00000 0.00000
16 10PX 11.33656 0.00000 0.00000 0.00000 6.20486
17 10PY 0.00000 0.00000 0.00000 6.20486 0.00000
18 10PZ 0.00000 0.00000 6.20486 0.00000 0.00000
19 11PX 0.31592 0.00000 0.00000 0.00000 0.37168
20 11PY 0.00000 0.00000 0.00000 0.37168 0.00000
21 11PZ 0.00000 0.00000 0.37168 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 0.00474 0.00000
24 12D-1 -0.11231 0.00000 0.00000 0.00000 0.00474
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00474 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 -0.52342 0.00000
29 13D-1 0.90634 0.00000 0.00000 0.00000 -0.52342
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 -0.52342 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 3.19436 0.00000
34 14D-1 10.35112 0.00000 0.00000 0.00000 3.19436
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 3.19436 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 2.57677 0.00000
39 15D-1 2.73933 0.00000 0.00000 0.00000 2.57677
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 2.57677 0.00000 0.00000
42 16F 0 0.00000 0.00000 -0.04450 0.00000 0.00000
43 16F+1 -0.00304 0.00000 0.00000 0.00000 0.02725
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45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
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119 12D 0 -0.20151 0.00000 -0.63095 0.31548 0.31548
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123 12D-2 -1.50777 0.32925 -0.85257 0.58265 0.58265
124 13F 0 0.02639 -0.02282 -0.03569 0.00903 0.00903
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126 13F-1 -0.02101 0.01397 0.01918 0.02186 -0.03024
127 13F+2 0.00613 0.00000 0.00000 -0.03125 0.03125
128 13F-2 -0.03007 0.03863 -0.00057 -0.00057 -0.00057
129 13F+3 -0.00789 -0.01804 0.02628 -0.01200 -0.02822
130 13F-3 -0.01711 0.01804 -0.02628 0.02822 0.01200
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138 15G 0 0.01540 -0.00470 -0.00439 0.00616 0.00616
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144 15G-3 -0.00968 0.00438 -0.00048 0.00578 0.00462
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146 15G-4 0.00440 0.00000 0.00000 0.00885 -0.00885
147 3 H 1S 0.01730 0.04737 0.00280 -0.00280 -0.00280
148 2S -0.58700 -0.74182 0.24192 -0.24192 -0.24192
149 3S 12.90916 -9.08932 -2.60676 2.60676 2.60676
150 4S 8.51987 -3.66729 -3.03750 3.03750 3.03750
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156 7PY -0.16318 0.08846 -0.07491 -0.08604 0.07491
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160 8PZ -4.34024 1.91735 0.63827 -0.41445 -0.41445
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163 9PZ -2.95991 0.62649 0.09004 -0.51242 -0.51242
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176 12D-1 -1.83803 -0.32925 -0.58265 0.58265 -0.85257
177 12D+2 -0.34903 0.00000 0.00000 -0.54642 0.54642
178 12D-2 1.50777 0.32925 -0.85257 -0.58265 -0.58265
179 13F 0 -0.02639 -0.02282 -0.03569 -0.00903 -0.00903
180 13F+1 0.00611 -0.01397 -0.01918 -0.03024 0.02186
181 13F-1 -0.02101 -0.01397 -0.01918 0.02186 -0.03024
182 13F+2 -0.00613 0.00000 0.00000 0.03125 -0.03125
183 13F-2 0.03007 0.03863 -0.00057 0.00057 0.00057
184 13F+3 -0.00789 0.01804 -0.02628 -0.01200 -0.02822
185 13F-3 -0.01711 -0.01804 0.02628 0.02822 0.01200
186 14F 0 0.42268 0.10766 0.42551 0.18109 0.18109
187 14F+1 0.15994 0.06593 0.10095 0.32273 -0.26057
188 14F-1 0.46011 0.06593 0.10095 -0.26057 0.32273
189 14F+2 0.25459 0.00000 0.00000 -0.26796 0.26796
190 14F-2 -0.74378 -0.18048 0.05966 -0.05966 -0.05966
191 14F+3 -0.20648 -0.08511 0.30725 0.02093 0.33640
192 14F-3 0.17825 0.08511 -0.30725 -0.33640 -0.02093
193 15G 0 -0.01540 -0.00470 -0.00439 -0.00616 -0.00616
194 15G+1 0.00328 0.00165 0.00928 -0.00175 0.00728
195 15G-1 0.00366 0.00165 0.00928 0.00728 -0.00175
196 15G+2 0.00168 0.00000 0.00000 0.00944 -0.00944
197 15G-2 0.02092 0.00468 0.00494 -0.00283 -0.00283
198 15G+3 0.02113 0.00438 -0.00048 -0.00462 -0.00578
199 15G-3 -0.00968 -0.00438 0.00048 0.00578 0.00462
200 15G+4 -0.01429 -0.00397 0.01056 0.00193 0.00193
201 15G-4 -0.00440 0.00000 0.00000 -0.00885 0.00885
202 4 H 1S -0.01730 0.04737 -0.00280 -0.00280 0.00280
203 2S 0.58700 -0.74182 -0.24192 -0.24192 0.24192
204 3S -12.90916 -9.08932 2.60676 2.60676 -2.60676
205 4S -8.51987 -3.66729 3.03750 3.03750 -3.03750
206 5S 0.14949 0.02047 -0.07540 -0.07540 0.07540
207 6PX 0.01805 0.00415 0.01122 0.01122 0.00937
208 6PY -0.00985 -0.00415 -0.01122 0.00937 0.01122
209 6PZ -0.00985 -0.00415 0.00937 -0.01122 0.01122
210 7PX -0.16227 -0.08846 -0.07491 -0.07491 -0.08604
211 7PY 0.16318 0.08846 0.07491 -0.08604 -0.07491
212 7PZ 0.16318 0.08846 -0.08604 0.07491 -0.07491
213 8PX 3.34085 1.91735 -0.41445 -0.41445 0.63827
214 8PY -4.34024 -1.91735 0.41445 0.63827 -0.41445
215 8PZ -4.34024 -1.91735 0.63827 0.41445 -0.41445
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217 9PY -2.95991 -0.62649 0.51242 0.09004 -0.51242
218 9PZ -2.95991 -0.62649 0.09004 0.51242 -0.51242
219 10D 0 0.01002 0.00000 0.06249 -0.03124 0.03124
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222 10D+2 -0.01736 0.00000 0.00000 -0.05412 -0.05412
223 10D-2 -0.00866 -0.02680 -0.06230 0.05060 -0.05060
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228 11D-2 0.12659 0.40166 0.38197 -0.41635 0.41635
229 12D 0 -0.20151 0.00000 0.63095 -0.31548 0.31548
230 12D+1 1.50777 -0.32925 0.58265 -0.85257 -0.58265
231 12D-1 -1.83803 0.32925 -0.58265 -0.58265 -0.85257
232 12D+2 0.34903 0.00000 0.00000 -0.54642 -0.54642
233 12D-2 1.50777 -0.32925 -0.85257 0.58265 -0.58265
234 13F 0 -0.02639 0.02282 -0.03569 0.00903 -0.00903
235 13F+1 0.00611 0.01397 -0.01918 0.03024 0.02186
236 13F-1 0.02101 -0.01397 0.01918 0.02186 0.03024
237 13F+2 -0.00613 0.00000 0.00000 -0.03125 -0.03125
238 13F-2 -0.03007 0.03863 0.00057 0.00057 -0.00057
239 13F+3 -0.00789 -0.01804 -0.02628 0.01200 -0.02822
240 13F-3 0.01711 -0.01804 -0.02628 0.02822 -0.01200
241 14F 0 0.42268 -0.10766 0.42551 -0.18109 0.18109
242 14F+1 0.15994 -0.06593 0.10095 -0.32273 -0.26057
243 14F-1 -0.46011 0.06593 -0.10095 -0.26057 -0.32273
244 14F+2 0.25459 0.00000 0.00000 0.26796 0.26796
245 14F-2 0.74378 -0.18048 -0.05966 -0.05966 0.05966
246 14F+3 -0.20648 0.08511 0.30725 -0.02093 0.33640
247 14F-3 -0.17825 0.08511 0.30725 -0.33640 0.02093
248 15G 0 0.01540 -0.00470 0.00439 -0.00616 0.00616
249 15G+1 -0.00328 0.00165 -0.00928 -0.00175 -0.00728
250 15G-1 0.00366 -0.00165 0.00928 -0.00728 -0.00175
251 15G+2 -0.00168 0.00000 0.00000 0.00944 0.00944
252 15G-2 0.02092 -0.00468 0.00494 0.00283 -0.00283
253 15G+3 -0.02113 0.00438 0.00048 -0.00462 0.00578
254 15G-3 -0.00968 0.00438 0.00048 -0.00578 0.00462
255 15G+4 0.01429 -0.00397 -0.01056 0.00193 -0.00193
256 15G-4 -0.00440 0.00000 0.00000 0.00885 0.00885
257 5 H 1S 0.01730 0.04737 -0.00280 0.00280 -0.00280
258 2S -0.58700 -0.74182 -0.24192 0.24192 -0.24192
259 3S 12.90916 -9.08932 2.60676 -2.60676 2.60676
260 4S 8.51987 -3.66729 3.03750 -3.03750 3.03750
261 5S -0.14949 0.02047 -0.07540 0.07540 -0.07540
262 6PX 0.01805 -0.00415 -0.01122 0.01122 0.00937
263 6PY -0.00985 0.00415 0.01122 0.00937 0.01122
264 6PZ 0.00985 -0.00415 0.00937 0.01122 -0.01122
265 7PX -0.16227 0.08846 0.07491 -0.07491 -0.08604
266 7PY 0.16318 -0.08846 -0.07491 -0.08604 -0.07491
267 7PZ -0.16318 0.08846 -0.08604 -0.07491 0.07491
268 8PX 3.34085 -1.91735 0.41445 -0.41445 0.63827
269 8PY -4.34024 1.91735 -0.41445 0.63827 -0.41445
270 8PZ 4.34024 -1.91735 0.63827 -0.41445 0.41445
271 9PX 2.60216 -0.62649 0.51242 -0.51242 0.09004
272 9PY -2.95991 0.62649 -0.51242 0.09004 -0.51242
273 9PZ 2.95991 -0.62649 0.09004 -0.51242 0.51242
274 10D 0 -0.01002 0.00000 0.06249 0.03124 -0.03124
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276 10D-1 0.05828 -0.02680 0.05060 -0.05060 -0.06230
277 10D+2 0.01736 0.00000 0.00000 0.05412 0.05412
278 10D-2 0.00866 -0.02680 -0.06230 -0.05060 0.05060
279 11D 0 0.10694 0.00000 -0.37857 -0.18928 0.18928
280 11D+1 0.12659 -0.40166 0.41635 0.38197 0.41635
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283 11D-2 -0.12659 0.40166 0.38197 0.41635 -0.41635
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285 12D+1 1.50777 0.32925 -0.58265 -0.85257 -0.58265
286 12D-1 -1.83803 -0.32925 0.58265 -0.58265 -0.85257
287 12D+2 -0.34903 0.00000 0.00000 0.54642 0.54642
288 12D-2 -1.50777 -0.32925 -0.85257 -0.58265 0.58265
289 13F 0 0.02639 0.02282 -0.03569 -0.00903 0.00903
290 13F+1 0.00611 -0.01397 0.01918 0.03024 0.02186
291 13F-1 0.02101 0.01397 -0.01918 0.02186 0.03024
292 13F+2 0.00613 0.00000 0.00000 0.03125 0.03125
293 13F-2 0.03007 0.03863 0.00057 -0.00057 0.00057
294 13F+3 -0.00789 0.01804 0.02628 0.01200 -0.02822
295 13F-3 0.01711 0.01804 0.02628 0.02822 -0.01200
296 14F 0 -0.42268 -0.10766 0.42551 0.18109 -0.18109
297 14F+1 0.15994 0.06593 -0.10095 -0.32273 -0.26057
298 14F-1 -0.46011 -0.06593 0.10095 -0.26057 -0.32273
299 14F+2 -0.25459 0.00000 0.00000 -0.26796 -0.26796
300 14F-2 -0.74378 -0.18048 -0.05966 0.05966 -0.05966
301 14F+3 -0.20648 -0.08511 -0.30725 -0.02093 0.33640
302 14F-3 -0.17825 -0.08511 -0.30725 -0.33640 0.02093
303 15G 0 -0.01540 -0.00470 0.00439 0.00616 -0.00616
304 15G+1 -0.00328 -0.00165 0.00928 -0.00175 -0.00728
305 15G-1 0.00366 0.00165 -0.00928 -0.00728 -0.00175
306 15G+2 0.00168 0.00000 0.00000 -0.00944 -0.00944
307 15G-2 -0.02092 -0.00468 0.00494 -0.00283 0.00283
308 15G+3 -0.02113 -0.00438 -0.00048 -0.00462 0.00578
309 15G-3 -0.00968 -0.00438 -0.00048 -0.00578 0.00462
310 15G+4 -0.01429 -0.00397 -0.01056 -0.00193 0.00193
311 15G-4 0.00440 0.00000 0.00000 -0.00885 -0.00885
131 132 133 134 135
(T2)--V (T2)--V (T2)--V (T1)--V (T1)--V
Eigenvalues -- 5.43068 5.43068 5.43068 5.48947 5.48947
1 1 C 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 -0.19255 0.00000 0.00000
8 7PY 0.00000 -0.19255 0.00000 0.00000 0.00000
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11 8PY 0.00000 -0.62624 0.00000 0.00000 0.00000
12 8PZ -0.62624 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 -1.46129 0.00000 0.00000
14 9PY 0.00000 -1.46129 0.00000 0.00000 0.00000
15 9PZ -1.46129 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 -0.15190 0.00000 0.00000
17 10PY 0.00000 -0.15190 0.00000 0.00000 0.00000
18 10PZ -0.15190 0.00000 0.00000 0.00000 0.00000
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21 11PZ -0.60113 0.00000 0.00000 0.00000 0.00000
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24 12D-1 0.00000 0.00000 -0.00279 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 -0.00279 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 0.40330 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.40330 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
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62 18F-3 0.00000 -1.44517 0.00000 0.00000 0.00000
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67 19G-2 -0.12558 0.00000 0.00000 0.00000 0.00000
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74 20G-1 0.00000 0.00000 -0.01318 2.26062 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
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78 20G-3 0.00000 0.00000 0.03486 0.85444 0.00000
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80 20G-4 0.00000 0.00000 0.00000 0.00000 2.41671
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85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
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93 2S -0.01439 -0.01439 -0.01439 0.00000 0.00000
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95 4S -0.89831 -0.89831 -0.89831 0.00000 0.00000
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97 6PX 0.02710 0.02710 0.00535 0.00000 -0.00519
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99 6PZ 0.00535 0.02710 0.02710 -0.00519 0.00000
100 7PX -0.18783 -0.18783 -0.04904 0.00000 0.09800
101 7PY -0.18783 -0.04904 -0.18783 -0.09800 -0.09800
102 7PZ -0.04904 -0.18783 -0.18783 0.09800 0.00000
103 8PX 0.17122 0.17122 0.23461 0.00000 -1.04894
104 8PY 0.17122 0.23461 0.17122 1.04894 1.04894
105 8PZ 0.23461 0.17122 0.17122 -1.04894 0.00000
106 9PX 0.05715 0.05715 0.72486 0.00000 -0.32031
107 9PY 0.05715 0.72486 0.05715 0.32031 0.32031
108 9PZ 0.72486 0.05715 0.05715 -0.32031 0.00000
109 10D 0 -0.02608 0.01304 0.01304 0.00178 0.00000
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111 10D-1 -0.01005 -0.01005 -0.06638 0.00000 0.05637
112 10D+2 0.00000 0.02259 -0.02259 0.00103 0.00205
113 10D-2 -0.06638 -0.01005 -0.01005 0.05637 0.00000
114 11D 0 0.20920 -0.10460 -0.10460 0.06667 0.00000
115 11D+1 0.08671 0.42834 0.08671 0.42098 0.42098
116 11D-1 0.08671 0.08671 0.42834 0.00000 -0.42098
117 11D+2 0.00000 -0.18118 0.18118 0.03849 0.07699
118 11D-2 0.42834 0.08671 0.08671 -0.42098 0.00000
119 12D 0 -1.10838 0.55419 0.55419 0.45172 0.00000
120 12D+1 -0.09502 -0.22830 -0.09502 0.71364 0.71364
121 12D-1 -0.09502 -0.09502 -0.22830 0.00000 -0.71364
122 12D+2 0.00000 0.95988 -0.95988 0.26080 0.52160
123 12D-2 -0.22830 -0.09502 -0.09502 -0.71364 0.00000
124 13F 0 -0.03637 0.01685 0.01685 -0.03579 0.00000
125 13F+1 -0.03248 0.01184 0.02227 -0.00360 0.04922
126 13F-1 -0.03248 0.02227 0.01184 0.00538 -0.04922
127 13F+2 0.00000 0.02803 -0.02803 0.03454 -0.00455
128 13F-2 0.02687 0.02687 0.02687 0.00000 0.00000
129 13F+3 -0.00384 0.03049 -0.02876 -0.00279 -0.00715
130 13F-3 0.00384 0.02876 -0.03049 -0.04945 -0.00715
131 14F 0 0.41363 -0.19095 -0.19095 0.37351 0.00000
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133 14F-1 0.40478 -0.25330 -0.17091 -0.23329 0.69075
134 14F+2 0.00000 -0.36410 0.36410 -0.58441 -0.46834
135 14F-2 -0.28431 -0.28431 -0.28431 0.00000 0.00000
136 14F+3 0.07200 -0.37392 0.32701 -0.28680 -0.06259
137 14F-3 -0.07200 -0.32701 0.37392 0.65317 -0.06259
138 15G 0 0.00468 -0.00291 -0.00291 -0.01359 0.00000
139 15G+1 -0.00811 0.00284 0.00639 0.00794 0.00094
140 15G-1 -0.00811 0.00639 0.00284 -0.00228 -0.00094
141 15G+2 0.00000 0.00679 -0.00679 0.01216 0.02431
142 15G-2 -0.00804 0.00243 0.00243 0.01255 0.00000
143 15G+3 0.00047 0.00752 -0.00501 0.01042 0.01307
144 15G-3 -0.00047 0.00501 -0.00752 -0.00086 0.01307
145 15G+4 -0.00631 0.00267 0.00267 0.01608 0.00000
146 15G-4 0.00000 0.00775 -0.00775 0.00374 -0.00244
147 3 H 1S 0.00577 -0.00577 -0.00577 0.00000 0.00000
148 2S -0.01439 0.01439 0.01439 0.00000 0.00000
149 3S 0.41010 -0.41010 -0.41010 0.00000 0.00000
150 4S -0.89831 0.89831 0.89831 0.00000 0.00000
151 5S 0.46287 -0.46287 -0.46287 0.00000 0.00000
152 6PX -0.02710 0.02710 0.00535 0.00000 0.00519
153 6PY -0.02710 0.00535 0.02710 0.00519 -0.00519
154 6PZ 0.00535 -0.02710 -0.02710 0.00519 0.00000
155 7PX 0.18783 -0.18783 -0.04904 0.00000 -0.09800
156 7PY 0.18783 -0.04904 -0.18783 -0.09800 0.09800
157 7PZ -0.04904 0.18783 0.18783 -0.09800 0.00000
158 8PX -0.17122 0.17122 0.23461 0.00000 1.04894
159 8PY -0.17122 0.23461 0.17122 1.04894 -1.04894
160 8PZ 0.23461 -0.17122 -0.17122 1.04894 0.00000
161 9PX -0.05715 0.05715 0.72486 0.00000 0.32031
162 9PY -0.05715 0.72486 0.05715 0.32031 -0.32031
163 9PZ 0.72486 -0.05715 -0.05715 0.32031 0.00000
164 10D 0 -0.02608 -0.01304 -0.01304 -0.00178 0.00000
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166 10D-1 0.01005 -0.01005 -0.06638 0.00000 -0.05637
167 10D+2 0.00000 -0.02259 0.02259 -0.00103 0.00205
168 10D-2 -0.06638 0.01005 0.01005 -0.05637 0.00000
169 11D 0 0.20920 0.10460 0.10460 -0.06667 0.00000
170 11D+1 -0.08671 0.42834 0.08671 0.42098 -0.42098
171 11D-1 -0.08671 0.08671 0.42834 0.00000 0.42098
172 11D+2 0.00000 0.18118 -0.18118 -0.03849 0.07699
173 11D-2 0.42834 -0.08671 -0.08671 0.42098 0.00000
174 12D 0 -1.10838 -0.55419 -0.55419 -0.45172 0.00000
175 12D+1 0.09502 -0.22830 -0.09502 0.71364 -0.71364
176 12D-1 0.09502 -0.09502 -0.22830 0.00000 0.71364
177 12D+2 0.00000 -0.95988 0.95988 -0.26080 0.52160
178 12D-2 -0.22830 0.09502 0.09502 0.71364 0.00000
179 13F 0 -0.03637 -0.01685 -0.01685 0.03579 0.00000
180 13F+1 0.03248 0.01184 0.02227 -0.00360 -0.04922
181 13F-1 0.03248 0.02227 0.01184 0.00538 0.04922
182 13F+2 0.00000 -0.02803 0.02803 -0.03454 -0.00455
183 13F-2 0.02687 -0.02687 -0.02687 0.00000 0.00000
184 13F+3 0.00384 0.03049 -0.02876 -0.00279 0.00715
185 13F-3 -0.00384 0.02876 -0.03049 -0.04945 0.00715
186 14F 0 0.41363 0.19095 0.19095 -0.37351 0.00000
187 14F+1 -0.40478 -0.17091 -0.25330 -0.37025 0.69075
188 14F-1 -0.40478 -0.25330 -0.17091 -0.23329 -0.69075
189 14F+2 0.00000 0.36410 -0.36410 0.58441 -0.46834
190 14F-2 -0.28431 0.28431 0.28431 0.00000 0.00000
191 14F+3 -0.07200 -0.37392 0.32701 -0.28680 0.06259
192 14F-3 0.07200 -0.32701 0.37392 0.65317 0.06259
193 15G 0 0.00468 0.00291 0.00291 0.01359 0.00000
194 15G+1 0.00811 0.00284 0.00639 0.00794 -0.00094
195 15G-1 0.00811 0.00639 0.00284 -0.00228 0.00094
196 15G+2 0.00000 -0.00679 0.00679 -0.01216 0.02431
197 15G-2 -0.00804 -0.00243 -0.00243 -0.01255 0.00000
198 15G+3 -0.00047 0.00752 -0.00501 0.01042 -0.01307
199 15G-3 0.00047 0.00501 -0.00752 -0.00086 -0.01307
200 15G+4 -0.00631 -0.00267 -0.00267 -0.01608 0.00000
201 15G-4 0.00000 -0.00775 0.00775 -0.00374 -0.00244
202 4 H 1S -0.00577 -0.00577 0.00577 0.00000 0.00000
203 2S 0.01439 0.01439 -0.01439 0.00000 0.00000
204 3S -0.41010 -0.41010 0.41010 0.00000 0.00000
205 4S 0.89831 0.89831 -0.89831 0.00000 0.00000
206 5S -0.46287 -0.46287 0.46287 0.00000 0.00000
207 6PX -0.02710 -0.02710 0.00535 0.00000 0.00519
208 6PY 0.02710 0.00535 -0.02710 -0.00519 0.00519
209 6PZ 0.00535 0.02710 -0.02710 0.00519 0.00000
210 7PX 0.18783 0.18783 -0.04904 0.00000 -0.09800
211 7PY -0.18783 -0.04904 0.18783 0.09800 -0.09800
212 7PZ -0.04904 -0.18783 0.18783 -0.09800 0.00000
213 8PX -0.17122 -0.17122 0.23461 0.00000 1.04894
214 8PY 0.17122 0.23461 -0.17122 -1.04894 1.04894
215 8PZ 0.23461 0.17122 -0.17122 1.04894 0.00000
216 9PX -0.05715 -0.05715 0.72486 0.00000 0.32031
217 9PY 0.05715 0.72486 -0.05715 -0.32031 0.32031
218 9PZ 0.72486 0.05715 -0.05715 0.32031 0.00000
219 10D 0 0.02608 -0.01304 0.01304 0.00178 0.00000
220 10D+1 -0.01005 -0.06638 0.01005 0.05637 -0.05637
221 10D-1 0.01005 0.01005 -0.06638 0.00000 -0.05637
222 10D+2 0.00000 -0.02259 -0.02259 0.00103 -0.00205
223 10D-2 -0.06638 -0.01005 0.01005 -0.05637 0.00000
224 11D 0 -0.20920 0.10460 -0.10460 0.06667 0.00000
225 11D+1 0.08671 0.42834 -0.08671 -0.42098 0.42098
226 11D-1 -0.08671 -0.08671 0.42834 0.00000 0.42098
227 11D+2 0.00000 0.18118 0.18118 0.03849 -0.07699
228 11D-2 0.42834 0.08671 -0.08671 0.42098 0.00000
229 12D 0 1.10838 -0.55419 0.55419 0.45172 0.00000
230 12D+1 -0.09502 -0.22830 0.09502 -0.71364 0.71364
231 12D-1 0.09502 0.09502 -0.22830 0.00000 0.71364
232 12D+2 0.00000 -0.95988 -0.95988 0.26080 -0.52160
233 12D-2 -0.22830 -0.09502 0.09502 0.71364 0.00000
234 13F 0 -0.03637 0.01685 -0.01685 0.03579 0.00000
235 13F+1 0.03248 -0.01184 0.02227 -0.00360 -0.04922
236 13F-1 -0.03248 0.02227 -0.01184 -0.00538 -0.04922
237 13F+2 0.00000 0.02803 0.02803 -0.03454 -0.00455
238 13F-2 -0.02687 -0.02687 0.02687 0.00000 0.00000
239 13F+3 0.00384 -0.03049 -0.02876 -0.00279 0.00715
240 13F-3 0.00384 0.02876 0.03049 0.04945 -0.00715
241 14F 0 0.41363 -0.19095 0.19095 -0.37351 0.00000
242 14F+1 -0.40478 0.17091 -0.25330 -0.37025 0.69075
243 14F-1 0.40478 -0.25330 0.17091 0.23329 0.69075
244 14F+2 0.00000 -0.36410 -0.36410 0.58441 -0.46834
245 14F-2 0.28431 0.28431 -0.28431 0.00000 0.00000
246 14F+3 -0.07200 0.37392 0.32701 -0.28680 0.06259
247 14F-3 -0.07200 -0.32701 -0.37392 -0.65317 -0.06259
248 15G 0 -0.00468 0.00291 -0.00291 -0.01359 0.00000
249 15G+1 -0.00811 0.00284 -0.00639 -0.00794 0.00094
250 15G-1 0.00811 -0.00639 0.00284 -0.00228 0.00094
251 15G+2 0.00000 -0.00679 -0.00679 0.01216 -0.02431
252 15G-2 -0.00804 0.00243 -0.00243 -0.01255 0.00000
253 15G+3 0.00047 0.00752 0.00501 -0.01042 0.01307
254 15G-3 0.00047 -0.00501 -0.00752 -0.00086 -0.01307
255 15G+4 0.00631 -0.00267 0.00267 0.01608 0.00000
256 15G-4 0.00000 0.00775 0.00775 -0.00374 -0.00244
257 5 H 1S -0.00577 0.00577 -0.00577 0.00000 0.00000
258 2S 0.01439 -0.01439 0.01439 0.00000 0.00000
259 3S -0.41010 0.41010 -0.41010 0.00000 0.00000
260 4S 0.89831 -0.89831 0.89831 0.00000 0.00000
261 5S -0.46287 0.46287 -0.46287 0.00000 0.00000
262 6PX 0.02710 -0.02710 0.00535 0.00000 -0.00519
263 6PY -0.02710 0.00535 -0.02710 -0.00519 -0.00519
264 6PZ 0.00535 -0.02710 0.02710 -0.00519 0.00000
265 7PX -0.18783 0.18783 -0.04904 0.00000 0.09800
266 7PY 0.18783 -0.04904 0.18783 0.09800 0.09800
267 7PZ -0.04904 0.18783 -0.18783 0.09800 0.00000
268 8PX 0.17122 -0.17122 0.23461 0.00000 -1.04894
269 8PY -0.17122 0.23461 -0.17122 -1.04894 -1.04894
270 8PZ 0.23461 -0.17122 0.17122 -1.04894 0.00000
271 9PX 0.05715 -0.05715 0.72486 0.00000 -0.32031
272 9PY -0.05715 0.72486 -0.05715 -0.32031 -0.32031
273 9PZ 0.72486 -0.05715 0.05715 -0.32031 0.00000
274 10D 0 0.02608 0.01304 -0.01304 -0.00178 0.00000
275 10D+1 0.01005 -0.06638 0.01005 0.05637 0.05637
276 10D-1 -0.01005 0.01005 -0.06638 0.00000 0.05637
277 10D+2 0.00000 0.02259 0.02259 -0.00103 -0.00205
278 10D-2 -0.06638 0.01005 -0.01005 0.05637 0.00000
279 11D 0 -0.20920 -0.10460 0.10460 -0.06667 0.00000
280 11D+1 -0.08671 0.42834 -0.08671 -0.42098 -0.42098
281 11D-1 0.08671 -0.08671 0.42834 0.00000 -0.42098
282 11D+2 0.00000 -0.18118 -0.18118 -0.03849 -0.07699
283 11D-2 0.42834 -0.08671 0.08671 -0.42098 0.00000
284 12D 0 1.10838 0.55419 -0.55419 -0.45172 0.00000
285 12D+1 0.09502 -0.22830 0.09502 -0.71364 -0.71364
286 12D-1 -0.09502 0.09502 -0.22830 0.00000 -0.71364
287 12D+2 0.00000 0.95988 0.95988 -0.26080 -0.52160
288 12D-2 -0.22830 0.09502 -0.09502 -0.71364 0.00000
289 13F 0 -0.03637 -0.01685 0.01685 -0.03579 0.00000
290 13F+1 -0.03248 -0.01184 0.02227 -0.00360 0.04922
291 13F-1 0.03248 0.02227 -0.01184 -0.00538 0.04922
292 13F+2 0.00000 -0.02803 -0.02803 0.03454 -0.00455
293 13F-2 -0.02687 0.02687 -0.02687 0.00000 0.00000
294 13F+3 -0.00384 -0.03049 -0.02876 -0.00279 -0.00715
295 13F-3 -0.00384 0.02876 0.03049 0.04945 0.00715
296 14F 0 0.41363 0.19095 -0.19095 0.37351 0.00000
297 14F+1 0.40478 0.17091 -0.25330 -0.37025 -0.69075
298 14F-1 -0.40478 -0.25330 0.17091 0.23329 -0.69075
299 14F+2 0.00000 0.36410 0.36410 -0.58441 -0.46834
300 14F-2 0.28431 -0.28431 0.28431 0.00000 0.00000
301 14F+3 0.07200 0.37392 0.32701 -0.28680 -0.06259
302 14F-3 0.07200 -0.32701 -0.37392 -0.65317 0.06259
303 15G 0 -0.00468 -0.00291 0.00291 0.01359 0.00000
304 15G+1 0.00811 0.00284 -0.00639 -0.00794 -0.00094
305 15G-1 -0.00811 -0.00639 0.00284 -0.00228 -0.00094
306 15G+2 0.00000 0.00679 0.00679 -0.01216 -0.02431
307 15G-2 -0.00804 -0.00243 0.00243 0.01255 0.00000
308 15G+3 -0.00047 0.00752 0.00501 -0.01042 -0.01307
309 15G-3 -0.00047 -0.00501 -0.00752 -0.00086 0.01307
310 15G+4 0.00631 0.00267 -0.00267 -0.01608 0.00000
311 15G-4 0.00000 -0.00775 -0.00775 0.00374 -0.00244
136 137 138 139 140
(T1)--V (E)--V (E)--V (T1)--V (T1)--V
Eigenvalues -- 5.48947 5.51353 5.51353 5.67718 5.67718
1 1 C 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 0.00000 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 -0.12389 -0.03808 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 0.03808 -0.12389 0.00000 0.00000
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237 13F+2 -0.03454 0.01719 -0.05592 0.02330 -0.04312
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
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240 13F-3 0.00279 0.02792 -0.03852 -0.02119 -0.00735
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243 14F-1 -0.37025 0.41252 0.11247 -0.16007 -0.30236
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245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
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247 14F-3 0.28680 -0.22635 0.31922 0.27095 0.08725
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252 15G-2 0.01255 -0.00244 -0.00075 0.00745 0.00000
253 15G+3 0.00086 -0.00181 -0.00204 0.00657 -0.00737
254 15G-3 0.01042 -0.00264 0.00067 -0.00190 0.00737
255 15G+4 -0.01608 -0.00093 -0.00028 -0.00269 0.00000
256 15G-4 -0.00374 -0.00109 0.00354 0.00113 -0.00538
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267 7PZ -0.09800 -0.09080 -0.02791 0.23060 0.00000
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288 12D-2 0.71364 0.43073 0.13238 0.67835 0.00000
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291 13F-1 -0.00360 0.05050 0.01329 0.01306 -0.02379
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295 13F-3 0.00279 -0.02792 0.03852 -0.02119 0.00735
296 14F 0 -0.37351 0.31503 0.09682 -0.11618 0.00000
297 14F+1 0.23329 0.40447 0.13863 0.36346 0.30236
298 14F-1 -0.37025 -0.41252 -0.11247 -0.16007 0.30236
299 14F+2 -0.58441 -0.14008 0.45576 0.29247 0.45975
300 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
301 14F+3 0.65317 0.00799 0.39125 0.28154 0.08725
302 14F-3 0.28680 0.22635 -0.31922 0.27095 -0.08725
303 15G 0 -0.01359 0.00078 0.00024 -0.00227 0.00000
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305 15G-1 -0.00794 0.00170 0.00315 -0.00504 0.00158
306 15G+2 -0.01216 0.00037 -0.00121 0.00203 0.00407
307 15G-2 -0.01255 -0.00244 -0.00075 -0.00745 0.00000
308 15G+3 0.00086 0.00181 0.00204 0.00657 0.00737
309 15G-3 0.01042 0.00264 -0.00067 -0.00190 -0.00737
310 15G+4 0.01608 -0.00093 -0.00028 0.00269 0.00000
311 15G-4 0.00374 -0.00109 0.00354 -0.00113 -0.00538
141 142 143 144 145
(T1)--V (T2)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 5.67718 5.75963 5.75963 5.75963 6.02143
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12 8PZ 0.00000 -3.90501 0.00000 0.00000 0.00000
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14 9PY 0.00000 0.00000 25.80433 0.00000 11.71566
15 9PZ 0.00000 25.80433 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 13.86382 0.00000
17 10PY 0.00000 0.00000 13.86382 0.00000 2.88327
18 10PZ 0.00000 13.86382 0.00000 0.00000 0.00000
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21 11PZ 0.00000 -0.12184 0.00000 0.00000 0.00000
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27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
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29 13D-1 0.00000 0.00000 0.00000 -1.46082 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 -1.46082 0.00000 0.00000 0.00000
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33 14D+1 0.00000 0.00000 18.51161 0.00000 3.11368
34 14D-1 0.00000 0.00000 0.00000 18.51161 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 18.51161 0.00000 0.00000 0.00000
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38 15D+1 0.00000 0.00000 4.36499 0.00000 1.44473
39 15D-1 0.00000 0.00000 0.00000 4.36499 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 4.36499 0.00000 0.00000 0.00000
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44 16F-1 0.02631 0.00000 -0.12709 0.00000 -0.03852
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 0.16408 0.00000
48 16F-3 -0.02038 0.00000 -0.16408 0.00000 -0.04973
49 17F 0 0.00000 -2.56465 0.00000 0.00000 0.00000
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51 17F-1 -0.41971 0.00000 1.57052 0.00000 1.08634
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 -2.02753 0.00000
55 17F-3 0.32511 0.00000 2.02753 0.00000 1.40245
56 18F 0 0.00000 -2.64033 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 0.00000 1.61687 0.00000
58 18F-1 2.29229 0.00000 1.61687 0.00000 1.58937
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 -2.08737 0.00000
62 18F-3 -1.77560 0.00000 2.08737 0.00000 2.05186
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 -0.07378 0.00000 -0.04245 0.00000 -0.00883
65 19G-1 0.00000 0.00000 0.00000 -0.04245 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.12008 0.00000 0.00000 0.00000
68 19G+3 0.02789 0.00000 -0.11232 0.00000 -0.02336
69 19G-3 0.00000 0.00000 0.00000 0.11232 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 0.54468 0.00000 0.06213 0.00000 -0.50655
74 20G-1 0.00000 0.00000 0.00000 0.06213 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 -0.17573 0.00000 0.00000 0.00000
77 20G+3 -0.20587 0.00000 0.16438 0.00000 -1.34021
78 20G-3 0.00000 0.00000 0.00000 -0.16438 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 0.08176 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 0.00000 -0.08005 0.00000
83 21H-1 -0.07401 0.00000 -0.08005 0.00000 0.00468
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 -0.20889 0.00000
87 21H-3 -0.03426 0.00000 0.20889 0.00000 -0.11127
88 21H+4 0.00000 -0.20884 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 0.01609 0.00000
91 21H-5 0.07661 0.00000 0.01609 0.00000 -0.04524
92 2 H 1S 0.00000 -0.00973 -0.00973 -0.00973 0.01053
93 2S 0.00000 0.51470 0.51470 0.51470 -0.27071
94 3S 0.00000 -16.49307 -16.49307 -16.49307 -5.53808
95 4S 0.00000 -7.85804 -7.85804 -7.85804 -2.18974
96 5S 0.00000 0.40541 0.40541 0.40541 0.09409
97 6PX 0.03058 0.00911 0.00911 0.00345 0.01851
98 6PY 0.00000 0.00911 0.00345 0.00911 0.00510
99 6PZ -0.03058 0.00345 0.00911 0.00911 0.01851
100 7PX -0.23060 -0.13055 -0.13055 -0.17393 -0.21443
101 7PY 0.00000 -0.13055 -0.17393 -0.13055 -0.08135
102 7PZ 0.23060 -0.17393 -0.13055 -0.13055 -0.21443
103 8PX 0.85149 3.98450 3.98450 5.47538 2.01054
104 8PY 0.00000 3.98450 5.47538 3.98450 1.33299
105 8PZ -0.85149 5.47538 3.98450 3.98450 2.01054
106 9PX 0.06474 2.10098 2.10098 2.03291 0.60883
107 9PY 0.00000 2.10098 2.03291 2.10098 0.82484
108 9PZ -0.06474 2.03291 2.10098 2.10098 0.60883
109 10D 0 0.04503 0.06059 -0.03030 -0.03030 0.02202
110 10D+1 0.00000 0.02234 0.01448 0.02234 -0.00580
111 10D-1 -0.07226 0.02234 0.02234 0.01448 0.02808
112 10D+2 -0.02600 0.00000 -0.05248 0.05248 0.03814
113 10D-2 0.07226 0.01448 0.02234 0.02234 0.02808
114 11D 0 -0.30132 -0.50817 0.25408 0.25408 -0.18000
115 11D+1 0.00000 -0.44595 -0.31492 -0.44595 -0.07733
116 11D-1 0.48162 -0.44595 -0.44595 -0.31492 -0.24273
117 11D+2 0.17397 0.00000 0.44009 -0.44009 -0.31177
118 11D-2 -0.48162 -0.31492 -0.44595 -0.44595 -0.24273
119 12D 0 0.31405 -0.25291 0.12646 0.12646 -0.39075
120 12D+1 0.00000 -0.60578 -0.75182 -0.60578 -0.23274
121 12D-1 -0.67835 -0.60578 -0.60578 -0.75182 -0.71760
122 12D+2 -0.18132 0.00000 0.21903 -0.21903 -0.67679
123 12D-2 0.67835 -0.75182 -0.60578 -0.60578 -0.71760
124 13F 0 0.00876 -0.04663 -0.04103 -0.04103 -0.02698
125 13F+1 -0.01306 0.05673 -0.00647 0.02856 0.02767
126 13F-1 -0.03409 0.05673 0.02856 -0.00647 -0.03694
127 13F+2 0.02330 0.00000 -0.03997 0.03997 0.01411
128 13F-2 0.00000 0.05008 0.05008 0.05008 -0.00968
129 13F+3 -0.02119 -0.00796 -0.05692 -0.03686 -0.01269
130 13F-3 0.02641 0.00796 0.03686 0.05692 -0.04769
131 14F 0 -0.11618 0.47712 0.13233 0.13233 0.22861
132 14F+1 0.16007 -0.22304 0.06097 -0.29217 -0.14564
133 14F-1 0.36346 -0.22304 -0.29217 0.06097 0.51201
134 14F+2 -0.29247 0.00000 0.17962 -0.17962 -0.00714
135 14F-2 0.00000 -0.15367 -0.15367 -0.15367 0.30048
136 14F+3 0.27095 -0.00538 0.21461 0.37719 0.17636
137 14F-3 -0.28154 0.00538 -0.37719 -0.21461 0.66100
138 15G 0 0.00227 0.00060 0.00355 0.00355 0.00051
139 15G+1 -0.00504 -0.01043 0.00138 0.00095 0.00015
140 15G-1 -0.00369 -0.01043 0.00095 0.00138 0.00045
141 15G+2 0.00203 0.00000 -0.00264 0.00264 0.00096
142 15G-2 -0.00745 -0.00389 0.01340 0.01340 -0.00434
143 15G+3 0.00190 -0.01038 0.00364 -0.01468 0.00041
144 15G-3 0.00657 0.01038 0.01468 -0.00364 -0.00447
145 15G+4 -0.00269 0.00450 0.00101 0.00101 0.00116
146 15G-4 0.00113 0.00000 0.00608 -0.00608 -0.00116
147 3 H 1S 0.00000 -0.00973 0.00973 0.00973 -0.01053
148 2S 0.00000 0.51470 -0.51470 -0.51470 0.27071
149 3S 0.00000 -16.49307 16.49307 16.49307 5.53808
150 4S 0.00000 -7.85804 7.85804 7.85804 2.18974
151 5S 0.00000 0.40541 -0.40541 -0.40541 -0.09409
152 6PX 0.03058 -0.00911 0.00911 0.00345 0.01851
153 6PY 0.00000 -0.00911 0.00345 0.00911 0.00510
154 6PZ 0.03058 0.00345 -0.00911 -0.00911 -0.01851
155 7PX -0.23060 0.13055 -0.13055 -0.17393 -0.21443
156 7PY 0.00000 0.13055 -0.17393 -0.13055 -0.08135
157 7PZ -0.23060 -0.17393 0.13055 0.13055 0.21443
158 8PX 0.85149 -3.98450 3.98450 5.47538 2.01054
159 8PY 0.00000 -3.98450 5.47538 3.98450 1.33299
160 8PZ 0.85149 5.47538 -3.98450 -3.98450 -2.01054
161 9PX 0.06474 -2.10098 2.10098 2.03291 0.60883
162 9PY 0.00000 -2.10098 2.03291 2.10098 0.82484
163 9PZ 0.06474 2.03291 -2.10098 -2.10098 -0.60883
164 10D 0 -0.04503 0.06059 0.03030 0.03030 -0.02202
165 10D+1 0.00000 -0.02234 0.01448 0.02234 -0.00580
166 10D-1 -0.07226 -0.02234 0.02234 0.01448 0.02808
167 10D+2 0.02600 0.00000 0.05248 -0.05248 -0.03814
168 10D-2 -0.07226 0.01448 -0.02234 -0.02234 -0.02808
169 11D 0 0.30132 -0.50817 -0.25408 -0.25408 0.18000
170 11D+1 0.00000 0.44595 -0.31492 -0.44595 -0.07733
171 11D-1 0.48162 0.44595 -0.44595 -0.31492 -0.24273
172 11D+2 -0.17397 0.00000 -0.44009 0.44009 0.31177
173 11D-2 0.48162 -0.31492 0.44595 0.44595 0.24273
174 12D 0 -0.31405 -0.25291 -0.12646 -0.12646 0.39075
175 12D+1 0.00000 0.60578 -0.75182 -0.60578 -0.23274
176 12D-1 -0.67835 0.60578 -0.60578 -0.75182 -0.71760
177 12D+2 0.18132 0.00000 -0.21903 0.21903 0.67679
178 12D-2 -0.67835 -0.75182 0.60578 0.60578 0.71760
179 13F 0 -0.00876 -0.04663 0.04103 0.04103 0.02698
180 13F+1 -0.01306 -0.05673 -0.00647 0.02856 0.02767
181 13F-1 -0.03409 -0.05673 0.02856 -0.00647 -0.03694
182 13F+2 -0.02330 0.00000 0.03997 -0.03997 -0.01411
183 13F-2 0.00000 0.05008 -0.05008 -0.05008 0.00968
184 13F+3 -0.02119 0.00796 -0.05692 -0.03686 -0.01269
185 13F-3 0.02641 -0.00796 0.03686 0.05692 -0.04769
186 14F 0 0.11618 0.47712 -0.13233 -0.13233 -0.22861
187 14F+1 0.16007 0.22304 0.06097 -0.29217 -0.14564
188 14F-1 0.36346 0.22304 -0.29217 0.06097 0.51201
189 14F+2 0.29247 0.00000 -0.17962 0.17962 0.00714
190 14F-2 0.00000 -0.15367 0.15367 0.15367 -0.30048
191 14F+3 0.27095 0.00538 0.21461 0.37719 0.17636
192 14F-3 -0.28154 -0.00538 -0.37719 -0.21461 0.66100
193 15G 0 -0.00227 0.00060 -0.00355 -0.00355 -0.00051
194 15G+1 -0.00504 0.01043 0.00138 0.00095 0.00015
195 15G-1 -0.00369 0.01043 0.00095 0.00138 0.00045
196 15G+2 -0.00203 0.00000 0.00264 -0.00264 -0.00096
197 15G-2 0.00745 -0.00389 -0.01340 -0.01340 0.00434
198 15G+3 0.00190 0.01038 0.00364 -0.01468 0.00041
199 15G-3 0.00657 -0.01038 0.01468 -0.00364 -0.00447
200 15G+4 0.00269 0.00450 -0.00101 -0.00101 -0.00116
201 15G-4 -0.00113 0.00000 -0.00608 0.00608 0.00116
202 4 H 1S 0.00000 0.00973 0.00973 -0.00973 -0.01053
203 2S 0.00000 -0.51470 -0.51470 0.51470 0.27071
204 3S 0.00000 16.49307 16.49307 -16.49307 5.53808
205 4S 0.00000 7.85804 7.85804 -7.85804 2.18974
206 5S 0.00000 -0.40541 -0.40541 0.40541 -0.09409
207 6PX -0.03058 -0.00911 -0.00911 0.00345 -0.01851
208 6PY 0.00000 0.00911 0.00345 -0.00911 0.00510
209 6PZ -0.03058 0.00345 0.00911 -0.00911 0.01851
210 7PX 0.23060 0.13055 0.13055 -0.17393 0.21443
211 7PY 0.00000 -0.13055 -0.17393 0.13055 -0.08135
212 7PZ 0.23060 -0.17393 -0.13055 0.13055 -0.21443
213 8PX -0.85149 -3.98450 -3.98450 5.47538 -2.01054
214 8PY 0.00000 3.98450 5.47538 -3.98450 1.33299
215 8PZ -0.85149 5.47538 3.98450 -3.98450 2.01054
216 9PX -0.06474 -2.10098 -2.10098 2.03291 -0.60883
217 9PY 0.00000 2.10098 2.03291 -2.10098 0.82484
218 9PZ -0.06474 2.03291 2.10098 -2.10098 0.60883
219 10D 0 -0.04503 -0.06059 0.03030 -0.03030 -0.02202
220 10D+1 0.00000 0.02234 0.01448 -0.02234 -0.00580
221 10D-1 0.07226 -0.02234 -0.02234 0.01448 -0.02808
222 10D+2 0.02600 0.00000 0.05248 0.05248 -0.03814
223 10D-2 0.07226 0.01448 0.02234 -0.02234 0.02808
224 11D 0 0.30132 0.50817 -0.25408 0.25408 0.18000
225 11D+1 0.00000 -0.44595 -0.31492 0.44595 -0.07733
226 11D-1 -0.48162 0.44595 0.44595 -0.31492 0.24273
227 11D+2 -0.17397 0.00000 -0.44009 -0.44009 0.31177
228 11D-2 -0.48162 -0.31492 -0.44595 0.44595 -0.24273
229 12D 0 -0.31405 0.25291 -0.12646 0.12646 0.39075
230 12D+1 0.00000 -0.60578 -0.75182 0.60578 -0.23274
231 12D-1 0.67835 0.60578 0.60578 -0.75182 0.71760
232 12D+2 0.18132 0.00000 -0.21903 -0.21903 0.67679
233 12D-2 0.67835 -0.75182 -0.60578 0.60578 -0.71760
234 13F 0 0.00876 -0.04663 -0.04103 0.04103 -0.02698
235 13F+1 0.01306 -0.05673 0.00647 0.02856 -0.02767
236 13F-1 -0.03409 0.05673 0.02856 0.00647 -0.03694
237 13F+2 0.02330 0.00000 -0.03997 -0.03997 0.01411
238 13F-2 0.00000 -0.05008 -0.05008 0.05008 0.00968
239 13F+3 0.02119 0.00796 0.05692 -0.03686 0.01269
240 13F-3 0.02641 0.00796 0.03686 -0.05692 -0.04769
241 14F 0 -0.11618 0.47712 0.13233 -0.13233 0.22861
242 14F+1 -0.16007 0.22304 -0.06097 -0.29217 0.14564
243 14F-1 0.36346 -0.22304 -0.29217 -0.06097 0.51201
244 14F+2 -0.29247 0.00000 0.17962 0.17962 -0.00714
245 14F-2 0.00000 0.15367 0.15367 -0.15367 -0.30048
246 14F+3 -0.27095 0.00538 -0.21461 0.37719 -0.17636
247 14F-3 -0.28154 0.00538 -0.37719 0.21461 0.66100
248 15G 0 -0.00227 -0.00060 -0.00355 0.00355 -0.00051
249 15G+1 -0.00504 -0.01043 0.00138 -0.00095 0.00015
250 15G-1 0.00369 0.01043 -0.00095 0.00138 -0.00045
251 15G+2 -0.00203 0.00000 0.00264 0.00264 -0.00096
252 15G-2 -0.00745 -0.00389 0.01340 -0.01340 -0.00434
253 15G+3 0.00190 -0.01038 0.00364 0.01468 0.00041
254 15G-3 -0.00657 -0.01038 -0.01468 -0.00364 0.00447
255 15G+4 0.00269 -0.00450 -0.00101 0.00101 -0.00116
256 15G-4 0.00113 0.00000 0.00608 0.00608 -0.00116
257 5 H 1S 0.00000 0.00973 -0.00973 0.00973 0.01053
258 2S 0.00000 -0.51470 0.51470 -0.51470 -0.27071
259 3S 0.00000 16.49307 -16.49307 16.49307 -5.53808
260 4S 0.00000 7.85804 -7.85804 7.85804 -2.18974
261 5S 0.00000 -0.40541 0.40541 -0.40541 0.09409
262 6PX -0.03058 0.00911 -0.00911 0.00345 -0.01851
263 6PY 0.00000 -0.00911 0.00345 -0.00911 0.00510
264 6PZ 0.03058 0.00345 -0.00911 0.00911 -0.01851
265 7PX 0.23060 -0.13055 0.13055 -0.17393 0.21443
266 7PY 0.00000 0.13055 -0.17393 0.13055 -0.08135
267 7PZ -0.23060 -0.17393 0.13055 -0.13055 0.21443
268 8PX -0.85149 3.98450 -3.98450 5.47538 -2.01054
269 8PY 0.00000 -3.98450 5.47538 -3.98450 1.33299
270 8PZ 0.85149 5.47538 -3.98450 3.98450 -2.01054
271 9PX -0.06474 2.10098 -2.10098 2.03291 -0.60883
272 9PY 0.00000 -2.10098 2.03291 -2.10098 0.82484
273 9PZ 0.06474 2.03291 -2.10098 2.10098 -0.60883
274 10D 0 0.04503 -0.06059 -0.03030 0.03030 0.02202
275 10D+1 0.00000 -0.02234 0.01448 -0.02234 -0.00580
276 10D-1 0.07226 0.02234 -0.02234 0.01448 -0.02808
277 10D+2 -0.02600 0.00000 -0.05248 -0.05248 0.03814
278 10D-2 -0.07226 0.01448 -0.02234 0.02234 -0.02808
279 11D 0 -0.30132 0.50817 0.25408 -0.25408 -0.18000
280 11D+1 0.00000 0.44595 -0.31492 0.44595 -0.07733
281 11D-1 -0.48162 -0.44595 0.44595 -0.31492 0.24273
282 11D+2 0.17397 0.00000 0.44009 0.44009 -0.31177
283 11D-2 0.48162 -0.31492 0.44595 -0.44595 0.24273
284 12D 0 0.31405 0.25291 0.12646 -0.12646 -0.39075
285 12D+1 0.00000 0.60578 -0.75182 0.60578 -0.23274
286 12D-1 0.67835 -0.60578 0.60578 -0.75182 0.71760
287 12D+2 -0.18132 0.00000 0.21903 0.21903 -0.67679
288 12D-2 -0.67835 -0.75182 0.60578 -0.60578 0.71760
289 13F 0 -0.00876 -0.04663 0.04103 -0.04103 0.02698
290 13F+1 0.01306 0.05673 0.00647 0.02856 -0.02767
291 13F-1 -0.03409 -0.05673 0.02856 0.00647 -0.03694
292 13F+2 -0.02330 0.00000 0.03997 0.03997 -0.01411
293 13F-2 0.00000 -0.05008 0.05008 -0.05008 -0.00968
294 13F+3 0.02119 -0.00796 0.05692 -0.03686 0.01269
295 13F-3 0.02641 -0.00796 0.03686 -0.05692 -0.04769
296 14F 0 0.11618 0.47712 -0.13233 0.13233 -0.22861
297 14F+1 -0.16007 -0.22304 -0.06097 -0.29217 0.14564
298 14F-1 0.36346 0.22304 -0.29217 -0.06097 0.51201
299 14F+2 0.29247 0.00000 -0.17962 -0.17962 0.00714
300 14F-2 0.00000 0.15367 -0.15367 0.15367 0.30048
301 14F+3 -0.27095 -0.00538 -0.21461 0.37719 -0.17636
302 14F-3 -0.28154 -0.00538 -0.37719 0.21461 0.66100
303 15G 0 0.00227 -0.00060 0.00355 -0.00355 0.00051
304 15G+1 -0.00504 0.01043 0.00138 -0.00095 0.00015
305 15G-1 0.00369 -0.01043 -0.00095 0.00138 -0.00045
306 15G+2 0.00203 0.00000 -0.00264 -0.00264 0.00096
307 15G-2 0.00745 -0.00389 -0.01340 0.01340 0.00434
308 15G+3 0.00190 0.01038 0.00364 0.01468 0.00041
309 15G-3 -0.00657 0.01038 -0.01468 -0.00364 0.00447
310 15G+4 -0.00269 -0.00450 0.00101 -0.00101 0.00116
311 15G-4 -0.00113 0.00000 -0.00608 -0.00608 0.00116
146 147 148 149 150
(T2)--V (T2)--V (A1)--V (E)--V (E)--V
Eigenvalues -- 6.02143 6.02143 6.03813 6.08025 6.08025
1 1 C 1S 0.00000 0.00000 -0.09038 0.00000 0.00000
2 2S 0.00000 0.00000 0.48443 0.00000 0.00000
3 3S 0.00000 0.00000 1.69561 0.00000 0.00000
4 4S 0.00000 0.00000 -12.82914 0.00000 0.00000
5 5S 0.00000 0.00000 16.30141 0.00000 0.00000
6 6S 0.00000 0.00000 -3.54370 0.00000 0.00000
7 7PX 0.00000 -0.02026 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
9 7PZ -0.02026 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.66524 0.00000 0.00000 0.00000
11 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
12 8PZ -0.66524 0.00000 0.00000 0.00000 0.00000
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14 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
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104 8PY 2.01054 2.01054 0.68566 0.70865 1.52762
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123 12D-2 -0.23274 -0.71760 1.03598 -0.83825 -0.07501
124 13F 0 0.06033 -0.02698 -0.00851 0.00205 0.00018
125 13F+1 0.00537 -0.03694 0.00521 -0.02116 -0.01642
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128 13F-2 -0.00968 -0.00968 0.05114 0.00000 0.00000
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130 13F-3 0.02997 0.01269 0.00673 0.01948 -0.00725
131 14F 0 -0.83610 0.22861 0.08915 -0.25468 -0.02279
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145 15G+4 -0.00012 0.00116 -0.01023 0.00904 0.00081
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149 3S -5.53808 5.53808 -6.21679 0.00000 0.00000
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153 6PY -0.01851 0.01851 0.04507 -0.03104 -0.06691
154 6PZ 0.00510 -0.01851 -0.04507 -0.07346 -0.00657
155 7PX 0.21443 -0.08135 -0.33784 0.35556 -0.50566
156 7PY 0.21443 -0.21443 -0.33784 0.26013 0.56076
157 7PZ -0.08135 0.21443 0.33784 0.61569 0.05510
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159 8PY -2.01054 2.01054 -0.68566 -0.70865 -1.52762
160 8PZ 1.33299 -2.01054 0.68566 -1.67729 -0.15010
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162 9PY -0.60883 0.60883 0.77032 -0.59339 -1.27915
163 9PZ 0.82484 -0.60883 -0.77032 -1.40447 -0.12569
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168 10D-2 -0.00580 -0.02808 0.05459 -0.06119 -0.00548
169 11D 0 0.36000 0.18000 0.00000 0.16773 0.01501
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171 11D-1 0.24273 -0.07733 0.60405 0.24210 -0.34429
172 11D+2 0.00000 -0.31177 0.00000 -0.01501 0.16773
173 11D-2 -0.07733 0.24273 -0.60405 0.41921 0.03752
174 12D 0 0.78149 0.39075 0.00000 1.11112 0.09943
175 12D+1 0.71760 -0.71760 -1.03598 -0.35416 -0.76345
176 12D-1 0.71760 -0.23274 -1.03598 -0.48409 0.68844
177 12D+2 0.00000 -0.67679 0.00000 -0.09943 1.11112
178 12D-2 -0.23274 0.71760 1.03598 -0.83825 -0.07501
179 13F 0 0.06033 0.02698 -0.00851 0.00205 0.00018
180 13F+1 -0.00537 -0.03694 -0.00521 0.02116 0.01642
181 13F-1 -0.00537 0.02767 -0.00521 0.02374 -0.01240
182 13F+2 0.00000 0.01411 0.00000 0.00302 -0.03370
183 13F-2 -0.00968 0.00968 0.05114 0.00000 0.00000
184 13F+3 0.02997 0.04769 0.00673 0.01789 0.01059
185 13F-3 -0.02997 0.01269 -0.00673 -0.01948 0.00725
186 14F 0 -0.83610 -0.22861 0.08915 -0.25468 -0.02279
187 14F+1 0.13435 0.51201 0.05459 0.13850 -0.09403
188 14F-1 0.13435 -0.14564 0.05459 0.11961 0.11713
189 14F+2 0.00000 -0.00714 0.00000 0.00668 -0.07460
190 14F-2 0.30048 -0.30048 -0.56692 0.00000 0.00000
191 14F+3 -0.18510 -0.66100 -0.07048 -0.07876 0.19174
192 14F-3 0.18510 -0.17636 0.07048 0.04346 0.20268
193 15G 0 0.00158 -0.00051 -0.01210 -0.00764 -0.00068
194 15G+1 -0.00262 0.00045 0.00425 -0.01416 0.00219
195 15G-1 -0.00262 0.00015 0.00425 -0.01354 -0.00467
196 15G+2 0.00000 0.00096 0.00000 -0.00106 0.01184
197 15G-2 -0.00043 0.00434 0.01202 0.01119 0.00100
198 15G+3 -0.00364 0.00447 0.01124 0.00029 -0.01173
199 15G-3 0.00364 -0.00041 -0.01124 0.00179 -0.01159
200 15G+4 -0.00012 -0.00116 -0.01023 0.00904 0.00081
201 15G-4 0.00000 -0.00116 0.00000 -0.00131 0.01465
202 4 H 1S -0.01053 0.01053 0.00888 0.00000 0.00000
203 2S 0.27071 -0.27071 0.04927 0.00000 0.00000
204 3S 5.53808 -5.53808 -6.21679 0.00000 0.00000
205 4S 2.18974 -2.18974 2.17342 0.00000 0.00000
206 5S -0.09409 0.09409 0.13953 0.00000 0.00000
207 6PX -0.01851 0.00510 -0.04507 0.04243 -0.06033
208 6PY 0.01851 -0.01851 0.04507 -0.03104 -0.06691
209 6PZ 0.00510 -0.01851 0.04507 0.07346 0.00657
210 7PX 0.21443 -0.08135 0.33784 -0.35556 0.50566
211 7PY -0.21443 0.21443 -0.33784 0.26013 0.56076
212 7PZ -0.08135 0.21443 -0.33784 -0.61569 -0.05510
213 8PX -2.01054 1.33299 0.68566 0.96863 -1.37752
214 8PY 2.01054 -2.01054 -0.68566 -0.70865 -1.52762
215 8PZ 1.33299 -2.01054 -0.68566 1.67729 0.15010
216 9PX -0.60883 0.82484 -0.77032 0.81108 -1.15347
217 9PY 0.60883 -0.60883 0.77032 -0.59339 -1.27915
218 9PZ 0.82484 -0.60883 0.77032 1.40447 0.12569
219 10D 0 0.04404 0.02202 0.00000 -0.01673 -0.00150
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221 10D-1 -0.02808 -0.00580 0.05459 0.03534 -0.05026
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223 10D-2 -0.00580 -0.02808 -0.05459 0.06119 0.00548
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227 11D+2 0.00000 0.31177 0.00000 -0.01501 0.16773
228 11D-2 -0.07733 0.24273 0.60405 -0.41921 -0.03752
229 12D 0 -0.78149 -0.39075 0.00000 1.11112 0.09943
230 12D+1 -0.71760 0.71760 -1.03598 -0.35416 -0.76345
231 12D-1 0.71760 -0.23274 1.03598 0.48409 -0.68844
232 12D+2 0.00000 0.67679 0.00000 -0.09943 1.11112
233 12D-2 -0.23274 0.71760 -1.03598 0.83825 0.07501
234 13F 0 0.06033 0.02698 0.00851 -0.00205 -0.00018
235 13F+1 -0.00537 -0.03694 0.00521 -0.02116 -0.01642
236 13F-1 0.00537 -0.02767 -0.00521 0.02374 -0.01240
237 13F+2 0.00000 0.01411 0.00000 -0.00302 0.03370
238 13F-2 0.00968 -0.00968 0.05114 0.00000 0.00000
239 13F+3 0.02997 0.04769 -0.00673 -0.01789 -0.01059
240 13F-3 0.02997 -0.01269 -0.00673 -0.01948 0.00725
241 14F 0 -0.83610 -0.22861 -0.08915 0.25468 0.02279
242 14F+1 0.13435 0.51201 -0.05459 -0.13850 0.09403
243 14F-1 -0.13435 0.14564 0.05459 0.11961 0.11713
244 14F+2 0.00000 -0.00714 0.00000 -0.00668 0.07460
245 14F-2 -0.30048 0.30048 -0.56692 0.00000 0.00000
246 14F+3 -0.18510 -0.66100 0.07048 0.07876 -0.19174
247 14F-3 -0.18510 0.17636 0.07048 0.04346 0.20268
248 15G 0 -0.00158 0.00051 -0.01210 -0.00764 -0.00068
249 15G+1 0.00262 -0.00045 0.00425 -0.01416 0.00219
250 15G-1 -0.00262 0.00015 -0.00425 0.01354 0.00467
251 15G+2 0.00000 -0.00096 0.00000 -0.00106 0.01184
252 15G-2 -0.00043 0.00434 -0.01202 -0.01119 -0.00100
253 15G+3 0.00364 -0.00447 0.01124 0.00029 -0.01173
254 15G-3 0.00364 -0.00041 0.01124 -0.00179 0.01159
255 15G+4 0.00012 0.00116 -0.01023 0.00904 0.00081
256 15G-4 0.00000 -0.00116 0.00000 0.00131 -0.01465
257 5 H 1S -0.01053 -0.01053 0.00888 0.00000 0.00000
258 2S 0.27071 0.27071 0.04927 0.00000 0.00000
259 3S 5.53808 5.53808 -6.21679 0.00000 0.00000
260 4S 2.18974 2.18974 2.17342 0.00000 0.00000
261 5S -0.09409 -0.09409 0.13953 0.00000 0.00000
262 6PX 0.01851 0.00510 0.04507 -0.04243 0.06033
263 6PY -0.01851 -0.01851 -0.04507 0.03104 0.06691
264 6PZ 0.00510 0.01851 0.04507 0.07346 0.00657
265 7PX -0.21443 -0.08135 -0.33784 0.35556 -0.50566
266 7PY 0.21443 0.21443 0.33784 -0.26013 -0.56076
267 7PZ -0.08135 -0.21443 -0.33784 -0.61569 -0.05510
268 8PX 2.01054 1.33299 -0.68566 -0.96863 1.37752
269 8PY -2.01054 -2.01054 0.68566 0.70865 1.52762
270 8PZ 1.33299 2.01054 -0.68566 1.67729 0.15010
271 9PX 0.60883 0.82484 0.77032 -0.81108 1.15347
272 9PY -0.60883 -0.60883 -0.77032 0.59339 1.27915
273 9PZ 0.82484 0.60883 0.77032 1.40447 0.12569
274 10D 0 0.04404 -0.02202 0.00000 -0.01673 -0.00150
275 10D+1 -0.02808 -0.02808 0.05459 0.02585 0.05573
276 10D-1 0.02808 -0.00580 -0.05459 -0.03534 0.05026
277 10D+2 0.00000 0.03814 0.00000 0.00150 -0.01673
278 10D-2 -0.00580 0.02808 -0.05459 0.06119 0.00548
279 11D 0 -0.36000 0.18000 0.00000 0.16773 0.01501
280 11D+1 0.24273 0.24273 -0.60405 -0.17712 -0.38181
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282 11D+2 0.00000 -0.31177 0.00000 -0.01501 0.16773
283 11D-2 -0.07733 -0.24273 0.60405 -0.41921 -0.03752
284 12D 0 -0.78149 0.39075 0.00000 1.11112 0.09943
285 12D+1 0.71760 0.71760 1.03598 0.35416 0.76345
286 12D-1 -0.71760 -0.23274 -1.03598 -0.48409 0.68844
287 12D+2 0.00000 -0.67679 0.00000 -0.09943 1.11112
288 12D-2 -0.23274 -0.71760 -1.03598 0.83825 0.07501
289 13F 0 0.06033 -0.02698 0.00851 -0.00205 -0.00018
290 13F+1 0.00537 -0.03694 -0.00521 0.02116 0.01642
291 13F-1 -0.00537 -0.02767 0.00521 -0.02374 0.01240
292 13F+2 0.00000 -0.01411 0.00000 -0.00302 0.03370
293 13F-2 0.00968 0.00968 0.05114 0.00000 0.00000
294 13F+3 -0.02997 0.04769 0.00673 0.01789 0.01059
295 13F-3 -0.02997 -0.01269 0.00673 0.01948 -0.00725
296 14F 0 -0.83610 0.22861 -0.08915 0.25468 0.02279
297 14F+1 -0.13435 0.51201 0.05459 0.13850 -0.09403
298 14F-1 0.13435 0.14564 -0.05459 -0.11961 -0.11713
299 14F+2 0.00000 0.00714 0.00000 -0.00668 0.07460
300 14F-2 -0.30048 -0.30048 -0.56692 0.00000 0.00000
301 14F+3 0.18510 -0.66100 -0.07048 -0.07876 0.19174
302 14F-3 0.18510 0.17636 -0.07048 -0.04346 -0.20268
303 15G 0 -0.00158 -0.00051 -0.01210 -0.00764 -0.00068
304 15G+1 -0.00262 -0.00045 -0.00425 0.01416 -0.00219
305 15G-1 0.00262 0.00015 0.00425 -0.01354 -0.00467
306 15G+2 0.00000 0.00096 0.00000 -0.00106 0.01184
307 15G-2 -0.00043 -0.00434 -0.01202 -0.01119 -0.00100
308 15G+3 -0.00364 -0.00447 -0.01124 -0.00029 0.01173
309 15G-3 -0.00364 -0.00041 -0.01124 0.00179 -0.01159
310 15G+4 0.00012 -0.00116 -0.01023 0.00904 0.00081
311 15G-4 0.00000 0.00116 0.00000 0.00131 -0.01465
151 152 153 154 155
(T2)--V (T2)--V (T2)--V (A1)--V (E)--V
Eigenvalues -- 6.26396 6.26396 6.26396 6.41756 6.89850
1 1 C 1S 0.00000 0.00000 0.00000 0.09261 0.00000
2 2S 0.00000 0.00000 0.00000 -0.01434 0.00000
3 3S 0.00000 0.00000 0.00000 2.48761 0.00000
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308 15G+3 0.00072 -0.00730 -0.00423 -0.00514 -0.01157
309 15G-3 0.00423 -0.00730 -0.00072 -0.00514 -0.01151
310 15G+4 -0.00211 0.01237 0.00211 -0.01036 -0.00345
311 15G-4 -0.00435 0.00000 -0.00435 0.00000 -0.00036
156 157 158 159 160
(E)--V (T1)--V (T1)--V (T1)--V (T2)--V
Eigenvalues -- 6.89850 7.01240 7.01240 7.01240 7.11697
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14 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 29.66937
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28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
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30 13D+2 0.63648 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.90055
32 14D 0 -0.06256 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 4.47417 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 10.32778
37 15D 0 0.00702 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
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41 15D-2 0.00000 0.00000 0.00000 0.00000 4.21158
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43 16F+1 0.00000 -0.14976 0.00000 0.00000 0.00000
44 16F-1 0.00000 0.00000 0.00000 -0.14976 0.00000
45 16F+2 0.00000 0.00000 -0.18944 0.00000 0.00000
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00000 -0.11601 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.00000 0.00000 0.11601 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 -2.22310
50 17F+1 0.00000 2.05882 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.00000 2.05882 0.00000
52 17F+2 0.00000 0.00000 2.60422 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.00000 1.59476 0.00000 0.00000 0.00000
55 17F-3 0.00000 0.00000 0.00000 -1.59476 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 -0.65293
57 18F+1 0.00000 2.02331 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.00000 0.00000 2.02331 0.00000
59 18F+2 0.00000 0.00000 2.55930 0.00000 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.00000 1.56725 0.00000 0.00000 0.00000
62 18F-3 0.00000 0.00000 0.00000 -1.56725 0.00000
63 19G 0 -0.00134 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 0.12215 0.00000
65 19G-1 0.00000 0.12215 0.00000 0.00000 0.00000
66 19G+2 -0.14801 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.07750
68 19G+3 0.00000 0.00000 0.00000 -0.04617 0.00000
69 19G-3 0.00000 0.04617 0.00000 0.00000 0.00000
70 19G+4 0.00158 0.00000 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.13058 0.00000 0.00000
72 20G 0 0.03473 0.00000 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.00000 0.19098 0.00000
74 20G-1 0.00000 0.19098 0.00000 0.00000 0.00000
75 20G+2 3.84816 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.00000 2.68318
77 20G+3 0.00000 0.00000 0.00000 -0.07218 0.00000
78 20G-3 0.00000 0.07218 0.00000 0.00000 0.00000
79 20G+4 -0.04110 0.00000 0.00000 0.00000 0.00000
80 20G-4 0.00000 0.00000 0.20417 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 -0.24145
82 21H+1 0.00000 0.04404 0.00000 0.00000 0.00000
83 21H-1 0.00000 0.00000 0.00000 0.04404 0.00000
84 21H+2 0.00000 0.00000 -0.06658 0.00000 0.00000
85 21H-2 -0.00324 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.00000 -0.02039 0.00000 0.00000 0.00000
87 21H-3 0.00000 0.00000 0.00000 0.02039 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 -0.18668
89 21H-4 0.23159 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00000 -0.04559 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.00000 0.00000 -0.04559 0.00000
92 2 H 1S 0.00000 0.00000 0.00000 0.00000 -0.05250
93 2S 0.00000 0.00000 0.00000 0.00000 -0.00131
94 3S 0.00000 0.00000 0.00000 0.00000 -14.37627
95 4S 0.00000 0.00000 0.00000 0.00000 -9.07787
96 5S 0.00000 0.00000 0.00000 0.00000 0.29569
97 6PX -0.00095 0.00000 -0.09657 0.09657 -0.04014
98 6PY 0.00094 0.09657 0.09657 0.00000 -0.04014
99 6PZ 0.00002 -0.09657 0.00000 -0.09657 -0.10594
100 7PX 0.05558 0.00000 0.89780 -0.89780 0.23216
101 7PY -0.05469 -0.89780 -0.89780 0.00000 0.23216
102 7PZ -0.00089 0.89780 0.00000 0.89780 0.88299
103 8PX -1.65690 0.00000 -2.18647 2.18647 4.54717
104 8PY 1.63036 2.18647 2.18647 0.00000 4.54717
105 8PZ 0.02654 -2.18647 0.00000 -2.18647 1.82926
106 9PX 0.00525 0.00000 -0.76869 0.76869 2.73421
107 9PY -0.00516 0.76869 0.76869 0.00000 2.73421
108 9PZ -0.00008 -0.76869 0.00000 -0.76869 1.35935
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111 10D-1 -0.01494 0.00000 0.01506 -0.01506 0.07093
112 10D+2 -0.16589 -0.02559 -0.05118 0.02559 0.00000
113 10D-2 0.00024 0.01506 0.00000 0.01506 0.07053
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115 11D+1 -0.07480 0.12486 0.12486 0.00000 -0.77448
116 11D-1 0.07601 0.00000 -0.12486 0.12486 -0.77448
117 11D+2 1.42599 0.18777 0.37554 -0.18777 0.00000
118 11D-2 -0.00122 -0.12486 0.00000 -0.12486 -0.85706
119 12D 0 -0.01395 1.43257 0.00000 1.43257 0.91159
120 12D+1 0.01467 0.63519 0.63519 0.00000 -0.03324
121 12D-1 -0.01491 0.00000 -0.63519 0.63519 -0.03324
122 12D+2 0.99748 0.82710 1.65419 -0.82710 0.00000
123 12D-2 0.00024 -0.63519 0.00000 -0.63519 -1.29679
124 13F 0 -0.00051 0.01713 0.00000 0.01713 -0.01875
125 13F+1 -0.02479 0.01414 -0.01214 0.00884 -0.00437
126 13F-1 0.02474 0.00884 0.01214 0.01414 -0.00437
127 13F+2 -0.01380 -0.00208 0.01789 0.00208 0.00000
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.03702
129 13F+3 0.02101 0.01095 0.01227 -0.01482 -0.02132
130 13F-3 0.02040 0.01482 0.01227 -0.01095 0.02132
131 14F 0 0.01186 -0.34118 0.00000 -0.34118 -0.14986
132 14F+1 0.40144 -0.56924 0.05784 -0.36001 -0.22106
133 14F-1 -0.39159 -0.36001 -0.05784 -0.56924 -0.22106
134 14F+2 -0.13511 -0.19111 -0.72004 0.19111 0.00000
135 14F-2 0.00000 0.00000 0.00000 0.00000 -0.00693
136 14F+3 -0.62590 -0.44093 -0.38676 0.15270 -0.11732
137 14F-3 -0.61852 -0.15270 -0.38676 0.44093 0.11732
138 15G 0 -0.00004 -0.00353 0.00000 -0.00353 0.00320
139 15G+1 -0.01463 0.00209 0.00958 0.01692 0.01607
140 15G-1 0.01409 0.01692 -0.00958 0.00209 0.01607
141 15G+2 -0.00452 0.00316 0.00632 -0.00316 0.00000
142 15G-2 0.00011 0.01651 0.00000 0.01651 0.00718
143 15G+3 -0.00182 0.01685 0.01403 -0.00640 0.01447
144 15G-3 -0.00214 0.00640 0.01403 -0.01685 -0.01447
145 15G+4 0.00005 0.00418 0.00000 0.00418 0.01323
146 15G-4 0.02546 -0.00400 0.01809 0.00400 0.00000
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 -0.05250
148 2S 0.00000 0.00000 0.00000 0.00000 -0.00131
149 3S 0.00000 0.00000 0.00000 0.00000 -14.37627
150 4S 0.00000 0.00000 0.00000 0.00000 -9.07787
151 5S 0.00000 0.00000 0.00000 0.00000 0.29569
152 6PX 0.00095 0.00000 0.09657 0.09657 0.04014
153 6PY -0.00094 0.09657 -0.09657 0.00000 0.04014
154 6PZ 0.00002 0.09657 0.00000 0.09657 -0.10594
155 7PX -0.05558 0.00000 -0.89780 -0.89780 -0.23216
156 7PY 0.05469 -0.89780 0.89780 0.00000 -0.23216
157 7PZ -0.00089 -0.89780 0.00000 -0.89780 0.88299
158 8PX 1.65690 0.00000 2.18647 2.18647 -4.54717
159 8PY -1.63036 2.18647 -2.18647 0.00000 -4.54717
160 8PZ 0.02654 2.18647 0.00000 2.18647 1.82926
161 9PX -0.00525 0.00000 0.76869 0.76869 -2.73421
162 9PY 0.00516 0.76869 -0.76869 0.00000 -2.73421
163 9PZ -0.00008 0.76869 0.00000 0.76869 1.35935
164 10D 0 0.00232 0.04432 0.00000 0.04432 -0.03738
165 10D+1 -0.01470 -0.01506 0.01506 0.00000 -0.07093
166 10D-1 0.01494 0.00000 -0.01506 -0.01506 -0.07093
167 10D+2 -0.16589 0.02559 -0.05118 -0.02559 0.00000
168 10D-2 0.00024 -0.01506 0.00000 -0.01506 0.07053
169 11D 0 -0.01994 -0.32523 0.00000 -0.32523 0.43647
170 11D+1 0.07480 0.12486 -0.12486 0.00000 0.77448
171 11D-1 -0.07601 0.00000 0.12486 0.12486 0.77448
172 11D+2 1.42599 -0.18777 0.37554 0.18777 0.00000
173 11D-2 -0.00122 0.12486 0.00000 0.12486 -0.85706
174 12D 0 -0.01395 -1.43257 0.00000 -1.43257 0.91159
175 12D+1 -0.01467 0.63519 -0.63519 0.00000 0.03324
176 12D-1 0.01491 0.00000 0.63519 0.63519 0.03324
177 12D+2 0.99748 -0.82710 1.65419 0.82710 0.00000
178 12D-2 0.00024 0.63519 0.00000 0.63519 -1.29679
179 13F 0 -0.00051 -0.01713 0.00000 -0.01713 -0.01875
180 13F+1 0.02479 0.01414 0.01214 0.00884 0.00437
181 13F-1 -0.02474 0.00884 -0.01214 0.01414 0.00437
182 13F+2 -0.01380 0.00208 0.01789 -0.00208 0.00000
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.03702
184 13F+3 -0.02101 0.01095 -0.01227 -0.01482 0.02132
185 13F-3 -0.02040 0.01482 -0.01227 -0.01095 -0.02132
186 14F 0 0.01186 0.34118 0.00000 0.34118 -0.14986
187 14F+1 -0.40144 -0.56924 -0.05784 -0.36001 0.22106
188 14F-1 0.39159 -0.36001 0.05784 -0.56924 0.22106
189 14F+2 -0.13511 0.19111 -0.72004 -0.19111 0.00000
190 14F-2 0.00000 0.00000 0.00000 0.00000 -0.00693
191 14F+3 0.62590 -0.44093 0.38676 0.15270 0.11732
192 14F-3 0.61852 -0.15270 0.38676 0.44093 -0.11732
193 15G 0 -0.00004 0.00353 0.00000 0.00353 0.00320
194 15G+1 0.01463 0.00209 -0.00958 0.01692 -0.01607
195 15G-1 -0.01409 0.01692 0.00958 0.00209 -0.01607
196 15G+2 -0.00452 -0.00316 0.00632 0.00316 0.00000
197 15G-2 0.00011 -0.01651 0.00000 -0.01651 0.00718
198 15G+3 0.00182 0.01685 -0.01403 -0.00640 -0.01447
199 15G-3 0.00214 0.00640 -0.01403 -0.01685 0.01447
200 15G+4 0.00005 -0.00418 0.00000 -0.00418 0.01323
201 15G-4 0.02546 0.00400 0.01809 -0.00400 0.00000
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 0.05250
203 2S 0.00000 0.00000 0.00000 0.00000 0.00131
204 3S 0.00000 0.00000 0.00000 0.00000 14.37627
205 4S 0.00000 0.00000 0.00000 0.00000 9.07787
206 5S 0.00000 0.00000 0.00000 0.00000 -0.29569
207 6PX -0.00095 0.00000 0.09657 -0.09657 0.04014
208 6PY -0.00094 -0.09657 0.09657 0.00000 -0.04014
209 6PZ -0.00002 0.09657 0.00000 -0.09657 -0.10594
210 7PX 0.05558 0.00000 -0.89780 0.89780 -0.23216
211 7PY 0.05469 0.89780 -0.89780 0.00000 0.23216
212 7PZ 0.00089 -0.89780 0.00000 0.89780 0.88299
213 8PX -1.65690 0.00000 2.18647 -2.18647 -4.54717
214 8PY -1.63036 -2.18647 2.18647 0.00000 4.54717
215 8PZ -0.02654 2.18647 0.00000 -2.18647 1.82926
216 9PX 0.00525 0.00000 0.76869 -0.76869 -2.73421
217 9PY 0.00516 -0.76869 0.76869 0.00000 2.73421
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234 13F 0 0.00051 -0.01713 0.00000 0.01713 -0.01875
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237 13F+2 0.01380 0.00208 0.01789 0.00208 0.00000
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239 13F+3 0.02101 0.01095 -0.01227 0.01482 0.02132
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241 14F 0 -0.01186 0.34118 0.00000 -0.34118 -0.14986
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248 15G 0 -0.00004 -0.00353 0.00000 0.00353 -0.00320
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252 15G-2 -0.00011 -0.01651 0.00000 0.01651 0.00718
253 15G+3 0.00182 -0.01685 0.01403 -0.00640 0.01447
254 15G-3 -0.00214 0.00640 -0.01403 0.01685 0.01447
255 15G+4 0.00005 0.00418 0.00000 -0.00418 -0.01323
256 15G-4 -0.02546 0.00400 0.01809 0.00400 0.00000
257 5 H 1S 0.00000 0.00000 0.00000 0.00000 0.05250
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259 3S 0.00000 0.00000 0.00000 0.00000 14.37627
260 4S 0.00000 0.00000 0.00000 0.00000 9.07787
261 5S 0.00000 0.00000 0.00000 0.00000 -0.29569
262 6PX 0.00095 0.00000 -0.09657 -0.09657 -0.04014
263 6PY 0.00094 -0.09657 -0.09657 0.00000 0.04014
264 6PZ -0.00002 -0.09657 0.00000 0.09657 -0.10594
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266 7PY -0.05469 0.89780 0.89780 0.00000 -0.23216
267 7PZ 0.00089 0.89780 0.00000 -0.89780 0.88299
268 8PX 1.65690 0.00000 -2.18647 -2.18647 4.54717
269 8PY 1.63036 -2.18647 -2.18647 0.00000 -4.54717
270 8PZ -0.02654 -2.18647 0.00000 2.18647 1.82926
271 9PX -0.00525 0.00000 -0.76869 -0.76869 2.73421
272 9PY -0.00516 -0.76869 -0.76869 0.00000 -2.73421
273 9PZ 0.00008 -0.76869 0.00000 0.76869 1.35935
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294 13F+3 -0.02101 0.01095 0.01227 0.01482 -0.02132
295 13F-3 0.02040 -0.01482 -0.01227 -0.01095 -0.02132
296 14F 0 -0.01186 -0.34118 0.00000 0.34118 -0.14986
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299 14F+2 0.13511 -0.19111 -0.72004 -0.19111 0.00000
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303 15G 0 -0.00004 0.00353 0.00000 -0.00353 -0.00320
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306 15G+2 -0.00452 -0.00316 -0.00632 -0.00316 0.00000
307 15G-2 -0.00011 0.01651 0.00000 -0.01651 0.00718
308 15G+3 -0.00182 -0.01685 -0.01403 -0.00640 -0.01447
309 15G-3 0.00214 0.00640 0.01403 0.01685 -0.01447
310 15G+4 0.00005 -0.00418 0.00000 0.00418 -0.01323
311 15G-4 -0.02546 -0.00400 0.01809 -0.00400 0.00000
161 162 163 164 165
(T2)--V (T2)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 7.11697 7.11697 7.48077 7.48077 7.48077
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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 0.23476 0.00000 0.00000 0.29341
8 7PY 0.23476 0.00000 0.29341 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.29341 0.00000
10 8PX 0.00000 -4.41432 0.00000 0.00000 -0.19662
11 8PY -4.41432 0.00000 -0.19662 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 -0.19662 0.00000
13 9PX 0.00000 29.66937 0.00000 0.00000 14.36602
14 9PY 29.66937 0.00000 14.36602 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 14.36602 0.00000
16 10PX 0.00000 17.59648 0.00000 0.00000 6.68755
17 10PY 17.59648 0.00000 6.68755 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 6.68755 0.00000
19 11PX 0.00000 0.15535 0.00000 0.00000 0.21709
20 11PY 0.15535 0.00000 0.21709 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.21709 0.00000
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23 12D+1 -0.04266 0.00000 -0.17822 0.00000 0.00000
24 12D-1 0.00000 -0.04266 0.00000 0.00000 -0.17822
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 -0.17822 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.90055 0.00000 1.53975 0.00000 0.00000
29 13D-1 0.00000 0.90055 0.00000 0.00000 1.53975
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 1.53975 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 10.32778 0.00000 16.37862 0.00000 0.00000
34 14D-1 0.00000 10.32778 0.00000 0.00000 16.37862
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 16.37862 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 4.21158 0.00000 3.72881 0.00000 0.00000
39 15D-1 0.00000 4.21158 0.00000 0.00000 3.72881
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 3.72881 0.00000
42 16F 0 0.00000 0.00000 0.00000 0.06476 0.00000
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44 16F-1 -0.09408 0.00000 -0.03966 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 0.12145 0.00000 0.00000 0.05120
48 16F-3 -0.12145 0.00000 -0.05120 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 -3.29243 0.00000
50 17F+1 0.00000 1.36137 0.00000 0.00000 2.01619
51 17F-1 1.36137 0.00000 2.01619 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 -1.75752 0.00000 0.00000 -2.60289
55 17F-3 1.75752 0.00000 2.60289 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 -3.27860 0.00000
57 18F+1 0.00000 0.39984 0.00000 0.00000 2.00772
58 18F-1 0.39984 0.00000 2.00772 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 -0.51619 0.00000 0.00000 -2.59196
62 18F-3 0.51619 0.00000 2.59196 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 -0.02740 0.00000 -0.08094 0.00000 0.00000
65 19G-1 0.00000 -0.02740 0.00000 0.00000 -0.08094
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.22893 0.00000
68 19G+3 -0.07249 0.00000 -0.21414 0.00000 0.00000
69 19G-3 0.00000 0.07249 0.00000 0.00000 0.21414
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 -0.94865 0.00000 0.35525 0.00000 0.00000
74 20G-1 0.00000 -0.94865 0.00000 0.00000 0.35525
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 -1.00480 0.00000
77 20G+3 -2.50989 0.00000 0.93991 0.00000 0.00000
78 20G-3 0.00000 2.50989 0.00000 0.00000 -0.93991
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 0.31581 0.00000
82 21H+1 0.00000 -0.22383 0.00000 0.00000 0.03003
83 21H-1 -0.22383 0.00000 0.03003 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 -0.02224 0.00000 0.00000 -0.33577
87 21H-3 0.02224 0.00000 0.33577 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 -0.21449 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00000 -0.20629 0.00000 0.00000 0.17917
91 21H-5 -0.20629 0.00000 0.17917 0.00000 0.00000
92 2 H 1S -0.05250 -0.05250 -0.02968 -0.02968 -0.02968
93 2S -0.00131 -0.00131 1.20908 1.20908 1.20908
94 3S -14.37627 -14.37627 -14.15890 -14.15890 -14.15890
95 4S -9.07787 -9.07787 -5.12935 -5.12935 -5.12935
96 5S 0.29569 0.29569 -0.02441 -0.02441 -0.02441
97 6PX -0.04014 -0.10594 -0.00898 -0.00898 0.08323
98 6PY -0.10594 -0.04014 0.08323 -0.00898 -0.00898
99 6PZ -0.04014 -0.04014 -0.00898 0.08323 -0.00898
100 7PX 0.23216 0.88299 -0.08348 -0.08348 -1.03071
101 7PY 0.88299 0.23216 -1.03071 -0.08348 -0.08348
102 7PZ 0.23216 0.23216 -0.08348 -1.03071 -0.08348
103 8PX 4.54717 1.82926 2.97955 2.97955 7.21854
104 8PY 1.82926 4.54717 7.21854 2.97955 2.97955
105 8PZ 4.54717 4.54717 2.97955 7.21854 2.97955
106 9PX 2.73421 1.35935 1.22211 1.22211 2.51386
107 9PY 1.35935 2.73421 2.51386 1.22211 1.22211
108 9PZ 2.73421 2.73421 1.22211 2.51386 1.22211
109 10D 0 0.01869 0.01869 -0.04000 0.08000 -0.04000
110 10D+1 0.07053 0.07093 0.03791 0.10541 0.10541
111 10D-1 0.07093 0.07053 0.10541 0.10541 0.03791
112 10D+2 0.03237 -0.03237 -0.06928 0.00000 0.06928
113 10D-2 0.07093 0.07093 0.10541 0.03791 0.10541
114 11D 0 -0.21823 -0.21823 0.42660 -0.85320 0.42660
115 11D+1 -0.85706 -0.77448 -0.31895 -0.97471 -0.97471
116 11D-1 -0.77448 -0.85706 -0.97471 -0.97471 -0.31895
117 11D+2 -0.37799 0.37799 0.73889 0.00000 -0.73889
118 11D-2 -0.77448 -0.77448 -0.97471 -0.31895 -0.97471
119 12D 0 -0.45580 -0.45580 0.65952 -1.31904 0.65952
120 12D+1 -1.29679 -0.03324 -0.13105 -1.37261 -1.37261
121 12D-1 -0.03324 -1.29679 -1.37261 -1.37261 -0.13105
122 12D+2 -0.78946 0.78946 1.14232 0.00000 -1.14232
123 12D-2 -0.03324 -0.03324 -1.37261 -0.13105 -1.37261
124 13F 0 -0.01418 -0.01418 -0.00773 -0.00959 -0.00773
125 13F+1 0.02173 0.01148 0.01289 -0.00343 0.00587
126 13F-1 0.01148 0.02173 0.00587 -0.00343 0.01289
127 13F+2 0.01651 -0.01651 0.01032 0.00000 -0.01032
128 13F-2 0.03702 0.03702 0.00628 0.00628 0.00628
129 13F+3 -0.00110 -0.01483 0.00021 -0.01243 -0.00758
130 13F-3 0.01483 0.00110 0.00758 0.01243 -0.00021
131 14F 0 0.04262 0.04262 -0.28792 0.20248 -0.28792
132 14F+1 0.16886 0.09177 -0.24114 0.59377 -0.12399
133 14F-1 0.09177 0.16886 -0.12399 0.59377 -0.24114
134 14F+2 0.24661 -0.24661 -0.52805 0.00000 0.52805
135 14F-2 -0.00693 -0.00693 0.39913 0.39913 0.39913
136 14F+3 0.18471 -0.11847 -0.55098 0.09574 0.16007
137 14F-3 0.11847 -0.18471 -0.16007 -0.09574 0.55098
138 15G 0 0.01098 0.01098 0.01337 0.01394 0.01337
139 15G+1 -0.00254 -0.00248 0.00814 -0.00338 0.00625
140 15G-1 -0.00248 -0.00254 0.00625 -0.00338 0.00814
141 15G+2 -0.00696 0.00696 0.00051 0.00000 -0.00051
142 15G-2 -0.01922 -0.01922 -0.00407 -0.02301 -0.00407
143 15G+3 -0.00671 0.02148 0.02152 0.00562 0.00198
144 15G-3 -0.02148 0.00671 -0.00198 -0.00562 -0.02152
145 15G+4 0.00402 0.00402 0.01168 0.01101 0.01168
146 15G-4 -0.00991 0.00991 0.00515 0.00000 -0.00515
147 3 H 1S 0.05250 0.05250 0.02968 -0.02968 0.02968
148 2S 0.00131 0.00131 -1.20908 1.20908 -1.20908
149 3S 14.37627 14.37627 14.15890 -14.15890 14.15890
150 4S 9.07787 9.07787 5.12935 -5.12935 5.12935
151 5S -0.29569 -0.29569 0.02441 -0.02441 0.02441
152 6PX -0.04014 -0.10594 -0.00898 0.00898 0.08323
153 6PY -0.10594 -0.04014 0.08323 0.00898 -0.00898
154 6PZ 0.04014 0.04014 0.00898 0.08323 0.00898
155 7PX 0.23216 0.88299 -0.08348 0.08348 -1.03071
156 7PY 0.88299 0.23216 -1.03071 0.08348 -0.08348
157 7PZ -0.23216 -0.23216 0.08348 -1.03071 0.08348
158 8PX 4.54717 1.82926 2.97955 -2.97955 7.21854
159 8PY 1.82926 4.54717 7.21854 -2.97955 2.97955
160 8PZ -4.54717 -4.54717 -2.97955 7.21854 -2.97955
161 9PX 2.73421 1.35935 1.22211 -1.22211 2.51386
162 9PY 1.35935 2.73421 2.51386 -1.22211 1.22211
163 9PZ -2.73421 -2.73421 -1.22211 2.51386 -1.22211
164 10D 0 -0.01869 -0.01869 0.04000 0.08000 0.04000
165 10D+1 0.07053 0.07093 0.03791 -0.10541 0.10541
166 10D-1 0.07093 0.07053 0.10541 -0.10541 0.03791
167 10D+2 -0.03237 0.03237 0.06928 0.00000 -0.06928
168 10D-2 -0.07093 -0.07093 -0.10541 0.03791 -0.10541
169 11D 0 0.21823 0.21823 -0.42660 -0.85320 -0.42660
170 11D+1 -0.85706 -0.77448 -0.31895 0.97471 -0.97471
171 11D-1 -0.77448 -0.85706 -0.97471 0.97471 -0.31895
172 11D+2 0.37799 -0.37799 -0.73889 0.00000 0.73889
173 11D-2 0.77448 0.77448 0.97471 -0.31895 0.97471
174 12D 0 0.45580 0.45580 -0.65952 -1.31904 -0.65952
175 12D+1 -1.29679 -0.03324 -0.13105 1.37261 -1.37261
176 12D-1 -0.03324 -1.29679 -1.37261 1.37261 -0.13105
177 12D+2 0.78946 -0.78946 -1.14232 0.00000 1.14232
178 12D-2 0.03324 0.03324 1.37261 -0.13105 1.37261
179 13F 0 0.01418 0.01418 0.00773 -0.00959 0.00773
180 13F+1 0.02173 0.01148 0.01289 0.00343 0.00587
181 13F-1 0.01148 0.02173 0.00587 0.00343 0.01289
182 13F+2 -0.01651 0.01651 -0.01032 0.00000 0.01032
183 13F-2 -0.03702 -0.03702 -0.00628 0.00628 -0.00628
184 13F+3 -0.00110 -0.01483 0.00021 0.01243 -0.00758
185 13F-3 0.01483 0.00110 0.00758 -0.01243 -0.00021
186 14F 0 -0.04262 -0.04262 0.28792 0.20248 0.28792
187 14F+1 0.16886 0.09177 -0.24114 -0.59377 -0.12399
188 14F-1 0.09177 0.16886 -0.12399 -0.59377 -0.24114
189 14F+2 -0.24661 0.24661 0.52805 0.00000 -0.52805
190 14F-2 0.00693 0.00693 -0.39913 0.39913 -0.39913
191 14F+3 0.18471 -0.11847 -0.55098 -0.09574 0.16007
192 14F-3 0.11847 -0.18471 -0.16007 0.09574 0.55098
193 15G 0 -0.01098 -0.01098 -0.01337 0.01394 -0.01337
194 15G+1 -0.00254 -0.00248 0.00814 0.00338 0.00625
195 15G-1 -0.00248 -0.00254 0.00625 0.00338 0.00814
196 15G+2 0.00696 -0.00696 -0.00051 0.00000 0.00051
197 15G-2 0.01922 0.01922 0.00407 -0.02301 0.00407
198 15G+3 -0.00671 0.02148 0.02152 -0.00562 0.00198
199 15G-3 -0.02148 0.00671 -0.00198 0.00562 -0.02152
200 15G+4 -0.00402 -0.00402 -0.01168 0.01101 -0.01168
201 15G-4 0.00991 -0.00991 -0.00515 0.00000 0.00515
202 4 H 1S 0.05250 -0.05250 0.02968 0.02968 -0.02968
203 2S 0.00131 -0.00131 -1.20908 -1.20908 1.20908
204 3S 14.37627 -14.37627 14.15890 14.15890 -14.15890
205 4S 9.07787 -9.07787 5.12935 5.12935 -5.12935
206 5S -0.29569 0.29569 0.02441 0.02441 -0.02441
207 6PX 0.04014 -0.10594 0.00898 0.00898 0.08323
208 6PY -0.10594 0.04014 0.08323 -0.00898 0.00898
209 6PZ -0.04014 0.04014 -0.00898 0.08323 0.00898
210 7PX -0.23216 0.88299 0.08348 0.08348 -1.03071
211 7PY 0.88299 -0.23216 -1.03071 -0.08348 0.08348
212 7PZ 0.23216 -0.23216 -0.08348 -1.03071 0.08348
213 8PX -4.54717 1.82926 -2.97955 -2.97955 7.21854
214 8PY 1.82926 -4.54717 7.21854 2.97955 -2.97955
215 8PZ 4.54717 -4.54717 2.97955 7.21854 -2.97955
216 9PX -2.73421 1.35935 -1.22211 -1.22211 2.51386
217 9PY 1.35935 -2.73421 2.51386 1.22211 -1.22211
218 9PZ 2.73421 -2.73421 1.22211 2.51386 -1.22211
219 10D 0 -0.01869 0.01869 0.04000 -0.08000 -0.04000
220 10D+1 0.07053 -0.07093 0.03791 0.10541 -0.10541
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224 11D 0 0.21823 -0.21823 -0.42660 0.85320 0.42660
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226 11D-1 0.77448 -0.85706 0.97471 0.97471 -0.31895
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228 11D-2 -0.77448 0.77448 -0.97471 -0.31895 0.97471
229 12D 0 0.45580 -0.45580 -0.65952 1.31904 0.65952
230 12D+1 -1.29679 0.03324 -0.13105 -1.37261 1.37261
231 12D-1 0.03324 -1.29679 1.37261 1.37261 -0.13105
232 12D+2 0.78946 0.78946 -1.14232 0.00000 -1.14232
233 12D-2 -0.03324 0.03324 -1.37261 -0.13105 1.37261
234 13F 0 -0.01418 0.01418 -0.00773 -0.00959 0.00773
235 13F+1 -0.02173 0.01148 -0.01289 0.00343 0.00587
236 13F-1 0.01148 -0.02173 0.00587 -0.00343 -0.01289
237 13F+2 0.01651 0.01651 0.01032 0.00000 0.01032
238 13F-2 -0.03702 0.03702 -0.00628 -0.00628 0.00628
239 13F+3 0.00110 -0.01483 -0.00021 0.01243 -0.00758
240 13F-3 0.01483 -0.00110 0.00758 0.01243 0.00021
241 14F 0 0.04262 -0.04262 -0.28792 0.20248 0.28792
242 14F+1 -0.16886 0.09177 0.24114 -0.59377 -0.12399
243 14F-1 0.09177 -0.16886 -0.12399 0.59377 0.24114
244 14F+2 0.24661 0.24661 -0.52805 0.00000 -0.52805
245 14F-2 0.00693 -0.00693 -0.39913 -0.39913 0.39913
246 14F+3 -0.18471 -0.11847 0.55098 -0.09574 0.16007
247 14F-3 0.11847 0.18471 -0.16007 -0.09574 -0.55098
248 15G 0 -0.01098 0.01098 -0.01337 -0.01394 0.01337
249 15G+1 -0.00254 0.00248 0.00814 -0.00338 -0.00625
250 15G-1 0.00248 -0.00254 -0.00625 0.00338 0.00814
251 15G+2 0.00696 0.00696 -0.00051 0.00000 -0.00051
252 15G-2 -0.01922 0.01922 -0.00407 -0.02301 0.00407
253 15G+3 -0.00671 -0.02148 0.02152 0.00562 -0.00198
254 15G-3 0.02148 0.00671 0.00198 0.00562 -0.02152
255 15G+4 -0.00402 0.00402 -0.01168 -0.01101 0.01168
256 15G-4 -0.00991 -0.00991 0.00515 0.00000 0.00515
257 5 H 1S -0.05250 0.05250 -0.02968 0.02968 0.02968
258 2S -0.00131 0.00131 1.20908 -1.20908 -1.20908
259 3S -14.37627 14.37627 -14.15890 14.15890 14.15890
260 4S -9.07787 9.07787 -5.12935 5.12935 5.12935
261 5S 0.29569 -0.29569 -0.02441 0.02441 0.02441
262 6PX 0.04014 -0.10594 0.00898 -0.00898 0.08323
263 6PY -0.10594 0.04014 0.08323 0.00898 0.00898
264 6PZ 0.04014 -0.04014 0.00898 0.08323 -0.00898
265 7PX -0.23216 0.88299 0.08348 -0.08348 -1.03071
266 7PY 0.88299 -0.23216 -1.03071 0.08348 0.08348
267 7PZ -0.23216 0.23216 0.08348 -1.03071 -0.08348
268 8PX -4.54717 1.82926 -2.97955 2.97955 7.21854
269 8PY 1.82926 -4.54717 7.21854 -2.97955 -2.97955
270 8PZ -4.54717 4.54717 -2.97955 7.21854 2.97955
271 9PX -2.73421 1.35935 -1.22211 1.22211 2.51386
272 9PY 1.35935 -2.73421 2.51386 -1.22211 -1.22211
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274 10D 0 0.01869 -0.01869 -0.04000 -0.08000 0.04000
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277 10D+2 0.03237 0.03237 -0.06928 0.00000 -0.06928
278 10D-2 -0.07093 0.07093 -0.10541 0.03791 0.10541
279 11D 0 -0.21823 0.21823 0.42660 0.85320 -0.42660
280 11D+1 -0.85706 0.77448 -0.31895 0.97471 0.97471
281 11D-1 0.77448 -0.85706 0.97471 -0.97471 -0.31895
282 11D+2 -0.37799 -0.37799 0.73889 0.00000 0.73889
283 11D-2 0.77448 -0.77448 0.97471 -0.31895 -0.97471
284 12D 0 -0.45580 0.45580 0.65952 1.31904 -0.65952
285 12D+1 -1.29679 0.03324 -0.13105 1.37261 1.37261
286 12D-1 0.03324 -1.29679 1.37261 -1.37261 -0.13105
287 12D+2 -0.78946 -0.78946 1.14232 0.00000 1.14232
288 12D-2 0.03324 -0.03324 1.37261 -0.13105 -1.37261
289 13F 0 0.01418 -0.01418 0.00773 -0.00959 -0.00773
290 13F+1 -0.02173 0.01148 -0.01289 -0.00343 0.00587
291 13F-1 0.01148 -0.02173 0.00587 0.00343 -0.01289
292 13F+2 -0.01651 -0.01651 -0.01032 0.00000 -0.01032
293 13F-2 0.03702 -0.03702 0.00628 -0.00628 -0.00628
294 13F+3 0.00110 -0.01483 -0.00021 -0.01243 -0.00758
295 13F-3 0.01483 -0.00110 0.00758 -0.01243 0.00021
296 14F 0 -0.04262 0.04262 0.28792 0.20248 -0.28792
297 14F+1 -0.16886 0.09177 0.24114 0.59377 -0.12399
298 14F-1 0.09177 -0.16886 -0.12399 -0.59377 0.24114
299 14F+2 -0.24661 -0.24661 0.52805 0.00000 0.52805
300 14F-2 -0.00693 0.00693 0.39913 -0.39913 -0.39913
301 14F+3 -0.18471 -0.11847 0.55098 0.09574 0.16007
302 14F-3 0.11847 0.18471 -0.16007 0.09574 -0.55098
303 15G 0 0.01098 -0.01098 0.01337 -0.01394 -0.01337
304 15G+1 -0.00254 0.00248 0.00814 0.00338 -0.00625
305 15G-1 0.00248 -0.00254 -0.00625 -0.00338 0.00814
306 15G+2 -0.00696 -0.00696 0.00051 0.00000 0.00051
307 15G-2 0.01922 -0.01922 0.00407 -0.02301 -0.00407
308 15G+3 -0.00671 -0.02148 0.02152 -0.00562 -0.00198
309 15G-3 0.02148 0.00671 0.00198 -0.00562 -0.02152
310 15G+4 0.00402 -0.00402 0.01168 -0.01101 -0.01168
311 15G-4 0.00991 0.00991 -0.00515 0.00000 -0.00515
166 167 168 169 170
(T1)--V (T1)--V (T1)--V (E)--V (E)--V
Eigenvalues -- 7.63741 7.63741 7.63741 7.83400 7.83400
1 1 C 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 0.00000 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 0.00484 0.00796
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 0.00796 -0.00484
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 -0.00566 -0.00930
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 -0.00930 0.00566
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 6.49820 10.68418
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 10.68418 -6.49820
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 1.71325 2.81688
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 2.81688 -1.71325
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 -0.10263 0.00000 0.00000 0.00000 0.00000
44 16F-1 0.00000 -0.10263 0.00000 0.00000 0.00000
45 16F+2 0.00000 0.00000 -0.12982 0.00000 0.00000
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 -0.07950 0.00000 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.07950 0.00000 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 3.42991 0.00000 0.00000 0.00000 0.00000
51 17F-1 0.00000 3.42991 0.00000 0.00000 0.00000
52 17F+2 0.00000 0.00000 4.33853 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 2.65680 0.00000 0.00000 0.00000 0.00000
55 17F-3 0.00000 -2.65680 0.00000 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 1.56577 0.00000 0.00000 0.00000 0.00000
58 18F-1 0.00000 1.56577 0.00000 0.00000 0.00000
59 18F+2 0.00000 0.00000 1.98057 0.00000 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 1.21284 0.00000 0.00000 0.00000 0.00000
62 18F-3 0.00000 -1.21284 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00533 0.00876
64 19G+1 0.00000 -0.14730 0.00000 0.00000 0.00000
65 19G-1 -0.14730 0.00000 0.00000 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 -0.01356 0.00825
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
68 19G+3 0.00000 0.05567 0.00000 0.00000 0.00000
69 19G-3 -0.05567 0.00000 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 -0.00630 -0.01036
71 19G-4 0.00000 0.00000 -0.15747 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 -0.00663 -0.01090
73 20G+1 0.00000 2.20406 0.00000 0.00000 0.00000
74 20G-1 2.20406 0.00000 0.00000 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.01689 -0.01027
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
77 20G+3 0.00000 -0.83306 0.00000 0.00000 0.00000
78 20G-3 0.83306 0.00000 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 0.00784 0.01290
80 20G-4 0.00000 0.00000 2.35624 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 -0.03559 0.00000 0.00000 0.00000 0.00000
83 21H-1 0.00000 -0.03559 0.00000 0.00000 0.00000
84 21H+2 0.00000 0.00000 0.05381 0.00000 0.00000
85 21H-2 0.00000 0.00000 0.00000 0.29771 0.48948
86 21H+3 0.01648 0.00000 0.00000 0.00000 0.00000
87 21H-3 0.00000 -0.01648 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 0.48948 -0.29771
90 21H+5 0.03684 0.00000 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.03684 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 -0.00475 0.00475 -0.04765 0.08706
98 6PY -0.00475 0.00000 -0.00475 0.09922 -0.00227
99 6PZ 0.00475 0.00475 0.00000 -0.05157 -0.08479
100 7PX 0.00000 0.02617 -0.02617 0.49773 -0.90943
101 7PY 0.02617 0.00000 0.02617 -1.03645 0.02367
102 7PZ -0.02617 -0.02617 0.00000 0.53873 0.88576
103 8PX 0.00000 2.04939 -2.04939 -1.76650 3.22769
104 8PY 2.04939 0.00000 2.04939 3.67851 -0.08401
105 8PZ -2.04939 -2.04939 0.00000 -1.91201 -3.14368
106 9PX 0.00000 0.33561 -0.33561 -0.87410 1.59713
107 9PY 0.33561 0.00000 0.33561 1.82020 -0.04157
108 9PZ -0.33561 -0.33561 0.00000 -0.94610 -1.55556
109 10D 0 -0.13442 -0.13442 0.00000 -0.02792 -0.04591
110 10D+1 -0.08432 0.00000 -0.08432 -0.05781 0.00132
111 10D-1 0.00000 -0.08432 0.08432 0.02776 -0.05073
112 10D+2 -0.07761 0.07761 -0.15522 -0.04591 0.02792
113 10D-2 0.08432 0.08432 0.00000 0.03005 0.04941
114 11D 0 1.10750 1.10750 0.00000 0.34183 0.56202
115 11D+1 0.74353 0.00000 0.74353 0.66283 -0.01514
116 11D-1 0.00000 0.74353 -0.74353 -0.31830 0.58160
117 11D+2 0.63941 -0.63941 1.27883 0.56202 -0.34183
118 11D-2 -0.74353 -0.74353 0.00000 -0.34452 -0.56646
119 12D 0 0.64677 0.64677 0.00000 0.98700 1.62280
120 12D+1 0.34352 0.00000 0.34352 1.59407 -0.03640
121 12D-1 0.00000 0.34352 -0.34352 -0.76551 1.39871
122 12D+2 0.37341 -0.37341 0.74683 1.62280 -0.98700
123 12D-2 -0.34352 -0.34352 0.00000 -0.82856 -1.36230
124 13F 0 0.02896 0.02896 0.00000 -0.02102 -0.03456
125 13F+1 0.00709 0.02437 -0.01109 0.02567 -0.01419
126 13F-1 0.02437 0.00709 0.01109 -0.02441 0.01626
127 13F+2 0.00840 -0.00840 0.00897 0.01697 -0.01032
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
129 13F+3 0.00550 -0.01775 0.02803 -0.00468 0.03390
130 13F-3 0.01775 -0.00550 0.02803 -0.03225 -0.01143
131 14F 0 -0.22022 -0.22022 0.00000 0.00231 0.00379
132 14F+1 -0.40053 -0.39737 -0.12766 -0.65871 -0.35741
133 14F-1 -0.39737 -0.40053 0.12766 -0.01439 -0.74929
134 14F+2 -0.33206 0.33206 -0.50663 -0.80992 0.49260
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
136 14F+3 -0.31025 -0.02925 -0.37744 -0.50754 -0.28177
137 14F-3 0.02925 0.31025 -0.37744 0.01676 0.58027
138 15G 0 -0.01957 -0.01957 0.00000 -0.00168 -0.00276
139 15G+1 0.00175 0.00270 0.00465 0.00767 0.02966
140 15G-1 0.00270 0.00175 -0.00465 0.02281 0.02045
141 15G+2 0.01750 -0.01750 0.03501 0.00428 -0.00260
142 15G-2 0.00906 0.00906 0.00000 0.01027 0.01689
143 15G+3 0.00902 -0.00102 0.00792 0.01823 -0.01169
144 15G-3 0.00102 -0.00902 0.00792 0.01877 -0.01081
145 15G+4 0.02315 0.02315 0.00000 0.00199 0.00327
146 15G-4 -0.00155 0.00155 0.00289 0.02724 -0.01657
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 -0.00475 -0.00475 0.04765 -0.08706
153 6PY -0.00475 0.00000 0.00475 -0.09922 0.00227
154 6PZ -0.00475 -0.00475 0.00000 -0.05157 -0.08479
155 7PX 0.00000 0.02617 0.02617 -0.49773 0.90943
156 7PY 0.02617 0.00000 -0.02617 1.03645 -0.02367
157 7PZ 0.02617 0.02617 0.00000 0.53873 0.88576
158 8PX 0.00000 2.04939 2.04939 1.76650 -3.22769
159 8PY 2.04939 0.00000 -2.04939 -3.67851 0.08401
160 8PZ 2.04939 2.04939 0.00000 -1.91201 -3.14368
161 9PX 0.00000 0.33561 0.33561 0.87410 -1.59713
162 9PY 0.33561 0.00000 -0.33561 -1.82020 0.04157
163 9PZ 0.33561 0.33561 0.00000 -0.94610 -1.55556
164 10D 0 0.13442 0.13442 0.00000 -0.02792 -0.04591
165 10D+1 -0.08432 0.00000 0.08432 0.05781 -0.00132
166 10D-1 0.00000 -0.08432 -0.08432 -0.02776 0.05073
167 10D+2 0.07761 -0.07761 -0.15522 -0.04591 0.02792
168 10D-2 -0.08432 -0.08432 0.00000 0.03005 0.04941
169 11D 0 -1.10750 -1.10750 0.00000 0.34183 0.56202
170 11D+1 0.74353 0.00000 -0.74353 -0.66283 0.01514
171 11D-1 0.00000 0.74353 0.74353 0.31830 -0.58160
172 11D+2 -0.63941 0.63941 1.27883 0.56202 -0.34183
173 11D-2 0.74353 0.74353 0.00000 -0.34452 -0.56646
174 12D 0 -0.64677 -0.64677 0.00000 0.98700 1.62280
175 12D+1 0.34352 0.00000 -0.34352 -1.59407 0.03640
176 12D-1 0.00000 0.34352 0.34352 0.76551 -1.39871
177 12D+2 -0.37341 0.37341 0.74683 1.62280 -0.98700
178 12D-2 0.34352 0.34352 0.00000 -0.82856 -1.36230
179 13F 0 -0.02896 -0.02896 0.00000 -0.02102 -0.03456
180 13F+1 0.00709 0.02437 0.01109 -0.02567 0.01419
181 13F-1 0.02437 0.00709 -0.01109 0.02441 -0.01626
182 13F+2 -0.00840 0.00840 0.00897 0.01697 -0.01032
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
184 13F+3 0.00550 -0.01775 -0.02803 0.00468 -0.03390
185 13F-3 0.01775 -0.00550 -0.02803 0.03225 0.01143
186 14F 0 0.22022 0.22022 0.00000 0.00231 0.00379
187 14F+1 -0.40053 -0.39737 0.12766 0.65871 0.35741
188 14F-1 -0.39737 -0.40053 -0.12766 0.01439 0.74929
189 14F+2 0.33206 -0.33206 -0.50663 -0.80992 0.49260
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
191 14F+3 -0.31025 -0.02925 0.37744 0.50754 0.28177
192 14F-3 0.02925 0.31025 0.37744 -0.01676 -0.58027
193 15G 0 0.01957 0.01957 0.00000 -0.00168 -0.00276
194 15G+1 0.00175 0.00270 -0.00465 -0.00767 -0.02966
195 15G-1 0.00270 0.00175 0.00465 -0.02281 -0.02045
196 15G+2 -0.01750 0.01750 0.03501 0.00428 -0.00260
197 15G-2 -0.00906 -0.00906 0.00000 0.01027 0.01689
198 15G+3 0.00902 -0.00102 -0.00792 -0.01823 0.01169
199 15G-3 0.00102 -0.00902 -0.00792 -0.01877 0.01081
200 15G+4 -0.02315 -0.02315 0.00000 0.00199 0.00327
201 15G-4 0.00155 -0.00155 0.00289 0.02724 -0.01657
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 0.00475 -0.00475 -0.04765 0.08706
208 6PY 0.00475 0.00000 -0.00475 -0.09922 0.00227
209 6PZ -0.00475 0.00475 0.00000 0.05157 0.08479
210 7PX 0.00000 -0.02617 0.02617 0.49773 -0.90943
211 7PY -0.02617 0.00000 0.02617 1.03645 -0.02367
212 7PZ 0.02617 -0.02617 0.00000 -0.53873 -0.88576
213 8PX 0.00000 -2.04939 2.04939 -1.76650 3.22769
214 8PY -2.04939 0.00000 2.04939 -3.67851 0.08401
215 8PZ 2.04939 -2.04939 0.00000 1.91201 3.14368
216 9PX 0.00000 -0.33561 0.33561 -0.87410 1.59713
217 9PY -0.33561 0.00000 0.33561 -1.82020 0.04157
218 9PZ 0.33561 -0.33561 0.00000 0.94610 1.55556
219 10D 0 -0.13442 0.13442 0.00000 -0.02792 -0.04591
220 10D+1 0.08432 0.00000 -0.08432 0.05781 -0.00132
221 10D-1 0.00000 0.08432 -0.08432 0.02776 -0.05073
222 10D+2 -0.07761 -0.07761 0.15522 -0.04591 0.02792
223 10D-2 -0.08432 0.08432 0.00000 -0.03005 -0.04941
224 11D 0 1.10750 -1.10750 0.00000 0.34183 0.56202
225 11D+1 -0.74353 0.00000 0.74353 -0.66283 0.01514
226 11D-1 0.00000 -0.74353 0.74353 -0.31830 0.58160
227 11D+2 0.63941 0.63941 -1.27883 0.56202 -0.34183
228 11D-2 0.74353 -0.74353 0.00000 0.34452 0.56646
229 12D 0 0.64677 -0.64677 0.00000 0.98700 1.62280
230 12D+1 -0.34352 0.00000 0.34352 -1.59407 0.03640
231 12D-1 0.00000 -0.34352 0.34352 -0.76551 1.39871
232 12D+2 0.37341 0.37341 -0.74683 1.62280 -0.98700
233 12D-2 0.34352 -0.34352 0.00000 0.82856 1.36230
234 13F 0 -0.02896 0.02896 0.00000 0.02102 0.03456
235 13F+1 0.00709 -0.02437 0.01109 0.02567 -0.01419
236 13F-1 -0.02437 0.00709 0.01109 0.02441 -0.01626
237 13F+2 -0.00840 -0.00840 0.00897 -0.01697 0.01032
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
239 13F+3 0.00550 0.01775 -0.02803 -0.00468 0.03390
240 13F-3 -0.01775 -0.00550 0.02803 0.03225 0.01143
241 14F 0 0.22022 -0.22022 0.00000 -0.00231 -0.00379
242 14F+1 -0.40053 0.39737 0.12766 -0.65871 -0.35741
243 14F-1 0.39737 -0.40053 0.12766 0.01439 0.74929
244 14F+2 0.33206 0.33206 -0.50663 0.80992 -0.49260
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
246 14F+3 -0.31025 0.02925 0.37744 -0.50754 -0.28177
247 14F-3 -0.02925 0.31025 -0.37744 -0.01676 -0.58027
248 15G 0 -0.01957 0.01957 0.00000 -0.00168 -0.00276
249 15G+1 -0.00175 0.00270 0.00465 -0.00767 -0.02966
250 15G-1 0.00270 -0.00175 0.00465 0.02281 0.02045
251 15G+2 0.01750 0.01750 -0.03501 0.00428 -0.00260
252 15G-2 -0.00906 0.00906 0.00000 -0.01027 -0.01689
253 15G+3 -0.00902 -0.00102 0.00792 -0.01823 0.01169
254 15G-3 0.00102 0.00902 -0.00792 0.01877 -0.01081
255 15G+4 0.02315 -0.02315 0.00000 0.00199 0.00327
256 15G-4 0.00155 0.00155 0.00289 -0.02724 0.01657
257 5 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
258 2S 0.00000 0.00000 0.00000 0.00000 0.00000
259 3S 0.00000 0.00000 0.00000 0.00000 0.00000
260 4S 0.00000 0.00000 0.00000 0.00000 0.00000
261 5S 0.00000 0.00000 0.00000 0.00000 0.00000
262 6PX 0.00000 0.00475 0.00475 0.04765 -0.08706
263 6PY 0.00475 0.00000 0.00475 0.09922 -0.00227
264 6PZ 0.00475 -0.00475 0.00000 0.05157 0.08479
265 7PX 0.00000 -0.02617 -0.02617 -0.49773 0.90943
266 7PY -0.02617 0.00000 -0.02617 -1.03645 0.02367
267 7PZ -0.02617 0.02617 0.00000 -0.53873 -0.88576
268 8PX 0.00000 -2.04939 -2.04939 1.76650 -3.22769
269 8PY -2.04939 0.00000 -2.04939 3.67851 -0.08401
270 8PZ -2.04939 2.04939 0.00000 1.91201 3.14368
271 9PX 0.00000 -0.33561 -0.33561 0.87410 -1.59713
272 9PY -0.33561 0.00000 -0.33561 1.82020 -0.04157
273 9PZ -0.33561 0.33561 0.00000 0.94610 1.55556
274 10D 0 0.13442 -0.13442 0.00000 -0.02792 -0.04591
275 10D+1 0.08432 0.00000 0.08432 -0.05781 0.00132
276 10D-1 0.00000 0.08432 0.08432 -0.02776 0.05073
277 10D+2 0.07761 0.07761 0.15522 -0.04591 0.02792
278 10D-2 0.08432 -0.08432 0.00000 -0.03005 -0.04941
279 11D 0 -1.10750 1.10750 0.00000 0.34183 0.56202
280 11D+1 -0.74353 0.00000 -0.74353 0.66283 -0.01514
281 11D-1 0.00000 -0.74353 -0.74353 0.31830 -0.58160
282 11D+2 -0.63941 -0.63941 -1.27883 0.56202 -0.34183
283 11D-2 -0.74353 0.74353 0.00000 0.34452 0.56646
284 12D 0 -0.64677 0.64677 0.00000 0.98700 1.62280
285 12D+1 -0.34352 0.00000 -0.34352 1.59407 -0.03640
286 12D-1 0.00000 -0.34352 -0.34352 0.76551 -1.39871
287 12D+2 -0.37341 -0.37341 -0.74683 1.62280 -0.98700
288 12D-2 -0.34352 0.34352 0.00000 0.82856 1.36230
289 13F 0 0.02896 -0.02896 0.00000 0.02102 0.03456
290 13F+1 0.00709 -0.02437 -0.01109 -0.02567 0.01419
291 13F-1 -0.02437 0.00709 -0.01109 -0.02441 0.01626
292 13F+2 0.00840 0.00840 0.00897 -0.01697 0.01032
293 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
294 13F+3 0.00550 0.01775 0.02803 0.00468 -0.03390
295 13F-3 -0.01775 -0.00550 -0.02803 -0.03225 -0.01143
296 14F 0 -0.22022 0.22022 0.00000 -0.00231 -0.00379
297 14F+1 -0.40053 0.39737 -0.12766 0.65871 0.35741
298 14F-1 0.39737 -0.40053 -0.12766 -0.01439 -0.74929
299 14F+2 -0.33206 -0.33206 -0.50663 0.80992 -0.49260
300 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
301 14F+3 -0.31025 0.02925 -0.37744 0.50754 0.28177
302 14F-3 -0.02925 0.31025 0.37744 0.01676 0.58027
303 15G 0 0.01957 -0.01957 0.00000 -0.00168 -0.00276
304 15G+1 -0.00175 0.00270 -0.00465 0.00767 0.02966
305 15G-1 0.00270 -0.00175 -0.00465 -0.02281 -0.02045
306 15G+2 -0.01750 -0.01750 -0.03501 0.00428 -0.00260
307 15G-2 0.00906 -0.00906 0.00000 -0.01027 -0.01689
308 15G+3 -0.00902 -0.00102 -0.00792 0.01823 -0.01169
309 15G-3 0.00102 0.00902 0.00792 -0.01877 0.01081
310 15G+4 -0.02315 0.02315 0.00000 0.00199 0.00327
311 15G-4 -0.00155 -0.00155 0.00289 -0.02724 0.01657
171 172 173 174 175
(T2)--V (T2)--V (T2)--V (A1)--V (T1)--V
Eigenvalues -- 8.18590 8.18590 8.18590 8.22337 9.50030
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2 2S 0.00000 0.00000 0.00000 0.01393 0.00000
3 3S 0.00000 0.00000 0.00000 -1.87580 0.00000
4 4S 0.00000 0.00000 0.00000 10.39826 0.00000
5 5S 0.00000 0.00000 0.00000 5.72841 0.00000
6 6S 0.00000 0.00000 0.00000 2.20566 0.00000
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9 7PZ 0.29915 0.00000 0.00000 0.00000 0.00000
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12 8PZ -3.46034 0.00000 0.00000 0.00000 0.00000
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14 9PY 0.00000 38.30874 0.00000 0.00000 0.00000
15 9PZ 38.30874 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 12.68296 0.00000 0.00000
17 10PY 0.00000 12.68296 0.00000 0.00000 0.00000
18 10PZ 12.68296 0.00000 0.00000 0.00000 0.00000
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20 11PY 0.00000 0.29109 0.00000 0.00000 0.00000
21 11PZ 0.29109 0.00000 0.00000 0.00000 0.00000
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25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 -0.22833 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 1.22941 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 1.22941 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 1.22941 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 10.51507 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 10.51507 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 10.51507 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 2.55851 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.00000 2.55851 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 2.55851 0.00000 0.00000 0.00000 0.00000
42 16F 0 -0.10802 0.00000 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.06615 0.00000 0.00000
44 16F-1 0.00000 0.06615 0.00000 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 -0.19948
46 16F-2 0.00000 0.00000 0.00000 0.07142 0.00000
47 16F+3 0.00000 0.00000 -0.08540 0.00000 0.00000
48 16F-3 0.00000 0.08540 0.00000 0.00000 0.00000
49 17F 0 -0.26337 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.16128 0.00000 0.00000
51 17F-1 0.00000 0.16128 0.00000 0.00000 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 -0.15395
53 17F-2 0.00000 0.00000 0.00000 -1.01825 0.00000
54 17F+3 0.00000 0.00000 -0.20821 0.00000 0.00000
55 17F-3 0.00000 0.20821 0.00000 0.00000 0.00000
56 18F 0 0.12679 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 -0.07764 0.00000 0.00000
58 18F-1 0.00000 -0.07764 0.00000 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 -0.17797
60 18F-2 0.00000 0.00000 0.00000 -1.01633 0.00000
61 18F+3 0.00000 0.00000 0.10023 0.00000 0.00000
62 18F-3 0.00000 -0.10023 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 -0.26753 0.00000
64 19G+1 0.00000 -0.09113 0.00000 0.00000 0.00000
65 19G-1 0.00000 0.00000 -0.09113 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.25776 0.00000 0.00000 0.00000 0.00000
68 19G+3 0.00000 -0.24111 0.00000 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.24111 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 -0.22611 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 -0.11555
72 20G 0 0.00000 0.00000 0.00000 1.10915 0.00000
73 20G+1 0.00000 -0.81225 0.00000 0.00000 0.00000
74 20G-1 0.00000 0.00000 -0.81225 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 2.29738 0.00000 0.00000 0.00000 0.00000
77 20G+3 0.00000 -2.14901 0.00000 0.00000 0.00000
78 20G-3 0.00000 0.00000 2.14901 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 0.93740 0.00000
80 20G-4 0.00000 0.00000 0.00000 0.00000 -1.16894
81 21H 0 -0.18155 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 -0.20289 0.00000 0.00000
83 21H-1 0.00000 -0.20289 0.00000 0.00000 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 1.21233
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.00000 0.00000 -0.06476 0.00000 0.00000
87 21H-3 0.00000 0.06476 0.00000 0.00000 0.00000
88 21H+4 -0.20075 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 -0.16705 0.00000 0.00000
91 21H-5 0.00000 -0.16705 0.00000 0.00000 0.00000
92 2 H 1S 0.02183 0.02183 0.02183 0.09751 0.00000
93 2S 1.42132 1.42132 1.42132 1.80641 0.00000
94 3S -17.26512 -17.26512 -17.26512 -2.21694 0.00000
95 4S -7.75192 -7.75192 -7.75192 -2.22615 0.00000
96 5S 0.17134 0.17134 0.17134 0.01268 0.00000
97 6PX 0.07966 0.07966 -0.00535 0.09292 -0.00186
98 6PY 0.07966 -0.00535 0.07966 0.09292 0.00186
99 6PZ -0.00535 0.07966 0.07966 0.09292 0.00000
100 7PX -0.97286 -0.97286 -0.10562 -0.90807 0.07141
101 7PY -0.97286 -0.10562 -0.97286 -0.90807 -0.07141
102 7PZ -0.10562 -0.97286 -0.97286 -0.90807 0.00000
103 8PX 7.13491 7.13491 3.12449 1.69439 0.30249
104 8PY 7.13491 3.12449 7.13491 1.69439 -0.30249
105 8PZ 3.12449 7.13491 7.13491 1.69439 0.00000
106 9PX 2.88801 2.88801 1.61268 0.70214 0.03414
107 9PY 2.88801 1.61268 2.88801 0.70214 -0.03414
108 9PZ 1.61268 2.88801 2.88801 0.70214 0.00000
109 10D 0 -0.05788 0.02894 0.02894 0.00000 0.00000
110 10D+1 0.04372 0.10532 0.04372 0.02207 0.05530
111 10D-1 0.04372 0.04372 0.10532 0.02207 -0.05530
112 10D+2 0.00000 0.05012 -0.05012 0.00000 -0.00081
113 10D-2 0.10532 0.04372 0.04372 0.02207 0.00000
114 11D 0 0.71421 -0.35710 -0.35710 0.00000 0.00000
115 11D+1 -0.52649 -1.33900 -0.52649 -0.20405 -0.37132
116 11D-1 -0.52649 -0.52649 -1.33900 -0.20405 0.37132
117 11D+2 0.00000 -0.61852 0.61852 0.00000 0.02965
118 11D-2 -1.33900 -0.52649 -0.52649 -0.20405 0.00000
119 12D 0 1.16181 -0.58090 -0.58090 0.00000 0.00000
120 12D+1 -0.77389 -2.45598 -0.77389 -0.68512 -0.16292
121 12D-1 -0.77389 -0.77389 -2.45598 -0.68512 0.16292
122 12D+2 0.00000 -1.00615 1.00615 0.00000 0.03339
123 12D-2 -2.45598 -0.77389 -0.77389 -0.68512 0.00000
124 13F 0 -0.01931 0.00351 0.00351 0.00852 0.00000
125 13F+1 0.01286 -0.01716 0.01182 -0.00522 -0.03527
126 13F-1 0.01286 0.01182 -0.01716 -0.00522 0.03527
127 13F+2 0.00000 -0.01898 0.01898 0.00000 -0.09593
128 13F-2 0.03423 0.03423 0.03423 0.00095 0.00000
129 13F+3 0.01440 -0.00885 -0.01526 0.00674 0.03953
130 13F-3 -0.01440 0.01526 0.00885 -0.00674 0.03953
131 14F 0 -0.17999 -0.20036 -0.20036 -0.19987 0.00000
132 14F+1 -0.36049 0.60588 0.11022 0.12239 0.26999
133 14F-1 -0.36049 0.11022 0.60588 0.12239 -0.26999
134 14F+2 0.00000 0.61118 -0.61118 0.00000 0.26594
135 14F-2 0.25805 0.25805 0.25805 0.20336 0.00000
136 14F+3 -0.53267 0.21587 -0.14229 -0.15801 -0.15665
137 14F-3 0.53267 0.14229 -0.21587 0.15801 -0.15665
138 15G 0 0.00357 0.00631 0.00631 0.00646 0.00000
139 15G+1 0.03126 0.00518 -0.00430 0.00422 -0.02639
140 15G-1 0.03126 -0.00430 0.00518 0.00422 0.02639
141 15G+2 0.00000 -0.00245 0.00245 0.00000 0.01086
142 15G-2 -0.01464 -0.03811 -0.03811 -0.01194 0.00000
143 15G+3 0.02893 0.01369 0.04237 0.01117 0.01722
144 15G-3 -0.02893 -0.04237 -0.01369 -0.01117 0.01722
145 15G+4 0.00672 0.00348 0.00348 0.00546 0.00000
146 15G-4 0.00000 -0.01901 0.01901 0.00000 -0.01521
147 3 H 1S 0.02183 -0.02183 -0.02183 0.09751 0.00000
148 2S 1.42132 -1.42132 -1.42132 1.80641 0.00000
149 3S -17.26512 17.26512 17.26512 -2.21694 0.00000
150 4S -7.75192 7.75192 7.75192 -2.22615 0.00000
151 5S 0.17134 -0.17134 -0.17134 0.01268 0.00000
152 6PX -0.07966 0.07966 -0.00535 -0.09292 0.00186
153 6PY -0.07966 -0.00535 0.07966 -0.09292 -0.00186
154 6PZ -0.00535 -0.07966 -0.07966 0.09292 0.00000
155 7PX 0.97286 -0.97286 -0.10562 0.90807 -0.07141
156 7PY 0.97286 -0.10562 -0.97286 0.90807 0.07141
157 7PZ -0.10562 0.97286 0.97286 -0.90807 0.00000
158 8PX -7.13491 7.13491 3.12449 -1.69439 -0.30249
159 8PY -7.13491 3.12449 7.13491 -1.69439 0.30249
160 8PZ 3.12449 -7.13491 -7.13491 1.69439 0.00000
161 9PX -2.88801 2.88801 1.61268 -0.70214 -0.03414
162 9PY -2.88801 1.61268 2.88801 -0.70214 0.03414
163 9PZ 1.61268 -2.88801 -2.88801 0.70214 0.00000
164 10D 0 -0.05788 -0.02894 -0.02894 0.00000 0.00000
165 10D+1 -0.04372 0.10532 0.04372 -0.02207 -0.05530
166 10D-1 -0.04372 0.04372 0.10532 -0.02207 0.05530
167 10D+2 0.00000 -0.05012 0.05012 0.00000 -0.00081
168 10D-2 0.10532 -0.04372 -0.04372 0.02207 0.00000
169 11D 0 0.71421 0.35710 0.35710 0.00000 0.00000
170 11D+1 0.52649 -1.33900 -0.52649 0.20405 0.37132
171 11D-1 0.52649 -0.52649 -1.33900 0.20405 -0.37132
172 11D+2 0.00000 0.61852 -0.61852 0.00000 0.02965
173 11D-2 -1.33900 0.52649 0.52649 -0.20405 0.00000
174 12D 0 1.16181 0.58090 0.58090 0.00000 0.00000
175 12D+1 0.77389 -2.45598 -0.77389 0.68512 0.16292
176 12D-1 0.77389 -0.77389 -2.45598 0.68512 -0.16292
177 12D+2 0.00000 1.00615 -1.00615 0.00000 0.03339
178 12D-2 -2.45598 0.77389 0.77389 -0.68512 0.00000
179 13F 0 -0.01931 -0.00351 -0.00351 0.00852 0.00000
180 13F+1 -0.01286 -0.01716 0.01182 0.00522 0.03527
181 13F-1 -0.01286 0.01182 -0.01716 0.00522 -0.03527
182 13F+2 0.00000 0.01898 -0.01898 0.00000 -0.09593
183 13F-2 0.03423 -0.03423 -0.03423 0.00095 0.00000
184 13F+3 -0.01440 -0.00885 -0.01526 -0.00674 -0.03953
185 13F-3 0.01440 0.01526 0.00885 0.00674 -0.03953
186 14F 0 -0.17999 0.20036 0.20036 -0.19987 0.00000
187 14F+1 0.36049 0.60588 0.11022 -0.12239 -0.26999
188 14F-1 0.36049 0.11022 0.60588 -0.12239 0.26999
189 14F+2 0.00000 -0.61118 0.61118 0.00000 0.26594
190 14F-2 0.25805 -0.25805 -0.25805 0.20336 0.00000
191 14F+3 0.53267 0.21587 -0.14229 0.15801 0.15665
192 14F-3 -0.53267 0.14229 -0.21587 -0.15801 0.15665
193 15G 0 0.00357 -0.00631 -0.00631 0.00646 0.00000
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195 15G-1 -0.03126 -0.00430 0.00518 -0.00422 -0.02639
196 15G+2 0.00000 0.00245 -0.00245 0.00000 0.01086
197 15G-2 -0.01464 0.03811 0.03811 -0.01194 0.00000
198 15G+3 -0.02893 0.01369 0.04237 -0.01117 -0.01722
199 15G-3 0.02893 -0.04237 -0.01369 0.01117 -0.01722
200 15G+4 0.00672 -0.00348 -0.00348 0.00546 0.00000
201 15G-4 0.00000 0.01901 -0.01901 0.00000 -0.01521
202 4 H 1S -0.02183 -0.02183 0.02183 0.09751 0.00000
203 2S -1.42132 -1.42132 1.42132 1.80641 0.00000
204 3S 17.26512 17.26512 -17.26512 -2.21694 0.00000
205 4S 7.75192 7.75192 -7.75192 -2.22615 0.00000
206 5S -0.17134 -0.17134 0.17134 0.01268 0.00000
207 6PX -0.07966 -0.07966 -0.00535 0.09292 0.00186
208 6PY 0.07966 -0.00535 -0.07966 -0.09292 0.00186
209 6PZ -0.00535 0.07966 -0.07966 -0.09292 0.00000
210 7PX 0.97286 0.97286 -0.10562 -0.90807 -0.07141
211 7PY -0.97286 -0.10562 0.97286 0.90807 -0.07141
212 7PZ -0.10562 -0.97286 0.97286 0.90807 0.00000
213 8PX -7.13491 -7.13491 3.12449 1.69439 -0.30249
214 8PY 7.13491 3.12449 -7.13491 -1.69439 -0.30249
215 8PZ 3.12449 7.13491 -7.13491 -1.69439 0.00000
216 9PX -2.88801 -2.88801 1.61268 0.70214 -0.03414
217 9PY 2.88801 1.61268 -2.88801 -0.70214 -0.03414
218 9PZ 1.61268 2.88801 -2.88801 -0.70214 0.00000
219 10D 0 0.05788 -0.02894 0.02894 0.00000 0.00000
220 10D+1 0.04372 0.10532 -0.04372 -0.02207 0.05530
221 10D-1 -0.04372 -0.04372 0.10532 0.02207 0.05530
222 10D+2 0.00000 -0.05012 -0.05012 0.00000 0.00081
223 10D-2 0.10532 0.04372 -0.04372 -0.02207 0.00000
224 11D 0 -0.71421 0.35710 -0.35710 0.00000 0.00000
225 11D+1 -0.52649 -1.33900 0.52649 0.20405 -0.37132
226 11D-1 0.52649 0.52649 -1.33900 -0.20405 -0.37132
227 11D+2 0.00000 0.61852 0.61852 0.00000 -0.02965
228 11D-2 -1.33900 -0.52649 0.52649 0.20405 0.00000
229 12D 0 -1.16181 0.58090 -0.58090 0.00000 0.00000
230 12D+1 -0.77389 -2.45598 0.77389 0.68512 -0.16292
231 12D-1 0.77389 0.77389 -2.45598 -0.68512 -0.16292
232 12D+2 0.00000 1.00615 1.00615 0.00000 -0.03339
233 12D-2 -2.45598 -0.77389 0.77389 0.68512 0.00000
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236 13F-1 0.01286 0.01182 0.01716 0.00522 0.03527
237 13F+2 0.00000 -0.01898 -0.01898 0.00000 -0.09593
238 13F-2 -0.03423 -0.03423 0.03423 0.00095 0.00000
239 13F+3 -0.01440 0.00885 -0.01526 0.00674 -0.03953
240 13F-3 -0.01440 0.01526 -0.00885 0.00674 0.03953
241 14F 0 -0.17999 -0.20036 0.20036 0.19987 0.00000
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243 14F-1 -0.36049 0.11022 -0.60588 -0.12239 -0.26999
244 14F+2 0.00000 0.61118 0.61118 0.00000 0.26594
245 14F-2 -0.25805 -0.25805 0.25805 0.20336 0.00000
246 14F+3 0.53267 -0.21587 -0.14229 -0.15801 0.15665
247 14F-3 0.53267 0.14229 0.21587 -0.15801 -0.15665
248 15G 0 -0.00357 -0.00631 0.00631 0.00646 0.00000
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250 15G-1 -0.03126 0.00430 0.00518 0.00422 -0.02639
251 15G+2 0.00000 0.00245 0.00245 0.00000 -0.01086
252 15G-2 -0.01464 -0.03811 0.03811 0.01194 0.00000
253 15G+3 0.02893 0.01369 -0.04237 -0.01117 0.01722
254 15G-3 0.02893 0.04237 -0.01369 -0.01117 -0.01722
255 15G+4 -0.00672 -0.00348 0.00348 0.00546 0.00000
256 15G-4 0.00000 -0.01901 -0.01901 0.00000 -0.01521
257 5 H 1S -0.02183 0.02183 -0.02183 0.09751 0.00000
258 2S -1.42132 1.42132 -1.42132 1.80641 0.00000
259 3S 17.26512 -17.26512 17.26512 -2.21694 0.00000
260 4S 7.75192 -7.75192 7.75192 -2.22615 0.00000
261 5S -0.17134 0.17134 -0.17134 0.01268 0.00000
262 6PX 0.07966 -0.07966 -0.00535 -0.09292 -0.00186
263 6PY -0.07966 -0.00535 -0.07966 0.09292 -0.00186
264 6PZ -0.00535 -0.07966 0.07966 -0.09292 0.00000
265 7PX -0.97286 0.97286 -0.10562 0.90807 0.07141
266 7PY 0.97286 -0.10562 0.97286 -0.90807 0.07141
267 7PZ -0.10562 0.97286 -0.97286 0.90807 0.00000
268 8PX 7.13491 -7.13491 3.12449 -1.69439 0.30249
269 8PY -7.13491 3.12449 -7.13491 1.69439 0.30249
270 8PZ 3.12449 -7.13491 7.13491 -1.69439 0.00000
271 9PX 2.88801 -2.88801 1.61268 -0.70214 0.03414
272 9PY -2.88801 1.61268 -2.88801 0.70214 0.03414
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279 11D 0 -0.71421 -0.35710 0.35710 0.00000 0.00000
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287 12D+2 0.00000 -1.00615 -1.00615 0.00000 -0.03339
288 12D-2 -2.45598 0.77389 -0.77389 0.68512 0.00000
289 13F 0 -0.01931 -0.00351 0.00351 -0.00852 0.00000
290 13F+1 0.01286 0.01716 0.01182 0.00522 -0.03527
291 13F-1 -0.01286 0.01182 0.01716 -0.00522 -0.03527
292 13F+2 0.00000 0.01898 0.01898 0.00000 -0.09593
293 13F-2 -0.03423 0.03423 -0.03423 0.00095 0.00000
294 13F+3 0.01440 0.00885 -0.01526 -0.00674 0.03953
295 13F-3 0.01440 0.01526 -0.00885 -0.00674 -0.03953
296 14F 0 -0.17999 0.20036 -0.20036 0.19987 0.00000
297 14F+1 -0.36049 -0.60588 0.11022 -0.12239 0.26999
298 14F-1 0.36049 0.11022 -0.60588 0.12239 0.26999
299 14F+2 0.00000 -0.61118 -0.61118 0.00000 0.26594
300 14F-2 -0.25805 0.25805 -0.25805 0.20336 0.00000
301 14F+3 -0.53267 -0.21587 -0.14229 0.15801 -0.15665
302 14F-3 -0.53267 0.14229 0.21587 0.15801 0.15665
303 15G 0 -0.00357 0.00631 -0.00631 0.00646 0.00000
304 15G+1 -0.03126 0.00518 0.00430 0.00422 0.02639
305 15G-1 0.03126 0.00430 0.00518 -0.00422 0.02639
306 15G+2 0.00000 -0.00245 -0.00245 0.00000 -0.01086
307 15G-2 -0.01464 0.03811 -0.03811 0.01194 0.00000
308 15G+3 -0.02893 0.01369 -0.04237 0.01117 -0.01722
309 15G-3 -0.02893 0.04237 -0.01369 0.01117 0.01722
310 15G+4 -0.00672 0.00348 -0.00348 0.00546 0.00000
311 15G-4 0.00000 0.01901 0.01901 0.00000 -0.01521
176 177 178 179 180
(T1)--V (T1)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 9.50030 9.50030 9.61573 9.61573 9.61573
1 1 C 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 0.00000 0.00000 -0.65861
8 7PY 0.00000 0.00000 0.00000 -0.65861 0.00000
9 7PZ 0.00000 0.00000 -0.65861 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 0.00000 0.52271
11 8PY 0.00000 0.00000 0.00000 0.52271 0.00000
12 8PZ 0.00000 0.00000 0.52271 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 4.35675
14 9PY 0.00000 0.00000 0.00000 4.35675 0.00000
15 9PZ 0.00000 0.00000 4.35675 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 3.20171
17 10PY 0.00000 0.00000 0.00000 3.20171 0.00000
18 10PZ 0.00000 0.00000 3.20171 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 -0.19034
20 11PY 0.00000 0.00000 0.00000 -0.19034 0.00000
21 11PZ 0.00000 0.00000 -0.19034 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 0.16544 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.16544
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.16544 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 0.07806 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.07806
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.07806 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 3.44174 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 3.44174
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 3.44174 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 0.76825 0.00000
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.76825
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.76825 0.00000 0.00000
42 16F 0 0.00000 0.00000 0.26004 0.00000 0.00000
43 16F+1 0.00000 0.15770 0.00000 0.00000 -0.15924
44 16F-1 0.15770 0.00000 0.00000 -0.15924 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 0.12215 0.00000 0.00000 0.20558
48 16F-3 -0.12215 0.00000 0.00000 -0.20558 0.00000
49 17F 0 0.00000 0.00000 -0.85256 0.00000 0.00000
50 17F+1 0.00000 0.12171 0.00000 0.00000 0.52208
51 17F-1 0.12171 0.00000 0.00000 0.52208 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 0.09428 0.00000 0.00000 -0.67400
55 17F-3 -0.09428 0.00000 0.00000 0.67400 0.00000
56 18F 0 0.00000 0.00000 -0.57778 0.00000 0.00000
57 18F+1 0.00000 0.14070 0.00000 0.00000 0.35382
58 18F-1 0.14070 0.00000 0.00000 0.35382 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 0.10899 0.00000 0.00000 -0.45678
62 18F-3 -0.10899 0.00000 0.00000 0.45678 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.10809 0.00000 0.00000 0.12584 0.00000
65 19G-1 0.00000 0.10809 0.00000 0.00000 0.12584
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 -0.35592 0.00000 0.00000
68 19G+3 -0.04085 0.00000 0.00000 0.33293 0.00000
69 19G-3 0.00000 0.04085 0.00000 0.00000 -0.33293
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 1.09344 0.00000 0.00000 -0.53493 0.00000
74 20G-1 0.00000 1.09344 0.00000 0.00000 -0.53493
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 1.51302 0.00000 0.00000
77 20G+3 -0.41328 0.00000 0.00000 -1.41530 0.00000
78 20G-3 0.00000 0.41328 0.00000 0.00000 1.41530
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 -0.54322 0.00000 0.00000
82 21H+1 0.00000 0.80188 0.00000 0.00000 -0.89587
83 21H-1 0.80188 0.00000 0.00000 -0.89587 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 -0.37120 0.00000 0.00000 -0.59484
87 21H-3 0.37120 0.00000 0.00000 0.59484 0.00000
88 21H+4 0.00000 0.00000 -1.10484 0.00000 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00000 -0.83003 0.00000 0.00000 -0.59947
91 21H-5 -0.83003 0.00000 0.00000 -0.59947 0.00000
92 2 H 1S 0.00000 0.00000 0.02148 0.02148 0.02148
93 2S 0.00000 0.00000 -0.94061 -0.94061 -0.94061
94 3S 0.00000 0.00000 -2.34058 -2.34058 -2.34058
95 4S 0.00000 0.00000 -1.99492 -1.99492 -1.99492
96 5S 0.00000 0.00000 0.18893 0.18893 0.18893
97 6PX -0.00186 0.00000 -0.03845 -0.03845 -0.02311
98 6PY 0.00000 -0.00186 -0.03845 -0.02311 -0.03845
99 6PZ 0.00186 0.00186 -0.02311 -0.03845 -0.03845
100 7PX 0.07141 0.00000 0.37589 0.37589 0.09278
101 7PY 0.00000 0.07141 0.37589 0.09278 0.37589
102 7PZ -0.07141 -0.07141 0.09278 0.37589 0.37589
103 8PX 0.30249 0.00000 0.61024 0.61024 0.61633
104 8PY 0.00000 0.30249 0.61024 0.61633 0.61024
105 8PZ -0.30249 -0.30249 0.61633 0.61024 0.61024
106 9PX 0.03414 0.00000 0.53194 0.53194 0.59846
107 9PY 0.00000 0.03414 0.53194 0.59846 0.53194
108 9PZ -0.03414 -0.03414 0.59846 0.53194 0.53194
109 10D 0 0.00070 0.00070 0.02173 -0.01086 -0.01086
110 10D+1 0.00000 -0.05530 -0.04319 -0.00578 -0.04319
111 10D-1 -0.05530 0.00000 -0.04319 -0.04319 -0.00578
112 10D+2 -0.00041 0.00041 0.00000 -0.01882 0.01882
113 10D-2 0.05530 0.05530 -0.00578 -0.04319 -0.04319
114 11D 0 -0.02568 -0.02568 0.02525 -0.01262 -0.01262
115 11D+1 0.00000 0.37132 -0.08061 -0.30453 -0.08061
116 11D-1 0.37132 0.00000 -0.08061 -0.08061 -0.30453
117 11D+2 0.01483 -0.01483 0.00000 -0.02186 0.02186
118 11D-2 -0.37132 -0.37132 -0.30453 -0.08061 -0.08061
119 12D 0 -0.02892 -0.02892 -0.07852 0.03926 0.03926
120 12D+1 0.00000 0.16292 -0.29584 -0.14936 -0.29584
121 12D-1 0.16292 0.00000 -0.29584 -0.29584 -0.14936
122 12D+2 0.01670 -0.01670 0.00000 0.06800 -0.06800
123 12D-2 -0.16292 -0.16292 -0.14936 -0.29584 -0.29584
124 13F 0 -0.05285 -0.05285 -0.04350 0.01911 0.01911
125 13F+1 -0.02946 0.07584 -0.00493 -0.01848 0.02664
126 13F-1 0.07584 -0.02946 -0.00493 0.02664 -0.01848
127 13F+2 -0.00368 0.00368 0.00000 -0.00857 0.00857
128 13F-2 0.00000 0.00000 -0.02484 -0.02484 -0.02484
129 13F+3 0.04403 0.05875 0.02036 0.00986 -0.03439
130 13F-3 -0.05875 -0.04403 -0.02036 0.03439 -0.00986
131 14F 0 0.28918 0.28918 -0.04959 -0.17812 -0.17812
132 14F+1 0.08418 -0.21025 0.10263 0.11553 0.03037
133 14F-1 -0.21025 0.08418 0.10263 0.03037 0.11553
134 14F+2 0.11752 -0.11752 0.00000 0.00816 -0.00816
135 14F-2 0.00000 0.00000 0.23458 0.23458 0.23458
136 14F+3 -0.30058 -0.16286 -0.14582 -0.13583 -0.03921
137 14F-3 0.16286 0.30058 0.14582 0.03921 0.13583
138 15G 0 0.00607 0.00607 -0.00569 0.00154 0.00154
139 15G+1 0.01423 -0.03118 -0.01525 0.00480 -0.00632
140 15G-1 -0.03118 0.01423 -0.01525 -0.00632 0.00480
141 15G+2 0.00543 -0.00543 0.00000 -0.00647 0.00647
142 15G-2 -0.00678 -0.00678 -0.01357 0.03049 0.03049
143 15G+3 -0.00538 0.00453 -0.02684 0.01269 -0.03021
144 15G-3 -0.00453 0.00538 0.02684 0.03021 -0.01269
145 15G+4 -0.00718 -0.00718 0.00497 -0.00359 -0.00359
146 15G-4 0.03077 -0.03077 0.00000 0.00477 -0.00477
147 3 H 1S 0.00000 0.00000 0.02148 -0.02148 -0.02148
148 2S 0.00000 0.00000 -0.94061 0.94061 0.94061
149 3S 0.00000 0.00000 -2.34058 2.34058 2.34058
150 4S 0.00000 0.00000 -1.99492 1.99492 1.99492
151 5S 0.00000 0.00000 0.18893 -0.18893 -0.18893
152 6PX -0.00186 0.00000 0.03845 -0.03845 -0.02311
153 6PY 0.00000 -0.00186 0.03845 -0.02311 -0.03845
154 6PZ -0.00186 -0.00186 -0.02311 0.03845 0.03845
155 7PX 0.07141 0.00000 -0.37589 0.37589 0.09278
156 7PY 0.00000 0.07141 -0.37589 0.09278 0.37589
157 7PZ 0.07141 0.07141 0.09278 -0.37589 -0.37589
158 8PX 0.30249 0.00000 -0.61024 0.61024 0.61633
159 8PY 0.00000 0.30249 -0.61024 0.61633 0.61024
160 8PZ 0.30249 0.30249 0.61633 -0.61024 -0.61024
161 9PX 0.03414 0.00000 -0.53194 0.53194 0.59846
162 9PY 0.00000 0.03414 -0.53194 0.59846 0.53194
163 9PZ 0.03414 0.03414 0.59846 -0.53194 -0.53194
164 10D 0 -0.00070 -0.00070 0.02173 0.01086 0.01086
165 10D+1 0.00000 -0.05530 0.04319 -0.00578 -0.04319
166 10D-1 -0.05530 0.00000 0.04319 -0.04319 -0.00578
167 10D+2 0.00041 -0.00041 0.00000 0.01882 -0.01882
168 10D-2 -0.05530 -0.05530 -0.00578 0.04319 0.04319
169 11D 0 0.02568 0.02568 0.02525 0.01262 0.01262
170 11D+1 0.00000 0.37132 0.08061 -0.30453 -0.08061
171 11D-1 0.37132 0.00000 0.08061 -0.08061 -0.30453
172 11D+2 -0.01483 0.01483 0.00000 0.02186 -0.02186
173 11D-2 0.37132 0.37132 -0.30453 0.08061 0.08061
174 12D 0 0.02892 0.02892 -0.07852 -0.03926 -0.03926
175 12D+1 0.00000 0.16292 0.29584 -0.14936 -0.29584
176 12D-1 0.16292 0.00000 0.29584 -0.29584 -0.14936
177 12D+2 -0.01670 0.01670 0.00000 -0.06800 0.06800
178 12D-2 0.16292 0.16292 -0.14936 0.29584 0.29584
179 13F 0 0.05285 0.05285 -0.04350 -0.01911 -0.01911
180 13F+1 -0.02946 0.07584 0.00493 -0.01848 0.02664
181 13F-1 0.07584 -0.02946 0.00493 0.02664 -0.01848
182 13F+2 0.00368 -0.00368 0.00000 0.00857 -0.00857
183 13F-2 0.00000 0.00000 -0.02484 0.02484 0.02484
184 13F+3 0.04403 0.05875 -0.02036 0.00986 -0.03439
185 13F-3 -0.05875 -0.04403 0.02036 0.03439 -0.00986
186 14F 0 -0.28918 -0.28918 -0.04959 0.17812 0.17812
187 14F+1 0.08418 -0.21025 -0.10263 0.11553 0.03037
188 14F-1 -0.21025 0.08418 -0.10263 0.03037 0.11553
189 14F+2 -0.11752 0.11752 0.00000 -0.00816 0.00816
190 14F-2 0.00000 0.00000 0.23458 -0.23458 -0.23458
191 14F+3 -0.30058 -0.16286 0.14582 -0.13583 -0.03921
192 14F-3 0.16286 0.30058 -0.14582 0.03921 0.13583
193 15G 0 -0.00607 -0.00607 -0.00569 -0.00154 -0.00154
194 15G+1 0.01423 -0.03118 0.01525 0.00480 -0.00632
195 15G-1 -0.03118 0.01423 0.01525 -0.00632 0.00480
196 15G+2 -0.00543 0.00543 0.00000 0.00647 -0.00647
197 15G-2 0.00678 0.00678 -0.01357 -0.03049 -0.03049
198 15G+3 -0.00538 0.00453 0.02684 0.01269 -0.03021
199 15G-3 -0.00453 0.00538 -0.02684 0.03021 -0.01269
200 15G+4 0.00718 0.00718 0.00497 0.00359 0.00359
201 15G-4 -0.03077 0.03077 0.00000 -0.00477 0.00477
202 4 H 1S 0.00000 0.00000 -0.02148 -0.02148 0.02148
203 2S 0.00000 0.00000 0.94061 0.94061 -0.94061
204 3S 0.00000 0.00000 2.34058 2.34058 -2.34058
205 4S 0.00000 0.00000 1.99492 1.99492 -1.99492
206 5S 0.00000 0.00000 -0.18893 -0.18893 0.18893
207 6PX 0.00186 0.00000 0.03845 0.03845 -0.02311
208 6PY 0.00000 0.00186 -0.03845 -0.02311 0.03845
209 6PZ 0.00186 -0.00186 -0.02311 -0.03845 0.03845
210 7PX -0.07141 0.00000 -0.37589 -0.37589 0.09278
211 7PY 0.00000 -0.07141 0.37589 0.09278 -0.37589
212 7PZ -0.07141 0.07141 0.09278 0.37589 -0.37589
213 8PX -0.30249 0.00000 -0.61024 -0.61024 0.61633
214 8PY 0.00000 -0.30249 0.61024 0.61633 -0.61024
215 8PZ -0.30249 0.30249 0.61633 0.61024 -0.61024
216 9PX -0.03414 0.00000 -0.53194 -0.53194 0.59846
217 9PY 0.00000 -0.03414 0.53194 0.59846 -0.53194
218 9PZ -0.03414 0.03414 0.59846 0.53194 -0.53194
219 10D 0 -0.00070 0.00070 -0.02173 0.01086 -0.01086
220 10D+1 0.00000 0.05530 -0.04319 -0.00578 0.04319
221 10D-1 0.05530 0.00000 0.04319 0.04319 -0.00578
222 10D+2 0.00041 0.00041 0.00000 0.01882 0.01882
223 10D-2 0.05530 -0.05530 -0.00578 -0.04319 0.04319
224 11D 0 0.02568 -0.02568 -0.02525 0.01262 -0.01262
225 11D+1 0.00000 -0.37132 -0.08061 -0.30453 0.08061
226 11D-1 -0.37132 0.00000 0.08061 0.08061 -0.30453
227 11D+2 -0.01483 -0.01483 0.00000 0.02186 0.02186
228 11D-2 -0.37132 0.37132 -0.30453 -0.08061 0.08061
229 12D 0 0.02892 -0.02892 0.07852 -0.03926 0.03926
230 12D+1 0.00000 -0.16292 -0.29584 -0.14936 0.29584
231 12D-1 -0.16292 0.00000 0.29584 0.29584 -0.14936
232 12D+2 -0.01670 -0.01670 0.00000 -0.06800 -0.06800
233 12D-2 -0.16292 0.16292 -0.14936 -0.29584 0.29584
234 13F 0 -0.05285 0.05285 -0.04350 0.01911 -0.01911
235 13F+1 0.02946 0.07584 0.00493 0.01848 0.02664
236 13F-1 0.07584 0.02946 -0.00493 0.02664 0.01848
237 13F+2 -0.00368 -0.00368 0.00000 -0.00857 -0.00857
238 13F-2 0.00000 0.00000 0.02484 0.02484 -0.02484
239 13F+3 -0.04403 0.05875 -0.02036 -0.00986 -0.03439
240 13F-3 -0.05875 0.04403 -0.02036 0.03439 0.00986
241 14F 0 0.28918 -0.28918 -0.04959 -0.17812 0.17812
242 14F+1 -0.08418 -0.21025 -0.10263 -0.11553 0.03037
243 14F-1 -0.21025 -0.08418 0.10263 0.03037 -0.11553
244 14F+2 0.11752 0.11752 0.00000 0.00816 0.00816
245 14F-2 0.00000 0.00000 -0.23458 -0.23458 0.23458
246 14F+3 0.30058 -0.16286 0.14582 0.13583 -0.03921
247 14F-3 0.16286 -0.30058 0.14582 0.03921 -0.13583
248 15G 0 -0.00607 0.00607 0.00569 -0.00154 0.00154
249 15G+1 0.01423 0.03118 -0.01525 0.00480 0.00632
250 15G-1 0.03118 0.01423 0.01525 0.00632 0.00480
251 15G+2 -0.00543 -0.00543 0.00000 0.00647 0.00647
252 15G-2 -0.00678 0.00678 -0.01357 0.03049 -0.03049
253 15G+3 -0.00538 -0.00453 -0.02684 0.01269 0.03021
254 15G-3 0.00453 0.00538 -0.02684 -0.03021 -0.01269
255 15G+4 0.00718 -0.00718 -0.00497 0.00359 -0.00359
256 15G-4 0.03077 0.03077 0.00000 0.00477 0.00477
257 5 H 1S 0.00000 0.00000 -0.02148 0.02148 -0.02148
258 2S 0.00000 0.00000 0.94061 -0.94061 0.94061
259 3S 0.00000 0.00000 2.34058 -2.34058 2.34058
260 4S 0.00000 0.00000 1.99492 -1.99492 1.99492
261 5S 0.00000 0.00000 -0.18893 0.18893 -0.18893
262 6PX 0.00186 0.00000 -0.03845 0.03845 -0.02311
263 6PY 0.00000 0.00186 0.03845 -0.02311 0.03845
264 6PZ -0.00186 0.00186 -0.02311 0.03845 -0.03845
265 7PX -0.07141 0.00000 0.37589 -0.37589 0.09278
266 7PY 0.00000 -0.07141 -0.37589 0.09278 -0.37589
267 7PZ 0.07141 -0.07141 0.09278 -0.37589 0.37589
268 8PX -0.30249 0.00000 0.61024 -0.61024 0.61633
269 8PY 0.00000 -0.30249 -0.61024 0.61633 -0.61024
270 8PZ 0.30249 -0.30249 0.61633 -0.61024 0.61024
271 9PX -0.03414 0.00000 0.53194 -0.53194 0.59846
272 9PY 0.00000 -0.03414 -0.53194 0.59846 -0.53194
273 9PZ 0.03414 -0.03414 0.59846 -0.53194 0.53194
274 10D 0 0.00070 -0.00070 -0.02173 -0.01086 0.01086
275 10D+1 0.00000 0.05530 0.04319 -0.00578 0.04319
276 10D-1 0.05530 0.00000 -0.04319 0.04319 -0.00578
277 10D+2 -0.00041 -0.00041 0.00000 -0.01882 -0.01882
278 10D-2 -0.05530 0.05530 -0.00578 0.04319 -0.04319
279 11D 0 -0.02568 0.02568 -0.02525 -0.01262 0.01262
280 11D+1 0.00000 -0.37132 0.08061 -0.30453 0.08061
281 11D-1 -0.37132 0.00000 -0.08061 0.08061 -0.30453
282 11D+2 0.01483 0.01483 0.00000 -0.02186 -0.02186
283 11D-2 0.37132 -0.37132 -0.30453 0.08061 -0.08061
284 12D 0 -0.02892 0.02892 0.07852 0.03926 -0.03926
285 12D+1 0.00000 -0.16292 0.29584 -0.14936 0.29584
286 12D-1 -0.16292 0.00000 -0.29584 0.29584 -0.14936
287 12D+2 0.01670 0.01670 0.00000 0.06800 0.06800
288 12D-2 0.16292 -0.16292 -0.14936 0.29584 -0.29584
289 13F 0 0.05285 -0.05285 -0.04350 -0.01911 0.01911
290 13F+1 0.02946 0.07584 -0.00493 0.01848 0.02664
291 13F-1 0.07584 0.02946 0.00493 0.02664 0.01848
292 13F+2 0.00368 0.00368 0.00000 0.00857 0.00857
293 13F-2 0.00000 0.00000 0.02484 -0.02484 0.02484
294 13F+3 -0.04403 0.05875 0.02036 -0.00986 -0.03439
295 13F-3 -0.05875 0.04403 0.02036 0.03439 0.00986
296 14F 0 -0.28918 0.28918 -0.04959 0.17812 -0.17812
297 14F+1 -0.08418 -0.21025 0.10263 -0.11553 0.03037
298 14F-1 -0.21025 -0.08418 -0.10263 0.03037 -0.11553
299 14F+2 -0.11752 -0.11752 0.00000 -0.00816 -0.00816
300 14F-2 0.00000 0.00000 -0.23458 0.23458 -0.23458
301 14F+3 0.30058 -0.16286 -0.14582 0.13583 -0.03921
302 14F-3 0.16286 -0.30058 -0.14582 0.03921 -0.13583
303 15G 0 0.00607 -0.00607 0.00569 0.00154 -0.00154
304 15G+1 0.01423 0.03118 0.01525 0.00480 0.00632
305 15G-1 0.03118 0.01423 -0.01525 0.00632 0.00480
306 15G+2 0.00543 0.00543 0.00000 -0.00647 -0.00647
307 15G-2 0.00678 -0.00678 -0.01357 -0.03049 0.03049
308 15G+3 -0.00538 -0.00453 0.02684 0.01269 0.03021
309 15G-3 0.00453 0.00538 0.02684 -0.03021 -0.01269
310 15G+4 -0.00718 0.00718 -0.00497 -0.00359 0.00359
311 15G-4 -0.03077 -0.03077 0.00000 -0.00477 -0.00477
181 182 183 184 185
(T2)--V (T2)--V (T2)--V (A1)--V (E)--V
Eigenvalues -- 9.84851 9.84851 9.84851 9.88007 9.95222
1 1 C 1S 0.00000 0.00000 0.00000 0.02842 0.00000
2 2S 0.00000 0.00000 0.00000 -1.99493 0.00000
3 3S 0.00000 0.00000 0.00000 -10.33645 0.00000
4 4S 0.00000 0.00000 0.00000 14.38259 0.00000
5 5S 0.00000 0.00000 0.00000 54.90426 0.00000
6 6S 0.00000 0.00000 0.00000 10.75906 0.00000
7 7PX 0.00000 0.00000 0.19083 0.00000 0.00000
8 7PY 0.19083 0.00000 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.19083 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 -2.06414 0.00000 0.00000
11 8PY -2.06414 0.00000 0.00000 0.00000 0.00000
12 8PZ 0.00000 -2.06414 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 17.43692 0.00000 0.00000
14 9PY 17.43692 0.00000 0.00000 0.00000 0.00000
15 9PZ 0.00000 17.43692 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 6.01239 0.00000 0.00000
17 10PY 6.01239 0.00000 0.00000 0.00000 0.00000
18 10PZ 0.00000 6.01239 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.28613 0.00000 0.00000
20 11PY 0.28613 0.00000 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.28613 0.00000 0.00000 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.06775
23 12D+1 -0.17783 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 -0.17783 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.22300
26 12D-2 0.00000 -0.17783 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.11383
28 13D+1 0.73458 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.73458 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 -0.37471
31 13D-2 0.00000 0.73458 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 -2.20112
33 14D+1 0.25235 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.25235 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 7.24552
36 14D-2 0.00000 0.25235 0.00000 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 -0.09901
38 15D+1 0.87172 0.00000 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.87172 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.32593
41 15D-2 0.00000 0.87172 0.00000 0.00000 0.00000
42 16F 0 0.00000 0.11333 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 -0.06940 0.00000 0.00000
44 16F-1 -0.06940 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 -0.58370 0.00000
47 16F+3 0.00000 0.00000 0.08960 0.00000 0.00000
48 16F-3 -0.08960 0.00000 0.00000 0.00000 0.00000
49 17F 0 0.00000 0.29401 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 -0.18005 0.00000 0.00000
51 17F-1 -0.18005 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 4.63426 0.00000
54 17F+3 0.00000 0.00000 0.23244 0.00000 0.00000
55 17F-3 -0.23244 0.00000 0.00000 0.00000 0.00000
56 18F 0 0.00000 0.05828 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 -0.03569 0.00000 0.00000
58 18F-1 -0.03569 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 3.10970 0.00000
61 18F+3 0.00000 0.00000 0.04608 0.00000 0.00000
62 18F-3 -0.04608 0.00000 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.09798 -0.01549
64 19G+1 0.08892 0.00000 0.00000 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.08892 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 -0.07897
67 19G-2 0.00000 -0.25151 0.00000 0.00000 0.00000
68 19G+3 0.23527 0.00000 0.00000 0.00000 0.00000
69 19G-3 0.00000 0.00000 -0.23527 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 0.08281 0.01832
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 -0.93507 0.39774
73 20G+1 -0.96772 0.00000 0.00000 0.00000 0.00000
74 20G-1 0.00000 0.00000 -0.96772 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 2.02832
76 20G-2 0.00000 2.73711 0.00000 0.00000 0.00000
77 20G+3 -2.56034 0.00000 0.00000 0.00000 0.00000
78 20G-3 0.00000 0.00000 2.56034 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 -0.79028 -0.47062
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 -1.32113 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 -0.17259 0.00000 0.00000
83 21H-1 -0.17259 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 -0.54363
86 21H+3 0.00000 0.00000 1.33937 0.00000 0.00000
87 21H-3 -1.33937 0.00000 0.00000 0.00000 0.00000
88 21H+4 0.00000 0.81526 0.00000 0.00000 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000 1.78948
90 21H+5 0.00000 0.00000 -0.76572 0.00000 0.00000
91 21H-5 -0.76572 0.00000 0.00000 0.00000 0.00000
92 2 H 1S -0.00212 -0.00212 -0.00212 -0.09789 0.00000
93 2S 0.41159 0.41159 0.41159 1.21961 0.00000
94 3S -5.86063 -5.86063 -5.86063 -14.31387 0.00000
95 4S -3.84920 -3.84920 -3.84920 -8.20054 0.00000
96 5S 0.05051 0.05051 0.05051 -0.39744 0.00000
97 6PX 0.01266 0.01266 0.06559 -0.00359 0.05772
98 6PY 0.06559 0.01266 0.01266 -0.00359 -0.04050
99 6PZ 0.01266 0.06559 0.01266 -0.00359 -0.01723
100 7PX -0.20902 -0.20902 -0.45907 -0.14497 -0.22514
101 7PY -0.45907 -0.20902 -0.20902 -0.14497 0.15795
102 7PZ -0.20902 -0.45907 -0.20902 -0.14497 0.06719
103 8PX 3.02942 3.02942 -0.01071 4.27996 -2.05888
104 8PY -0.01071 3.02942 3.02942 4.27996 1.44442
105 8PZ 3.02942 -0.01071 3.02942 4.27996 0.61446
106 9PX 1.50159 1.50159 0.57486 2.61690 -0.43147
107 9PY 0.57486 1.50159 1.50159 2.61690 0.30270
108 9PZ 1.50159 0.57486 1.50159 2.61690 0.12877
109 10D 0 0.04708 -0.09416 0.04708 0.00000 0.03562
110 10D+1 0.02528 -0.02083 -0.02083 0.03987 -0.06413
111 10D-1 -0.02083 -0.02083 0.02528 0.03987 0.09141
112 10D+2 0.08155 0.00000 -0.08155 0.00000 -0.11727
113 10D-2 -0.02083 0.02528 -0.02083 0.03987 -0.02728
114 11D 0 -0.49285 0.98570 -0.49285 0.00000 -0.32436
115 11D+1 -0.61802 0.02132 0.02132 -0.83223 0.33529
116 11D-1 0.02132 0.02132 -0.61802 -0.83223 -0.47792
117 11D+2 -0.85364 0.00000 0.85364 0.00000 1.06771
118 11D-2 0.02132 -0.61802 0.02132 -0.83223 0.14263
119 12D 0 -0.51031 1.02061 -0.51031 0.00000 -0.26955
120 12D+1 -1.06724 -0.44310 -0.44310 -1.18536 0.28508
121 12D-1 -0.44310 -0.44310 -1.06724 -1.18536 -0.40635
122 12D+2 -0.88388 0.00000 0.88388 0.00000 0.88730
123 12D-2 -0.44310 -1.06724 -0.44310 -1.18536 0.12127
124 13F 0 -0.02471 -0.05766 -0.02471 -0.01910 0.01129
125 13F+1 0.05964 -0.02938 0.03531 0.01170 0.01190
126 13F-1 0.03531 -0.02938 0.05964 0.01170 0.02005
127 13F+2 0.05630 0.00000 -0.05630 0.00000 -0.06019
128 13F-2 -0.04685 -0.04685 -0.04685 0.03805 0.00000
129 13F+3 0.01494 -0.05401 -0.04558 -0.01510 -0.03865
130 13F-3 0.04558 0.05401 -0.01494 0.01510 -0.04912
131 14F 0 0.07825 -0.38662 0.07825 -0.25760 0.06858
132 14F+1 0.13146 -0.22729 0.23676 0.15775 0.09319
133 14F-1 0.23676 -0.22729 0.13146 0.15775 0.05438
134 14F+2 0.22689 0.00000 -0.22689 0.00000 -0.25379
135 14F-2 0.18714 0.18714 0.18714 0.50209 0.00000
136 14F+3 0.20080 -0.07708 -0.30565 -0.20365 -0.21849
137 14F-3 0.30565 0.07708 -0.20080 0.20365 -0.24605
138 15G 0 0.05575 0.04363 0.05575 0.03095 0.00920
139 15G+1 -0.02974 0.05539 -0.03974 0.01857 -0.02172
140 15G-1 -0.03974 0.05539 -0.02974 0.01857 -0.02045
141 15G+2 -0.01084 0.00000 0.01084 0.00000 0.04692
142 15G-2 -0.02213 0.08412 -0.02213 -0.05252 -0.02935
143 15G+3 -0.07869 0.00273 0.03868 0.04913 0.08196
144 15G-3 -0.03868 -0.00273 0.07869 -0.04913 0.09740
145 15G+4 0.03892 0.05326 0.03892 0.02616 -0.01089
146 15G-4 -0.05085 0.00000 0.05085 0.00000 0.06460
147 3 H 1S 0.00212 -0.00212 0.00212 -0.09789 0.00000
148 2S -0.41159 0.41159 -0.41159 1.21961 0.00000
149 3S 5.86063 -5.86063 5.86063 -14.31387 0.00000
150 4S 3.84920 -3.84920 3.84920 -8.20054 0.00000
151 5S -0.05051 0.05051 -0.05051 -0.39744 0.00000
152 6PX 0.01266 -0.01266 0.06559 0.00359 -0.05772
153 6PY 0.06559 -0.01266 0.01266 0.00359 0.04050
154 6PZ -0.01266 0.06559 -0.01266 -0.00359 -0.01723
155 7PX -0.20902 0.20902 -0.45907 0.14497 0.22514
156 7PY -0.45907 0.20902 -0.20902 0.14497 -0.15795
157 7PZ 0.20902 -0.45907 0.20902 -0.14497 0.06719
158 8PX 3.02942 -3.02942 -0.01071 -4.27996 2.05888
159 8PY -0.01071 -3.02942 3.02942 -4.27996 -1.44442
160 8PZ -3.02942 -0.01071 -3.02942 4.27996 0.61446
161 9PX 1.50159 -1.50159 0.57486 -2.61690 0.43147
162 9PY 0.57486 -1.50159 1.50159 -2.61690 -0.30270
163 9PZ -1.50159 0.57486 -1.50159 2.61690 0.12877
164 10D 0 -0.04708 -0.09416 -0.04708 0.00000 0.03562
165 10D+1 0.02528 0.02083 -0.02083 -0.03987 0.06413
166 10D-1 -0.02083 0.02083 0.02528 -0.03987 -0.09141
167 10D+2 -0.08155 0.00000 0.08155 0.00000 -0.11727
168 10D-2 0.02083 0.02528 0.02083 0.03987 -0.02728
169 11D 0 0.49285 0.98570 0.49285 0.00000 -0.32436
170 11D+1 -0.61802 -0.02132 0.02132 0.83223 -0.33529
171 11D-1 0.02132 -0.02132 -0.61802 0.83223 0.47792
172 11D+2 0.85364 0.00000 -0.85364 0.00000 1.06771
173 11D-2 -0.02132 -0.61802 -0.02132 -0.83223 0.14263
174 12D 0 0.51031 1.02061 0.51031 0.00000 -0.26955
175 12D+1 -1.06724 0.44310 -0.44310 1.18536 -0.28508
176 12D-1 -0.44310 0.44310 -1.06724 1.18536 0.40635
177 12D+2 0.88388 0.00000 -0.88388 0.00000 0.88730
178 12D-2 0.44310 -1.06724 0.44310 -1.18536 0.12127
179 13F 0 0.02471 -0.05766 0.02471 -0.01910 0.01129
180 13F+1 0.05964 0.02938 0.03531 -0.01170 -0.01190
181 13F-1 0.03531 0.02938 0.05964 -0.01170 -0.02005
182 13F+2 -0.05630 0.00000 0.05630 0.00000 -0.06019
183 13F-2 0.04685 -0.04685 0.04685 0.03805 0.00000
184 13F+3 0.01494 0.05401 -0.04558 0.01510 0.03865
185 13F-3 0.04558 -0.05401 -0.01494 -0.01510 0.04912
186 14F 0 -0.07825 -0.38662 -0.07825 -0.25760 0.06858
187 14F+1 0.13146 0.22729 0.23676 -0.15775 -0.09319
188 14F-1 0.23676 0.22729 0.13146 -0.15775 -0.05438
189 14F+2 -0.22689 0.00000 0.22689 0.00000 -0.25379
190 14F-2 -0.18714 0.18714 -0.18714 0.50209 0.00000
191 14F+3 0.20080 0.07708 -0.30565 0.20365 0.21849
192 14F-3 0.30565 -0.07708 -0.20080 -0.20365 0.24605
193 15G 0 -0.05575 0.04363 -0.05575 0.03095 0.00920
194 15G+1 -0.02974 -0.05539 -0.03974 -0.01857 0.02172
195 15G-1 -0.03974 -0.05539 -0.02974 -0.01857 0.02045
196 15G+2 0.01084 0.00000 -0.01084 0.00000 0.04692
197 15G-2 0.02213 0.08412 0.02213 -0.05252 -0.02935
198 15G+3 -0.07869 -0.00273 0.03868 -0.04913 -0.08196
199 15G-3 -0.03868 0.00273 0.07869 0.04913 -0.09740
200 15G+4 -0.03892 0.05326 -0.03892 0.02616 -0.01089
201 15G-4 0.05085 0.00000 -0.05085 0.00000 0.06460
202 4 H 1S 0.00212 0.00212 -0.00212 -0.09789 0.00000
203 2S -0.41159 -0.41159 0.41159 1.21961 0.00000
204 3S 5.86063 5.86063 -5.86063 -14.31387 0.00000
205 4S 3.84920 3.84920 -3.84920 -8.20054 0.00000
206 5S -0.05051 -0.05051 0.05051 -0.39744 0.00000
207 6PX -0.01266 -0.01266 0.06559 -0.00359 0.05772
208 6PY 0.06559 0.01266 -0.01266 0.00359 0.04050
209 6PZ 0.01266 0.06559 -0.01266 0.00359 0.01723
210 7PX 0.20902 0.20902 -0.45907 -0.14497 -0.22514
211 7PY -0.45907 -0.20902 0.20902 0.14497 -0.15795
212 7PZ -0.20902 -0.45907 0.20902 0.14497 -0.06719
213 8PX -3.02942 -3.02942 -0.01071 4.27996 -2.05888
214 8PY -0.01071 3.02942 -3.02942 -4.27996 -1.44442
215 8PZ 3.02942 -0.01071 -3.02942 -4.27996 -0.61446
216 9PX -1.50159 -1.50159 0.57486 2.61690 -0.43147
217 9PY 0.57486 1.50159 -1.50159 -2.61690 -0.30270
218 9PZ 1.50159 0.57486 -1.50159 -2.61690 -0.12877
219 10D 0 -0.04708 0.09416 0.04708 0.00000 0.03562
220 10D+1 0.02528 -0.02083 0.02083 -0.03987 0.06413
221 10D-1 0.02083 0.02083 0.02528 0.03987 0.09141
222 10D+2 -0.08155 0.00000 -0.08155 0.00000 -0.11727
223 10D-2 -0.02083 0.02528 0.02083 -0.03987 0.02728
224 11D 0 0.49285 -0.98570 -0.49285 0.00000 -0.32436
225 11D+1 -0.61802 0.02132 -0.02132 0.83223 -0.33529
226 11D-1 -0.02132 -0.02132 -0.61802 -0.83223 -0.47792
227 11D+2 0.85364 0.00000 0.85364 0.00000 1.06771
228 11D-2 0.02132 -0.61802 -0.02132 0.83223 -0.14263
229 12D 0 0.51031 -1.02061 -0.51031 0.00000 -0.26955
230 12D+1 -1.06724 -0.44310 0.44310 1.18536 -0.28508
231 12D-1 0.44310 0.44310 -1.06724 -1.18536 -0.40635
232 12D+2 0.88388 0.00000 0.88388 0.00000 0.88730
233 12D-2 -0.44310 -1.06724 0.44310 1.18536 -0.12127
234 13F 0 -0.02471 -0.05766 0.02471 0.01910 -0.01129
235 13F+1 -0.05964 0.02938 0.03531 0.01170 0.01190
236 13F-1 0.03531 -0.02938 -0.05964 -0.01170 -0.02005
237 13F+2 0.05630 0.00000 0.05630 0.00000 0.06019
238 13F-2 0.04685 0.04685 -0.04685 0.03805 0.00000
239 13F+3 -0.01494 0.05401 -0.04558 -0.01510 -0.03865
240 13F-3 0.04558 0.05401 0.01494 -0.01510 0.04912
241 14F 0 0.07825 -0.38662 -0.07825 0.25760 -0.06858
242 14F+1 -0.13146 0.22729 0.23676 0.15775 0.09319
243 14F-1 0.23676 -0.22729 -0.13146 -0.15775 -0.05438
244 14F+2 0.22689 0.00000 0.22689 0.00000 0.25379
245 14F-2 -0.18714 -0.18714 0.18714 0.50209 0.00000
246 14F+3 -0.20080 0.07708 -0.30565 -0.20365 -0.21849
247 14F-3 0.30565 0.07708 0.20080 -0.20365 0.24605
248 15G 0 -0.05575 -0.04363 0.05575 0.03095 0.00920
249 15G+1 -0.02974 0.05539 0.03974 -0.01857 0.02172
250 15G-1 0.03974 -0.05539 -0.02974 0.01857 -0.02045
251 15G+2 0.01084 0.00000 0.01084 0.00000 0.04692
252 15G-2 -0.02213 0.08412 0.02213 0.05252 0.02935
253 15G+3 -0.07869 0.00273 -0.03868 -0.04913 -0.08196
254 15G-3 0.03868 0.00273 0.07869 -0.04913 0.09740
255 15G+4 -0.03892 -0.05326 0.03892 0.02616 -0.01089
256 15G-4 -0.05085 0.00000 -0.05085 0.00000 -0.06460
257 5 H 1S -0.00212 0.00212 0.00212 -0.09789 0.00000
258 2S 0.41159 -0.41159 -0.41159 1.21961 0.00000
259 3S -5.86063 5.86063 5.86063 -14.31387 0.00000
260 4S -3.84920 3.84920 3.84920 -8.20054 0.00000
261 5S 0.05051 -0.05051 -0.05051 -0.39744 0.00000
262 6PX -0.01266 0.01266 0.06559 0.00359 -0.05772
263 6PY 0.06559 -0.01266 -0.01266 -0.00359 -0.04050
264 6PZ -0.01266 0.06559 0.01266 0.00359 0.01723
265 7PX 0.20902 -0.20902 -0.45907 0.14497 0.22514
266 7PY -0.45907 0.20902 0.20902 -0.14497 0.15795
267 7PZ 0.20902 -0.45907 -0.20902 0.14497 -0.06719
268 8PX -3.02942 3.02942 -0.01071 -4.27996 2.05888
269 8PY -0.01071 -3.02942 -3.02942 4.27996 1.44442
270 8PZ -3.02942 -0.01071 3.02942 -4.27996 -0.61446
271 9PX -1.50159 1.50159 0.57486 -2.61690 0.43147
272 9PY 0.57486 -1.50159 -1.50159 2.61690 0.30270
273 9PZ -1.50159 0.57486 1.50159 -2.61690 -0.12877
274 10D 0 0.04708 0.09416 -0.04708 0.00000 0.03562
275 10D+1 0.02528 0.02083 0.02083 0.03987 -0.06413
276 10D-1 0.02083 -0.02083 0.02528 -0.03987 -0.09141
277 10D+2 0.08155 0.00000 0.08155 0.00000 -0.11727
278 10D-2 0.02083 0.02528 -0.02083 -0.03987 0.02728
279 11D 0 -0.49285 -0.98570 0.49285 0.00000 -0.32436
280 11D+1 -0.61802 -0.02132 -0.02132 -0.83223 0.33529
281 11D-1 -0.02132 0.02132 -0.61802 0.83223 0.47792
282 11D+2 -0.85364 0.00000 -0.85364 0.00000 1.06771
283 11D-2 -0.02132 -0.61802 0.02132 0.83223 -0.14263
284 12D 0 -0.51031 -1.02061 0.51031 0.00000 -0.26955
285 12D+1 -1.06724 0.44310 0.44310 -1.18536 0.28508
286 12D-1 0.44310 -0.44310 -1.06724 1.18536 0.40635
287 12D+2 -0.88388 0.00000 -0.88388 0.00000 0.88730
288 12D-2 0.44310 -1.06724 -0.44310 1.18536 -0.12127
289 13F 0 0.02471 -0.05766 -0.02471 0.01910 -0.01129
290 13F+1 -0.05964 -0.02938 0.03531 -0.01170 -0.01190
291 13F-1 0.03531 0.02938 -0.05964 0.01170 0.02005
292 13F+2 -0.05630 0.00000 -0.05630 0.00000 0.06019
293 13F-2 -0.04685 0.04685 0.04685 0.03805 0.00000
294 13F+3 -0.01494 -0.05401 -0.04558 0.01510 0.03865
295 13F-3 0.04558 -0.05401 0.01494 0.01510 -0.04912
296 14F 0 -0.07825 -0.38662 0.07825 0.25760 -0.06858
297 14F+1 -0.13146 -0.22729 0.23676 -0.15775 -0.09319
298 14F-1 0.23676 0.22729 -0.13146 0.15775 0.05438
299 14F+2 -0.22689 0.00000 -0.22689 0.00000 0.25379
300 14F-2 0.18714 -0.18714 -0.18714 0.50209 0.00000
301 14F+3 -0.20080 -0.07708 -0.30565 0.20365 0.21849
302 14F-3 0.30565 -0.07708 0.20080 0.20365 -0.24605
303 15G 0 0.05575 -0.04363 -0.05575 0.03095 0.00920
304 15G+1 -0.02974 -0.05539 0.03974 0.01857 -0.02172
305 15G-1 0.03974 0.05539 -0.02974 -0.01857 0.02045
306 15G+2 -0.01084 0.00000 -0.01084 0.00000 0.04692
307 15G-2 0.02213 0.08412 -0.02213 0.05252 0.02935
308 15G+3 -0.07869 -0.00273 -0.03868 0.04913 0.08196
309 15G-3 0.03868 -0.00273 0.07869 0.04913 -0.09740
310 15G+4 0.03892 -0.05326 -0.03892 0.02616 -0.01089
311 15G-4 0.05085 0.00000 0.05085 0.00000 -0.06460
186 187 188 189 190
(E)--V (E)--V (E)--V (T2)--V (T2)--V
Eigenvalues -- 9.95222 10.30004 10.30004 10.47501 10.47501
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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 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 -0.67050 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.67050
10 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
11 8PY 0.00000 0.00000 0.00000 0.78467 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.78467
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
14 9PY 0.00000 0.00000 0.00000 12.24578 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 12.24578
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
17 10PY 0.00000 0.00000 0.00000 5.55700 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 5.55700
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
20 11PY 0.00000 0.00000 0.00000 0.27683 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.27683
22 12D 0 0.22300 0.15440 0.09253 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.10920 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
25 12D+2 0.06775 -0.09253 0.15440 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.10920
27 13D 0 -0.37471 -0.14403 -0.08632 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 0.55050 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
30 13D+2 -0.11383 0.08632 -0.14403 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.55050
32 14D 0 7.24552 3.78968 2.27124 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 6.77605 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
35 14D+2 2.20112 -2.27124 3.78968 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 6.77605
37 15D 0 0.32593 1.78509 1.06984 0.00000 0.00000
38 15D+1 0.00000 0.00000 0.00000 1.89561 0.00000
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
40 15D+2 0.09901 -1.06984 1.78509 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 0.00000 1.89561
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.98200
43 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F-1 0.00000 0.00000 0.00000 -0.60135 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 -0.77634 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 -2.15530
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.00000 1.31985 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 1.70392 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 -1.08311
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.00000 0.00000 0.66327 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 0.85627 0.00000
63 19G 0 0.05098 -0.61859 -0.37074 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 -0.22100 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00000 0.00000
66 19G+2 -0.02399 -0.57434 0.95832 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.62509
68 19G+3 0.00000 0.00000 0.00000 -0.58472 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00000
70 19G+4 -0.06032 0.73193 0.43866 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 -1.30927 0.78178 0.46854 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.00000 0.11413 0.00000
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.00000
75 20G+2 0.61618 0.72586 -1.21113 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.00000 -0.32280
77 20G+3 0.00000 0.00000 0.00000 0.30195 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
79 20G+4 1.54915 -0.92502 -0.55438 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 0.17965
82 21H+1 0.00000 0.00000 0.00000 0.00000 0.00000
83 21H-1 0.00000 0.00000 0.00000 0.24591 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 21H-2 1.78948 0.18116 0.10857 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 -0.12677 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.27746
89 21H-4 0.54363 -0.10857 0.18116 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 0.18087 0.00000
92 2 H 1S 0.00000 0.00000 0.00000 -0.08899 -0.08899
93 2S 0.00000 0.00000 0.00000 1.02570 1.02570
94 3S 0.00000 0.00000 0.00000 -8.18467 -8.18467
95 4S 0.00000 0.00000 0.00000 -4.32713 -4.32713
96 5S 0.00000 0.00000 0.00000 -0.02867 -0.02867
97 6PX -0.01343 0.00643 -0.00357 0.01414 0.01414
98 6PY -0.04327 -0.00012 0.00735 -0.01036 0.01414
99 6PZ 0.05671 -0.00631 -0.00378 0.01414 -0.01036
100 7PX 0.05240 -0.24905 0.13842 -0.22647 -0.22647
101 7PY 0.16878 0.00465 -0.28489 -0.18527 -0.22647
102 7PZ -0.22118 0.24440 0.14647 -0.22647 -0.18527
103 8PX 0.47918 0.85300 -0.47409 2.39558 2.39558
104 8PY 1.54345 -0.01593 0.97576 2.91387 2.39558
105 8PZ -2.02263 -0.83707 -0.50167 2.39558 2.91387
106 9PX 0.10042 0.92714 -0.51529 1.38759 1.38759
107 9PY 0.32345 -0.01731 1.06057 1.54831 1.38759
108 9PZ -0.42387 -0.90982 -0.54528 1.38759 1.54831
109 10D 0 -0.11727 -0.06417 -0.03846 0.02349 -0.04699
110 10D+1 -0.06853 -0.00001 0.00051 0.04601 0.02111
111 10D-1 -0.02127 0.00044 -0.00025 0.02111 0.02111
112 10D+2 -0.03562 0.03846 -0.06417 0.04069 0.00000
113 10D-2 0.08980 -0.00043 -0.00026 0.02111 0.04601
114 11D 0 1.06771 0.10896 0.06530 -0.03104 0.06208
115 11D+1 0.35828 -0.00373 0.22841 -0.30675 -0.39876
116 11D-1 0.11123 0.19968 -0.11098 -0.39876 -0.39876
117 11D+2 0.32436 -0.06530 0.10896 -0.05376 0.00000
118 11D-2 -0.46951 -0.19595 -0.11744 -0.39876 -0.30675
119 12D 0 0.88730 0.43581 0.26119 0.02712 -0.05424
120 12D+1 0.30462 -0.01368 0.83808 -0.60677 -0.80486
121 12D-1 0.09457 0.73264 -0.40719 -0.80486 -0.80486
122 12D+2 0.26955 -0.26119 0.43581 0.04698 0.00000
123 12D-2 -0.39920 -0.71896 -0.43089 -0.80486 -0.60677
124 13F 0 -0.03718 0.11564 0.06931 -0.02321 0.09356
125 13F+1 -0.05383 0.08184 -0.02270 -0.06245 0.09088
126 13F-1 -0.05135 0.01856 0.08287 -0.05729 0.09088
127 13F+2 -0.01829 -0.01295 0.02161 -0.09698 0.00000
128 13F-2 0.00000 0.00000 0.00000 0.00256 0.00256
129 13F+3 -0.03056 -0.08567 0.06526 -0.07774 0.04104
130 13F-3 0.00389 -0.01716 0.10632 -0.07396 -0.04104
131 14F 0 -0.22575 0.07594 0.04551 0.00305 -0.26249
132 14F+1 -0.23698 -0.10864 -0.30707 0.03949 -0.04323
133 14F-1 -0.24877 -0.32202 0.04897 0.16074 -0.04323
134 14F+2 -0.07710 0.20885 -0.34847 0.05231 0.00000
135 14F-2 0.00000 0.00000 0.00000 0.24205 0.24205
136 14F+3 -0.11591 -0.18204 -0.18345 0.03445 -0.02962
137 14F-3 -0.02521 0.24761 0.07404 0.20752 0.02962
138 15G 0 -0.03029 -0.03957 -0.02371 -0.00402 0.03429
139 15G+1 0.06922 -0.06499 0.00985 0.01555 -0.05399
140 15G-1 0.06960 -0.02195 -0.06196 0.03115 -0.05399
141 15G+2 0.01425 -0.03674 0.06130 0.03427 0.00000
142 15G-2 0.09660 0.02648 0.01587 0.03230 -0.04398
143 15G+3 0.05265 0.02402 0.02927 0.04114 -0.01413
144 15G-3 0.00184 -0.03714 -0.00739 0.04631 0.01413
145 15G+4 0.03584 0.04682 0.02806 0.02250 -0.02283
146 15G-4 0.01963 0.03562 -0.05944 0.04551 0.00000
147 3 H 1S 0.00000 0.00000 0.00000 0.08899 -0.08899
148 2S 0.00000 0.00000 0.00000 -1.02570 1.02570
149 3S 0.00000 0.00000 0.00000 8.18467 -8.18467
150 4S 0.00000 0.00000 0.00000 4.32713 -4.32713
151 5S 0.00000 0.00000 0.00000 0.02867 -0.02867
152 6PX 0.01343 -0.00643 0.00357 0.01414 -0.01414
153 6PY 0.04327 0.00012 -0.00735 -0.01036 -0.01414
154 6PZ 0.05671 -0.00631 -0.00378 -0.01414 -0.01036
155 7PX -0.05240 0.24905 -0.13842 -0.22647 0.22647
156 7PY -0.16878 -0.00465 0.28489 -0.18527 0.22647
157 7PZ -0.22118 0.24440 0.14647 0.22647 -0.18527
158 8PX -0.47918 -0.85300 0.47409 2.39558 -2.39558
159 8PY -1.54345 0.01593 -0.97576 2.91387 -2.39558
160 8PZ -2.02263 -0.83707 -0.50167 -2.39558 2.91387
161 9PX -0.10042 -0.92714 0.51529 1.38759 -1.38759
162 9PY -0.32345 0.01731 -1.06057 1.54831 -1.38759
163 9PZ -0.42387 -0.90982 -0.54528 -1.38759 1.54831
164 10D 0 -0.11727 -0.06417 -0.03846 -0.02349 -0.04699
165 10D+1 0.06853 0.00001 -0.00051 0.04601 -0.02111
166 10D-1 0.02127 -0.00044 0.00025 0.02111 -0.02111
167 10D+2 -0.03562 0.03846 -0.06417 -0.04069 0.00000
168 10D-2 0.08980 -0.00043 -0.00026 -0.02111 0.04601
169 11D 0 1.06771 0.10896 0.06530 0.03104 0.06208
170 11D+1 -0.35828 0.00373 -0.22841 -0.30675 0.39876
171 11D-1 -0.11123 -0.19968 0.11098 -0.39876 0.39876
172 11D+2 0.32436 -0.06530 0.10896 0.05376 0.00000
173 11D-2 -0.46951 -0.19595 -0.11744 0.39876 -0.30675
174 12D 0 0.88730 0.43581 0.26119 -0.02712 -0.05424
175 12D+1 -0.30462 0.01368 -0.83808 -0.60677 0.80486
176 12D-1 -0.09457 -0.73264 0.40719 -0.80486 0.80486
177 12D+2 0.26955 -0.26119 0.43581 -0.04698 0.00000
178 12D-2 -0.39920 -0.71896 -0.43089 0.80486 -0.60677
179 13F 0 -0.03718 0.11564 0.06931 0.02321 0.09356
180 13F+1 0.05383 -0.08184 0.02270 -0.06245 -0.09088
181 13F-1 0.05135 -0.01856 -0.08287 -0.05729 -0.09088
182 13F+2 -0.01829 -0.01295 0.02161 0.09698 0.00000
183 13F-2 0.00000 0.00000 0.00000 -0.00256 0.00256
184 13F+3 0.03056 0.08567 -0.06526 -0.07774 -0.04104
185 13F-3 -0.00389 0.01716 -0.10632 -0.07396 0.04104
186 14F 0 -0.22575 0.07594 0.04551 -0.00305 -0.26249
187 14F+1 0.23698 0.10864 0.30707 0.03949 0.04323
188 14F-1 0.24877 0.32202 -0.04897 0.16074 0.04323
189 14F+2 -0.07710 0.20885 -0.34847 -0.05231 0.00000
190 14F-2 0.00000 0.00000 0.00000 -0.24205 0.24205
191 14F+3 0.11591 0.18204 0.18345 0.03445 0.02962
192 14F-3 0.02521 -0.24761 -0.07404 0.20752 -0.02962
193 15G 0 -0.03029 -0.03957 -0.02371 0.00402 0.03429
194 15G+1 -0.06922 0.06499 -0.00985 0.01555 0.05399
195 15G-1 -0.06960 0.02195 0.06196 0.03115 0.05399
196 15G+2 0.01425 -0.03674 0.06130 -0.03427 0.00000
197 15G-2 0.09660 0.02648 0.01587 -0.03230 -0.04398
198 15G+3 -0.05265 -0.02402 -0.02927 0.04114 0.01413
199 15G-3 -0.00184 0.03714 0.00739 0.04631 -0.01413
200 15G+4 0.03584 0.04682 0.02806 -0.02250 -0.02283
201 15G-4 0.01963 0.03562 -0.05944 -0.04551 0.00000
202 4 H 1S 0.00000 0.00000 0.00000 0.08899 0.08899
203 2S 0.00000 0.00000 0.00000 -1.02570 -1.02570
204 3S 0.00000 0.00000 0.00000 8.18467 8.18467
205 4S 0.00000 0.00000 0.00000 4.32713 4.32713
206 5S 0.00000 0.00000 0.00000 0.02867 0.02867
207 6PX -0.01343 0.00643 -0.00357 -0.01414 -0.01414
208 6PY 0.04327 0.00012 -0.00735 -0.01036 0.01414
209 6PZ -0.05671 0.00631 0.00378 0.01414 -0.01036
210 7PX 0.05240 -0.24905 0.13842 0.22647 0.22647
211 7PY -0.16878 -0.00465 0.28489 -0.18527 -0.22647
212 7PZ 0.22118 -0.24440 -0.14647 -0.22647 -0.18527
213 8PX 0.47918 0.85300 -0.47409 -2.39558 -2.39558
214 8PY -1.54345 0.01593 -0.97576 2.91387 2.39558
215 8PZ 2.02263 0.83707 0.50167 2.39558 2.91387
216 9PX 0.10042 0.92714 -0.51529 -1.38759 -1.38759
217 9PY -0.32345 0.01731 -1.06057 1.54831 1.38759
218 9PZ 0.42387 0.90982 0.54528 1.38759 1.54831
219 10D 0 -0.11727 -0.06417 -0.03846 -0.02349 0.04699
220 10D+1 0.06853 0.00001 -0.00051 0.04601 0.02111
221 10D-1 -0.02127 0.00044 -0.00025 -0.02111 -0.02111
222 10D+2 -0.03562 0.03846 -0.06417 -0.04069 0.00000
223 10D-2 -0.08980 0.00043 0.00026 0.02111 0.04601
224 11D 0 1.06771 0.10896 0.06530 0.03104 -0.06208
225 11D+1 -0.35828 0.00373 -0.22841 -0.30675 -0.39876
226 11D-1 0.11123 0.19968 -0.11098 0.39876 0.39876
227 11D+2 0.32436 -0.06530 0.10896 0.05376 0.00000
228 11D-2 0.46951 0.19595 0.11744 -0.39876 -0.30675
229 12D 0 0.88730 0.43581 0.26119 -0.02712 0.05424
230 12D+1 -0.30462 0.01368 -0.83808 -0.60677 -0.80486
231 12D-1 0.09457 0.73264 -0.40719 0.80486 0.80486
232 12D+2 0.26955 -0.26119 0.43581 -0.04698 0.00000
233 12D-2 0.39920 0.71896 0.43089 -0.80486 -0.60677
234 13F 0 0.03718 -0.11564 -0.06931 -0.02321 0.09356
235 13F+1 -0.05383 0.08184 -0.02270 0.06245 -0.09088
236 13F-1 0.05135 -0.01856 -0.08287 -0.05729 0.09088
237 13F+2 0.01829 0.01295 -0.02161 -0.09698 0.00000
238 13F-2 0.00000 0.00000 0.00000 -0.00256 -0.00256
239 13F+3 -0.03056 -0.08567 0.06526 0.07774 -0.04104
240 13F-3 -0.00389 0.01716 -0.10632 -0.07396 -0.04104
241 14F 0 0.22575 -0.07594 -0.04551 0.00305 -0.26249
242 14F+1 -0.23698 -0.10864 -0.30707 -0.03949 0.04323
243 14F-1 0.24877 0.32202 -0.04897 0.16074 -0.04323
244 14F+2 0.07710 -0.20885 0.34847 0.05231 0.00000
245 14F-2 0.00000 0.00000 0.00000 -0.24205 -0.24205
246 14F+3 -0.11591 -0.18204 -0.18345 -0.03445 0.02962
247 14F-3 0.02521 -0.24761 -0.07404 0.20752 0.02962
248 15G 0 -0.03029 -0.03957 -0.02371 0.00402 -0.03429
249 15G+1 -0.06922 0.06499 -0.00985 0.01555 -0.05399
250 15G-1 0.06960 -0.02195 -0.06196 -0.03115 0.05399
251 15G+2 0.01425 -0.03674 0.06130 -0.03427 0.00000
252 15G-2 -0.09660 -0.02648 -0.01587 0.03230 -0.04398
253 15G+3 -0.05265 -0.02402 -0.02927 0.04114 -0.01413
254 15G-3 0.00184 -0.03714 -0.00739 -0.04631 -0.01413
255 15G+4 0.03584 0.04682 0.02806 -0.02250 0.02283
256 15G-4 -0.01963 -0.03562 0.05944 0.04551 0.00000
257 5 H 1S 0.00000 0.00000 0.00000 -0.08899 0.08899
258 2S 0.00000 0.00000 0.00000 1.02570 -1.02570
259 3S 0.00000 0.00000 0.00000 -8.18467 8.18467
260 4S 0.00000 0.00000 0.00000 -4.32713 4.32713
261 5S 0.00000 0.00000 0.00000 -0.02867 0.02867
262 6PX 0.01343 -0.00643 0.00357 -0.01414 0.01414
263 6PY -0.04327 -0.00012 0.00735 -0.01036 -0.01414
264 6PZ -0.05671 0.00631 0.00378 -0.01414 -0.01036
265 7PX -0.05240 0.24905 -0.13842 0.22647 -0.22647
266 7PY 0.16878 0.00465 -0.28489 -0.18527 0.22647
267 7PZ 0.22118 -0.24440 -0.14647 0.22647 -0.18527
268 8PX -0.47918 -0.85300 0.47409 -2.39558 2.39558
269 8PY 1.54345 -0.01593 0.97576 2.91387 -2.39558
270 8PZ 2.02263 0.83707 0.50167 -2.39558 2.91387
271 9PX -0.10042 -0.92714 0.51529 -1.38759 1.38759
272 9PY 0.32345 -0.01731 1.06057 1.54831 -1.38759
273 9PZ 0.42387 0.90982 0.54528 -1.38759 1.54831
274 10D 0 -0.11727 -0.06417 -0.03846 0.02349 0.04699
275 10D+1 -0.06853 -0.00001 0.00051 0.04601 -0.02111
276 10D-1 0.02127 -0.00044 0.00025 -0.02111 0.02111
277 10D+2 -0.03562 0.03846 -0.06417 0.04069 0.00000
278 10D-2 -0.08980 0.00043 0.00026 -0.02111 0.04601
279 11D 0 1.06771 0.10896 0.06530 -0.03104 -0.06208
280 11D+1 0.35828 -0.00373 0.22841 -0.30675 0.39876
281 11D-1 -0.11123 -0.19968 0.11098 0.39876 -0.39876
282 11D+2 0.32436 -0.06530 0.10896 -0.05376 0.00000
283 11D-2 0.46951 0.19595 0.11744 0.39876 -0.30675
284 12D 0 0.88730 0.43581 0.26119 0.02712 0.05424
285 12D+1 0.30462 -0.01368 0.83808 -0.60677 0.80486
286 12D-1 -0.09457 -0.73264 0.40719 0.80486 -0.80486
287 12D+2 0.26955 -0.26119 0.43581 0.04698 0.00000
288 12D-2 0.39920 0.71896 0.43089 0.80486 -0.60677
289 13F 0 0.03718 -0.11564 -0.06931 0.02321 0.09356
290 13F+1 0.05383 -0.08184 0.02270 0.06245 0.09088
291 13F-1 -0.05135 0.01856 0.08287 -0.05729 -0.09088
292 13F+2 0.01829 0.01295 -0.02161 0.09698 0.00000
293 13F-2 0.00000 0.00000 0.00000 0.00256 -0.00256
294 13F+3 0.03056 0.08567 -0.06526 0.07774 0.04104
295 13F-3 0.00389 -0.01716 0.10632 -0.07396 0.04104
296 14F 0 0.22575 -0.07594 -0.04551 -0.00305 -0.26249
297 14F+1 0.23698 0.10864 0.30707 -0.03949 -0.04323
298 14F-1 -0.24877 -0.32202 0.04897 0.16074 0.04323
299 14F+2 0.07710 -0.20885 0.34847 -0.05231 0.00000
300 14F-2 0.00000 0.00000 0.00000 0.24205 -0.24205
301 14F+3 0.11591 0.18204 0.18345 -0.03445 -0.02962
302 14F-3 -0.02521 0.24761 0.07404 0.20752 -0.02962
303 15G 0 -0.03029 -0.03957 -0.02371 -0.00402 -0.03429
304 15G+1 0.06922 -0.06499 0.00985 0.01555 0.05399
305 15G-1 -0.06960 0.02195 0.06196 -0.03115 -0.05399
306 15G+2 0.01425 -0.03674 0.06130 0.03427 0.00000
307 15G-2 -0.09660 -0.02648 -0.01587 -0.03230 -0.04398
308 15G+3 0.05265 0.02402 0.02927 0.04114 0.01413
309 15G-3 -0.00184 0.03714 0.00739 -0.04631 0.01413
310 15G+4 0.03584 0.04682 0.02806 0.02250 0.02283
311 15G-4 -0.01963 -0.03562 0.05944 -0.04551 0.00000
191 192 193 194 195
(T2)--V (T1)--V (T1)--V (T1)--V (A1)--V
Eigenvalues -- 10.47501 10.47831 10.47831 10.47831 10.86685
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2 2S 0.00000 0.00000 0.00000 0.00000 -0.61358
3 3S 0.00000 0.00000 0.00000 0.00000 -3.23718
4 4S 0.00000 0.00000 0.00000 0.00000 4.63161
5 5S 0.00000 0.00000 0.00000 0.00000 7.57549
6 6S 0.00000 0.00000 0.00000 0.00000 0.45515
7 7PX -0.67050 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 0.78467 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 12.24578 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 5.55700 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 0.27683 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 0.10920 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 0.55050 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 6.77605 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 1.89561 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 -0.60135 -0.58407 0.00000 0.00000 0.00000
44 16F-1 0.00000 0.00000 -0.58407 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.00000 -0.73880 0.00000
46 16F-2 0.00000 0.00000 0.00000 0.00000 -0.23087
47 16F+3 0.77634 -0.45242 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.00000 0.45242 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 1.31985 1.28361 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.00000 1.28361 0.00000 0.00000
52 17F+2 0.00000 0.00000 0.00000 1.62366 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 1.58054
54 17F+3 -1.70392 0.99428 0.00000 0.00000 0.00000
55 17F-3 0.00000 0.00000 -0.99428 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.66327 1.43586 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.00000 1.43586 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.00000 1.81624 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 -0.22224
61 18F+3 -0.85627 1.11221 0.00000 0.00000 0.00000
62 18F-3 0.00000 0.00000 -1.11221 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 -0.95043
64 19G+1 0.00000 0.00000 -0.88286 0.00000 0.00000
65 19G-1 -0.22100 -0.88286 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 0.33369 0.00000 0.00000
69 19G-3 0.58472 -0.33369 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 0.00000 -0.80326
71 19G-4 0.00000 0.00000 0.00000 -0.94381 0.00000
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.49860
73 20G+1 0.00000 0.00000 1.99872 0.00000 0.00000
74 20G-1 0.11413 1.99872 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 -0.75544 0.00000 0.00000
78 20G-3 -0.30195 0.75544 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.42139
80 20G-4 0.00000 0.00000 0.00000 2.13672 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.24591 0.31014 0.00000 0.00000 0.00000
83 21H-1 0.00000 0.00000 0.31014 0.00000 0.00000
84 21H+2 0.00000 0.00000 0.00000 -0.46889 0.00000
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.12677 -0.14357 0.00000 0.00000 0.00000
87 21H-3 0.00000 0.00000 0.14357 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 0.18087 -0.32103 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.00000 -0.32103 0.00000 0.00000
92 2 H 1S -0.08899 0.00000 0.00000 0.00000 -0.18874
93 2S 1.02570 0.00000 0.00000 0.00000 0.55430
94 3S -8.18467 0.00000 0.00000 0.00000 -2.76990
95 4S -4.32713 0.00000 0.00000 0.00000 -0.64051
96 5S -0.02867 0.00000 0.00000 0.00000 -0.03395
97 6PX -0.01036 0.00000 -0.00828 0.00828 -0.04897
98 6PY 0.01414 -0.00828 0.00000 -0.00828 -0.04897
99 6PZ 0.01414 0.00828 0.00828 0.00000 -0.04897
100 7PX -0.18527 0.00000 0.00776 -0.00776 0.19962
101 7PY -0.22647 0.00776 0.00000 0.00776 0.19962
102 7PZ -0.22647 -0.00776 -0.00776 0.00000 0.19962
103 8PX 2.91387 0.00000 1.14171 -1.14171 0.82156
104 8PY 2.39558 1.14171 0.00000 1.14171 0.82156
105 8PZ 2.39558 -1.14171 -1.14171 0.00000 0.82156
106 9PX 1.54831 0.00000 0.33758 -0.33758 0.32237
107 9PY 1.38759 0.33758 0.00000 0.33758 0.32237
108 9PZ 1.38759 -0.33758 -0.33758 0.00000 0.32237
109 10D 0 0.02349 0.03500 0.03500 0.00000 0.00000
110 10D+1 0.02111 0.02010 0.00000 0.02010 0.09692
111 10D-1 0.04601 0.00000 0.02010 -0.02010 0.09692
112 10D+2 -0.04069 0.02021 -0.02021 0.04042 0.00000
113 10D-2 0.02111 -0.02010 -0.02010 0.00000 0.09692
114 11D 0 -0.03104 0.11656 0.11656 0.00000 0.00000
115 11D+1 -0.39876 0.29182 0.00000 0.29182 -0.37235
116 11D-1 -0.30675 0.00000 0.29182 -0.29182 -0.37235
117 11D+2 0.05376 0.06730 -0.06730 0.13460 0.00000
118 11D-2 -0.39876 -0.29182 -0.29182 0.00000 -0.37235
119 12D 0 0.02712 0.37916 0.37916 0.00000 0.00000
120 12D+1 -0.80486 0.26410 0.00000 0.26410 -0.06214
121 12D-1 -0.60677 0.00000 0.26410 -0.26410 -0.06214
122 12D+2 -0.04698 0.21891 -0.21891 0.43782 0.00000
123 12D-2 -0.80486 -0.26410 -0.26410 0.00000 -0.06214
124 13F 0 -0.02321 -0.04563 -0.04563 0.00000 -0.01460
125 13F+1 -0.05729 -0.08338 -0.09376 -0.03787 0.00894
126 13F-1 -0.06245 -0.09376 -0.08338 0.03787 0.00894
127 13F+2 0.09698 -0.08325 0.08325 -0.10547 0.00000
128 13F-2 0.00256 0.00000 0.00000 0.00000 -0.03077
129 13F+3 0.07396 -0.06459 -0.01490 -0.08705 -0.01154
130 13F-3 0.07774 0.01490 0.06459 -0.08705 0.01154
131 14F 0 0.00305 0.13471 0.13471 0.00000 -0.05735
132 14F+1 0.16074 -0.02862 0.03611 -0.12887 0.03512
133 14F-1 0.03949 0.03611 -0.02862 0.12887 0.03512
134 14F+2 -0.05231 -0.05867 0.05867 -0.03620 0.00000
135 14F-2 0.24205 0.00000 0.00000 0.00000 0.00540
136 14F+3 -0.20752 -0.02217 -0.14242 0.07057 -0.04534
137 14F-3 -0.03445 0.14242 0.02217 0.07057 0.04534
138 15G 0 -0.00402 -0.06071 -0.06071 0.00000 0.04451
139 15G+1 0.03115 0.01411 0.04540 0.01742 0.00701
140 15G-1 0.01555 0.04540 0.01411 -0.01742 0.00701
141 15G+2 -0.03427 0.05430 -0.05430 0.10860 0.00000
142 15G-2 0.03230 0.04459 0.04459 0.00000 -0.01982
143 15G+3 -0.04631 0.04234 -0.01716 0.04109 0.01854
144 15G-3 -0.04114 0.01716 -0.04234 0.04109 -0.01854
145 15G+4 0.02250 0.07183 0.07183 0.00000 0.03761
146 15G-4 -0.04551 -0.00177 0.00177 0.04853 0.00000
147 3 H 1S 0.08899 0.00000 0.00000 0.00000 -0.18874
148 2S -1.02570 0.00000 0.00000 0.00000 0.55430
149 3S 8.18467 0.00000 0.00000 0.00000 -2.76990
150 4S 4.32713 0.00000 0.00000 0.00000 -0.64051
151 5S 0.02867 0.00000 0.00000 0.00000 -0.03395
152 6PX -0.01036 0.00000 -0.00828 -0.00828 0.04897
153 6PY 0.01414 -0.00828 0.00000 0.00828 0.04897
154 6PZ -0.01414 -0.00828 -0.00828 0.00000 -0.04897
155 7PX -0.18527 0.00000 0.00776 0.00776 -0.19962
156 7PY -0.22647 0.00776 0.00000 -0.00776 -0.19962
157 7PZ 0.22647 0.00776 0.00776 0.00000 0.19962
158 8PX 2.91387 0.00000 1.14171 1.14171 -0.82156
159 8PY 2.39558 1.14171 0.00000 -1.14171 -0.82156
160 8PZ -2.39558 1.14171 1.14171 0.00000 0.82156
161 9PX 1.54831 0.00000 0.33758 0.33758 -0.32237
162 9PY 1.38759 0.33758 0.00000 -0.33758 -0.32237
163 9PZ -1.38759 0.33758 0.33758 0.00000 0.32237
164 10D 0 -0.02349 -0.03500 -0.03500 0.00000 0.00000
165 10D+1 0.02111 0.02010 0.00000 -0.02010 -0.09692
166 10D-1 0.04601 0.00000 0.02010 0.02010 -0.09692
167 10D+2 0.04069 -0.02021 0.02021 0.04042 0.00000
168 10D-2 -0.02111 0.02010 0.02010 0.00000 0.09692
169 11D 0 0.03104 -0.11656 -0.11656 0.00000 0.00000
170 11D+1 -0.39876 0.29182 0.00000 -0.29182 0.37235
171 11D-1 -0.30675 0.00000 0.29182 0.29182 0.37235
172 11D+2 -0.05376 -0.06730 0.06730 0.13460 0.00000
173 11D-2 0.39876 0.29182 0.29182 0.00000 -0.37235
174 12D 0 -0.02712 -0.37916 -0.37916 0.00000 0.00000
175 12D+1 -0.80486 0.26410 0.00000 -0.26410 0.06214
176 12D-1 -0.60677 0.00000 0.26410 0.26410 0.06214
177 12D+2 0.04698 -0.21891 0.21891 0.43782 0.00000
178 12D-2 0.80486 0.26410 0.26410 0.00000 -0.06214
179 13F 0 0.02321 0.04563 0.04563 0.00000 -0.01460
180 13F+1 -0.05729 -0.08338 -0.09376 0.03787 -0.00894
181 13F-1 -0.06245 -0.09376 -0.08338 -0.03787 -0.00894
182 13F+2 -0.09698 0.08325 -0.08325 -0.10547 0.00000
183 13F-2 -0.00256 0.00000 0.00000 0.00000 -0.03077
184 13F+3 0.07396 -0.06459 -0.01490 0.08705 0.01154
185 13F-3 0.07774 0.01490 0.06459 0.08705 -0.01154
186 14F 0 -0.00305 -0.13471 -0.13471 0.00000 -0.05735
187 14F+1 0.16074 -0.02862 0.03611 0.12887 -0.03512
188 14F-1 0.03949 0.03611 -0.02862 -0.12887 -0.03512
189 14F+2 0.05231 0.05867 -0.05867 -0.03620 0.00000
190 14F-2 -0.24205 0.00000 0.00000 0.00000 0.00540
191 14F+3 -0.20752 -0.02217 -0.14242 -0.07057 0.04534
192 14F-3 -0.03445 0.14242 0.02217 -0.07057 -0.04534
193 15G 0 0.00402 0.06071 0.06071 0.00000 0.04451
194 15G+1 0.03115 0.01411 0.04540 -0.01742 -0.00701
195 15G-1 0.01555 0.04540 0.01411 0.01742 -0.00701
196 15G+2 0.03427 -0.05430 0.05430 0.10860 0.00000
197 15G-2 -0.03230 -0.04459 -0.04459 0.00000 -0.01982
198 15G+3 -0.04631 0.04234 -0.01716 -0.04109 -0.01854
199 15G-3 -0.04114 0.01716 -0.04234 -0.04109 0.01854
200 15G+4 -0.02250 -0.07183 -0.07183 0.00000 0.03761
201 15G-4 0.04551 0.00177 -0.00177 0.04853 0.00000
202 4 H 1S -0.08899 0.00000 0.00000 0.00000 -0.18874
203 2S 1.02570 0.00000 0.00000 0.00000 0.55430
204 3S -8.18467 0.00000 0.00000 0.00000 -2.76990
205 4S -4.32713 0.00000 0.00000 0.00000 -0.64051
206 5S -0.02867 0.00000 0.00000 0.00000 -0.03395
207 6PX -0.01036 0.00000 0.00828 -0.00828 -0.04897
208 6PY -0.01414 0.00828 0.00000 -0.00828 0.04897
209 6PZ -0.01414 -0.00828 0.00828 0.00000 0.04897
210 7PX -0.18527 0.00000 -0.00776 0.00776 0.19962
211 7PY 0.22647 -0.00776 0.00000 0.00776 -0.19962
212 7PZ 0.22647 0.00776 -0.00776 0.00000 -0.19962
213 8PX 2.91387 0.00000 -1.14171 1.14171 0.82156
214 8PY -2.39558 -1.14171 0.00000 1.14171 -0.82156
215 8PZ -2.39558 1.14171 -1.14171 0.00000 -0.82156
216 9PX 1.54831 0.00000 -0.33758 0.33758 0.32237
217 9PY -1.38759 -0.33758 0.00000 0.33758 -0.32237
218 9PZ -1.38759 0.33758 -0.33758 0.00000 -0.32237
219 10D 0 0.02349 0.03500 -0.03500 0.00000 0.00000
220 10D+1 -0.02111 -0.02010 0.00000 0.02010 -0.09692
221 10D-1 0.04601 0.00000 -0.02010 0.02010 0.09692
222 10D+2 -0.04069 0.02021 0.02021 -0.04042 0.00000
223 10D-2 -0.02111 0.02010 -0.02010 0.00000 -0.09692
224 11D 0 -0.03104 0.11656 -0.11656 0.00000 0.00000
225 11D+1 0.39876 -0.29182 0.00000 0.29182 0.37235
226 11D-1 -0.30675 0.00000 -0.29182 0.29182 -0.37235
227 11D+2 0.05376 0.06730 0.06730 -0.13460 0.00000
228 11D-2 0.39876 0.29182 -0.29182 0.00000 0.37235
229 12D 0 0.02712 0.37916 -0.37916 0.00000 0.00000
230 12D+1 0.80486 -0.26410 0.00000 0.26410 0.06214
231 12D-1 -0.60677 0.00000 -0.26410 0.26410 -0.06214
232 12D+2 -0.04698 0.21891 0.21891 -0.43782 0.00000
233 12D-2 0.80486 0.26410 -0.26410 0.00000 0.06214
234 13F 0 0.02321 0.04563 -0.04563 0.00000 0.01460
235 13F+1 -0.05729 -0.08338 0.09376 0.03787 0.00894
236 13F-1 0.06245 0.09376 -0.08338 0.03787 -0.00894
237 13F+2 -0.09698 0.08325 0.08325 -0.10547 0.00000
238 13F-2 0.00256 0.00000 0.00000 0.00000 -0.03077
239 13F+3 0.07396 -0.06459 0.01490 0.08705 -0.01154
240 13F-3 -0.07774 -0.01490 0.06459 -0.08705 -0.01154
241 14F 0 -0.00305 -0.13471 0.13471 0.00000 0.05735
242 14F+1 0.16074 -0.02862 -0.03611 0.12887 0.03512
243 14F-1 -0.03949 -0.03611 -0.02862 0.12887 -0.03512
244 14F+2 0.05231 0.05867 0.05867 -0.03620 0.00000
245 14F-2 0.24205 0.00000 0.00000 0.00000 0.00540
246 14F+3 -0.20752 -0.02217 0.14242 -0.07057 -0.04534
247 14F-3 0.03445 -0.14242 0.02217 0.07057 -0.04534
248 15G 0 -0.00402 -0.06071 0.06071 0.00000 0.04451
249 15G+1 -0.03115 -0.01411 0.04540 0.01742 -0.00701
250 15G-1 0.01555 0.04540 -0.01411 0.01742 0.00701
251 15G+2 -0.03427 0.05430 0.05430 -0.10860 0.00000
252 15G-2 -0.03230 -0.04459 0.04459 0.00000 0.01982
253 15G+3 0.04631 -0.04234 -0.01716 0.04109 -0.01854
254 15G-3 -0.04114 0.01716 0.04234 -0.04109 -0.01854
255 15G+4 0.02250 0.07183 -0.07183 0.00000 0.03761
256 15G-4 0.04551 0.00177 0.00177 0.04853 0.00000
257 5 H 1S 0.08899 0.00000 0.00000 0.00000 -0.18874
258 2S -1.02570 0.00000 0.00000 0.00000 0.55430
259 3S 8.18467 0.00000 0.00000 0.00000 -2.76990
260 4S 4.32713 0.00000 0.00000 0.00000 -0.64051
261 5S 0.02867 0.00000 0.00000 0.00000 -0.03395
262 6PX -0.01036 0.00000 0.00828 0.00828 0.04897
263 6PY -0.01414 0.00828 0.00000 0.00828 -0.04897
264 6PZ 0.01414 0.00828 -0.00828 0.00000 0.04897
265 7PX -0.18527 0.00000 -0.00776 -0.00776 -0.19962
266 7PY 0.22647 -0.00776 0.00000 -0.00776 0.19962
267 7PZ -0.22647 -0.00776 0.00776 0.00000 -0.19962
268 8PX 2.91387 0.00000 -1.14171 -1.14171 -0.82156
269 8PY -2.39558 -1.14171 0.00000 -1.14171 0.82156
270 8PZ 2.39558 -1.14171 1.14171 0.00000 -0.82156
271 9PX 1.54831 0.00000 -0.33758 -0.33758 -0.32237
272 9PY -1.38759 -0.33758 0.00000 -0.33758 0.32237
273 9PZ 1.38759 -0.33758 0.33758 0.00000 -0.32237
274 10D 0 -0.02349 -0.03500 0.03500 0.00000 0.00000
275 10D+1 -0.02111 -0.02010 0.00000 -0.02010 0.09692
276 10D-1 0.04601 0.00000 -0.02010 -0.02010 -0.09692
277 10D+2 0.04069 -0.02021 -0.02021 -0.04042 0.00000
278 10D-2 0.02111 -0.02010 0.02010 0.00000 -0.09692
279 11D 0 0.03104 -0.11656 0.11656 0.00000 0.00000
280 11D+1 0.39876 -0.29182 0.00000 -0.29182 -0.37235
281 11D-1 -0.30675 0.00000 -0.29182 -0.29182 0.37235
282 11D+2 -0.05376 -0.06730 -0.06730 -0.13460 0.00000
283 11D-2 -0.39876 -0.29182 0.29182 0.00000 0.37235
284 12D 0 -0.02712 -0.37916 0.37916 0.00000 0.00000
285 12D+1 0.80486 -0.26410 0.00000 -0.26410 -0.06214
286 12D-1 -0.60677 0.00000 -0.26410 -0.26410 0.06214
287 12D+2 0.04698 -0.21891 -0.21891 -0.43782 0.00000
288 12D-2 -0.80486 -0.26410 0.26410 0.00000 0.06214
289 13F 0 -0.02321 -0.04563 0.04563 0.00000 0.01460
290 13F+1 -0.05729 -0.08338 0.09376 -0.03787 -0.00894
291 13F-1 0.06245 0.09376 -0.08338 -0.03787 0.00894
292 13F+2 0.09698 -0.08325 -0.08325 -0.10547 0.00000
293 13F-2 -0.00256 0.00000 0.00000 0.00000 -0.03077
294 13F+3 0.07396 -0.06459 0.01490 -0.08705 0.01154
295 13F-3 -0.07774 -0.01490 0.06459 0.08705 0.01154
296 14F 0 0.00305 0.13471 -0.13471 0.00000 0.05735
297 14F+1 0.16074 -0.02862 -0.03611 -0.12887 -0.03512
298 14F-1 -0.03949 -0.03611 -0.02862 -0.12887 0.03512
299 14F+2 -0.05231 -0.05867 -0.05867 -0.03620 0.00000
300 14F-2 -0.24205 0.00000 0.00000 0.00000 0.00540
301 14F+3 -0.20752 -0.02217 0.14242 0.07057 0.04534
302 14F-3 0.03445 -0.14242 0.02217 -0.07057 0.04534
303 15G 0 0.00402 0.06071 -0.06071 0.00000 0.04451
304 15G+1 -0.03115 -0.01411 0.04540 -0.01742 0.00701
305 15G-1 0.01555 0.04540 -0.01411 -0.01742 -0.00701
306 15G+2 0.03427 -0.05430 -0.05430 -0.10860 0.00000
307 15G-2 0.03230 0.04459 -0.04459 0.00000 0.01982
308 15G+3 0.04631 -0.04234 -0.01716 -0.04109 0.01854
309 15G-3 -0.04114 0.01716 0.04234 0.04109 0.01854
310 15G+4 -0.02250 -0.07183 0.07183 0.00000 0.03761
311 15G-4 -0.04551 -0.00177 -0.00177 0.04853 0.00000
196 197 198 199 200
(T2)--V (T2)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 11.12814 11.12814 11.12814 11.44366 11.44366
1 1 C 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 0.12420 0.00000 0.00000
8 7PY 0.00000 0.12420 0.00000 0.98675 0.00000
9 7PZ 0.12420 0.00000 0.00000 0.00000 0.98675
10 8PX 0.00000 0.00000 -2.14837 0.00000 0.00000
11 8PY 0.00000 -2.14837 0.00000 -4.49007 0.00000
12 8PZ -2.14837 0.00000 0.00000 0.00000 -4.49007
13 9PX 0.00000 0.00000 13.16867 0.00000 0.00000
14 9PY 0.00000 13.16867 0.00000 13.36513 0.00000
15 9PZ 13.16867 0.00000 0.00000 0.00000 13.36513
16 10PX 0.00000 0.00000 4.57125 0.00000 0.00000
17 10PY 0.00000 4.57125 0.00000 9.21536 0.00000
18 10PZ 4.57125 0.00000 0.00000 0.00000 9.21536
19 11PX 0.00000 0.00000 0.52330 0.00000 0.00000
20 11PY 0.00000 0.52330 0.00000 0.06217 0.00000
21 11PZ 0.52330 0.00000 0.00000 0.00000 0.06217
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 -0.19106 0.00000 -0.38307 0.00000
24 12D-1 0.00000 0.00000 -0.19106 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 -0.19106 0.00000 0.00000 0.00000 -0.38307
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.20740 0.00000 -0.28351 0.00000
29 13D-1 0.00000 0.00000 0.20740 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.20740 0.00000 0.00000 0.00000 -0.28351
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 -2.26905 0.00000 7.50979 0.00000
34 14D-1 0.00000 0.00000 -2.26905 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 -2.26905 0.00000 0.00000 0.00000 7.50979
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.54597 0.00000 2.32963 0.00000
39 15D-1 0.00000 0.00000 0.54597 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.54597 0.00000 0.00000 0.00000 2.32963
42 16F 0 -0.84655 0.00000 0.00000 0.00000 0.88912
43 16F+1 0.00000 0.00000 0.51841 0.00000 0.00000
44 16F-1 0.00000 0.51841 0.00000 -0.54447 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 -0.66926 0.00000 0.00000
48 16F-3 0.00000 0.66926 0.00000 -0.70291 0.00000
49 17F 0 1.88718 0.00000 0.00000 0.00000 -2.20065
50 17F+1 0.00000 0.00000 -1.15566 0.00000 0.00000
51 17F-1 0.00000 -1.15566 0.00000 1.34762 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 1.49195 0.00000 0.00000
55 17F-3 0.00000 -1.49195 0.00000 1.73977 0.00000
56 18F 0 0.76431 0.00000 0.00000 0.00000 -0.56330
57 18F+1 0.00000 0.00000 -0.46804 0.00000 0.00000
58 18F-1 0.00000 -0.46804 0.00000 0.34495 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 0.60424 0.00000 0.00000
62 18F-3 0.00000 -0.60424 0.00000 0.44533 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 -0.28354 0.00000 -0.06877 0.00000
65 19G-1 0.00000 0.00000 -0.28354 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.80196 0.00000 0.00000 0.00000 0.19450
68 19G+3 0.00000 -0.75016 0.00000 -0.18194 0.00000
69 19G-3 0.00000 0.00000 0.75016 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 -0.75954 0.00000 -0.45128 0.00000
74 20G-1 0.00000 0.00000 -0.75954 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 2.14831 0.00000 0.00000 0.00000 1.27642
77 20G+3 0.00000 -2.00956 0.00000 -1.19399 0.00000
78 20G-3 0.00000 0.00000 2.00956 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 -0.93136 0.00000 0.00000 0.00000 -0.15876
82 21H+1 0.00000 0.00000 -0.53224 0.00000 0.00000
83 21H-1 0.00000 -0.53224 0.00000 -0.50856 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 0.37404 0.00000 0.00000
87 21H-3 0.00000 -0.37404 0.00000 0.51650 0.00000
88 21H+4 -0.14202 0.00000 0.00000 0.00000 -0.75364
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00000 0.00000 -0.68147 0.00000 0.00000
91 21H-5 0.00000 -0.68147 0.00000 -0.26033 0.00000
92 2 H 1S -0.13801 -0.13801 -0.13801 -0.20351 -0.20351
93 2S -0.12140 -0.12140 -0.12140 -0.63432 -0.63432
94 3S -2.55369 -2.55369 -2.55369 -6.50060 -6.50060
95 4S -1.81159 -1.81159 -1.81159 -5.18342 -5.18342
96 5S -0.19998 -0.19998 -0.19998 0.19926 0.19926
97 6PX -0.04757 -0.04757 -0.03568 -0.09001 -0.09001
98 6PY -0.04757 -0.03568 -0.04757 -0.08782 -0.09001
99 6PZ -0.03568 -0.04757 -0.04757 -0.09001 -0.08782
100 7PX 0.16448 0.16448 0.31926 0.47148 0.47148
101 7PY 0.16448 0.31926 0.16448 0.45860 0.47148
102 7PZ 0.31926 0.16448 0.16448 0.47148 0.45860
103 8PX 1.79393 1.79393 -1.85296 1.33926 1.33926
104 8PY 1.79393 -1.85296 1.79393 1.16186 1.33926
105 8PZ -1.85296 1.79393 1.79393 1.33926 1.16186
106 9PX 0.87599 0.87599 -0.48473 1.43351 1.43351
107 9PY 0.87599 -0.48473 0.87599 1.01504 1.43351
108 9PZ -0.48473 0.87599 0.87599 1.43351 1.01504
109 10D 0 -0.09858 0.04929 0.04929 -0.00026 0.00052
110 10D+1 0.06370 0.15641 0.06370 0.03645 -0.03109
111 10D-1 0.06370 0.06370 0.15641 -0.03109 -0.03109
112 10D+2 0.00000 0.08537 -0.08537 -0.00045 0.00000
113 10D-2 0.15641 0.06370 0.06370 -0.03109 0.03645
114 11D 0 0.90865 -0.45433 -0.45433 0.00871 -0.01741
115 11D+1 0.04098 -0.80272 0.04098 -0.12732 -0.09765
116 11D-1 0.04098 0.04098 -0.80272 -0.09765 -0.09765
117 11D+2 0.00000 -0.78692 0.78692 0.01508 0.00000
118 11D-2 -0.80272 0.04098 0.04098 -0.09765 -0.12732
119 12D 0 1.25619 -0.62809 -0.62809 -0.01061 0.02121
120 12D+1 0.41771 -0.91492 0.41771 -0.27884 -0.04980
121 12D-1 0.41771 0.41771 -0.91492 -0.04980 -0.04980
122 12D+2 0.00000 -1.08789 1.08789 -0.01837 0.00000
123 12D-2 -0.91492 0.41771 0.41771 -0.04980 -0.27884
124 13F 0 0.03536 -0.00504 -0.00504 -0.09099 -0.14415
125 13F+1 0.06078 -0.05461 -0.02166 0.03500 0.07644
126 13F-1 0.06078 -0.02166 -0.05461 0.08828 0.07644
127 13F+2 0.00000 -0.07298 0.07298 -0.02621 0.00000
128 13F-2 -0.07628 -0.07628 -0.07628 0.20144 0.20144
129 13F+3 0.04071 -0.04868 0.02796 -0.08798 -0.05588
130 13F-3 -0.04071 -0.02796 0.04868 0.11396 0.05588
131 14F 0 -0.21323 0.05067 0.05067 0.07801 0.18192
132 14F+1 -0.47659 0.41453 0.13058 -0.04869 -0.04686
133 14F-1 -0.47659 0.13058 0.41453 -0.11140 -0.04686
134 14F+2 0.00000 0.56359 -0.56359 -0.00116 0.00000
135 14F-2 0.04721 0.04721 0.04721 -0.24691 -0.24691
136 14F+3 -0.30507 0.38519 -0.16858 0.06097 0.06238
137 14F-3 0.30507 0.16858 -0.38519 -0.14382 -0.06238
138 15G 0 -0.00784 0.02746 0.02746 0.02234 0.02890
139 15G+1 0.04754 -0.00886 -0.02643 0.02689 0.04583
140 15G-1 0.04754 -0.02643 -0.00886 -0.01009 0.04583
141 15G+2 0.00000 -0.03158 0.03158 0.00587 0.00000
142 15G-2 0.02507 -0.02986 -0.02986 -0.05055 -0.07606
143 15G+3 0.01395 -0.02345 0.04191 0.07115 0.03671
144 15G-3 -0.01395 -0.04191 0.02345 -0.05785 -0.03671
145 15G+4 0.04111 -0.00066 -0.00066 0.02332 0.01555
146 15G-4 0.00000 -0.03954 0.03954 -0.02989 0.00000
147 3 H 1S -0.13801 0.13801 0.13801 0.20351 -0.20351
148 2S -0.12140 0.12140 0.12140 0.63432 -0.63432
149 3S -2.55369 2.55369 2.55369 6.50060 -6.50060
150 4S -1.81159 1.81159 1.81159 5.18342 -5.18342
151 5S -0.19998 0.19998 0.19998 -0.19926 0.19926
152 6PX 0.04757 -0.04757 -0.03568 -0.09001 0.09001
153 6PY 0.04757 -0.03568 -0.04757 -0.08782 0.09001
154 6PZ -0.03568 0.04757 0.04757 0.09001 -0.08782
155 7PX -0.16448 0.16448 0.31926 0.47148 -0.47148
156 7PY -0.16448 0.31926 0.16448 0.45860 -0.47148
157 7PZ 0.31926 -0.16448 -0.16448 -0.47148 0.45860
158 8PX -1.79393 1.79393 -1.85296 1.33926 -1.33926
159 8PY -1.79393 -1.85296 1.79393 1.16186 -1.33926
160 8PZ -1.85296 -1.79393 -1.79393 -1.33926 1.16186
161 9PX -0.87599 0.87599 -0.48473 1.43351 -1.43351
162 9PY -0.87599 -0.48473 0.87599 1.01504 -1.43351
163 9PZ -0.48473 -0.87599 -0.87599 -1.43351 1.01504
164 10D 0 -0.09858 -0.04929 -0.04929 0.00026 0.00052
165 10D+1 -0.06370 0.15641 0.06370 0.03645 0.03109
166 10D-1 -0.06370 0.06370 0.15641 -0.03109 0.03109
167 10D+2 0.00000 -0.08537 0.08537 0.00045 0.00000
168 10D-2 0.15641 -0.06370 -0.06370 0.03109 0.03645
169 11D 0 0.90865 0.45433 0.45433 -0.00871 -0.01741
170 11D+1 -0.04098 -0.80272 0.04098 -0.12732 0.09765
171 11D-1 -0.04098 0.04098 -0.80272 -0.09765 0.09765
172 11D+2 0.00000 0.78692 -0.78692 -0.01508 0.00000
173 11D-2 -0.80272 -0.04098 -0.04098 0.09765 -0.12732
174 12D 0 1.25619 0.62809 0.62809 0.01061 0.02121
175 12D+1 -0.41771 -0.91492 0.41771 -0.27884 0.04980
176 12D-1 -0.41771 0.41771 -0.91492 -0.04980 0.04980
177 12D+2 0.00000 1.08789 -1.08789 0.01837 0.00000
178 12D-2 -0.91492 -0.41771 -0.41771 0.04980 -0.27884
179 13F 0 0.03536 0.00504 0.00504 0.09099 -0.14415
180 13F+1 -0.06078 -0.05461 -0.02166 0.03500 -0.07644
181 13F-1 -0.06078 -0.02166 -0.05461 0.08828 -0.07644
182 13F+2 0.00000 0.07298 -0.07298 0.02621 0.00000
183 13F-2 -0.07628 0.07628 0.07628 -0.20144 0.20144
184 13F+3 -0.04071 -0.04868 0.02796 -0.08798 0.05588
185 13F-3 0.04071 -0.02796 0.04868 0.11396 -0.05588
186 14F 0 -0.21323 -0.05067 -0.05067 -0.07801 0.18192
187 14F+1 0.47659 0.41453 0.13058 -0.04869 0.04686
188 14F-1 0.47659 0.13058 0.41453 -0.11140 0.04686
189 14F+2 0.00000 -0.56359 0.56359 0.00116 0.00000
190 14F-2 0.04721 -0.04721 -0.04721 0.24691 -0.24691
191 14F+3 0.30507 0.38519 -0.16858 0.06097 -0.06238
192 14F-3 -0.30507 0.16858 -0.38519 -0.14382 0.06238
193 15G 0 -0.00784 -0.02746 -0.02746 -0.02234 0.02890
194 15G+1 -0.04754 -0.00886 -0.02643 0.02689 -0.04583
195 15G-1 -0.04754 -0.02643 -0.00886 -0.01009 -0.04583
196 15G+2 0.00000 0.03158 -0.03158 -0.00587 0.00000
197 15G-2 0.02507 0.02986 0.02986 0.05055 -0.07606
198 15G+3 -0.01395 -0.02345 0.04191 0.07115 -0.03671
199 15G-3 0.01395 -0.04191 0.02345 -0.05785 0.03671
200 15G+4 0.04111 0.00066 0.00066 -0.02332 0.01555
201 15G-4 0.00000 0.03954 -0.03954 0.02989 0.00000
202 4 H 1S 0.13801 0.13801 -0.13801 0.20351 0.20351
203 2S 0.12140 0.12140 -0.12140 0.63432 0.63432
204 3S 2.55369 2.55369 -2.55369 6.50060 6.50060
205 4S 1.81159 1.81159 -1.81159 5.18342 5.18342
206 5S 0.19998 0.19998 -0.19998 -0.19926 -0.19926
207 6PX 0.04757 0.04757 -0.03568 0.09001 0.09001
208 6PY -0.04757 -0.03568 0.04757 -0.08782 -0.09001
209 6PZ -0.03568 -0.04757 0.04757 -0.09001 -0.08782
210 7PX -0.16448 -0.16448 0.31926 -0.47148 -0.47148
211 7PY 0.16448 0.31926 -0.16448 0.45860 0.47148
212 7PZ 0.31926 0.16448 -0.16448 0.47148 0.45860
213 8PX -1.79393 -1.79393 -1.85296 -1.33926 -1.33926
214 8PY 1.79393 -1.85296 -1.79393 1.16186 1.33926
215 8PZ -1.85296 1.79393 -1.79393 1.33926 1.16186
216 9PX -0.87599 -0.87599 -0.48473 -1.43351 -1.43351
217 9PY 0.87599 -0.48473 -0.87599 1.01504 1.43351
218 9PZ -0.48473 0.87599 -0.87599 1.43351 1.01504
219 10D 0 0.09858 -0.04929 0.04929 0.00026 -0.00052
220 10D+1 0.06370 0.15641 -0.06370 0.03645 -0.03109
221 10D-1 -0.06370 -0.06370 0.15641 0.03109 0.03109
222 10D+2 0.00000 -0.08537 -0.08537 0.00045 0.00000
223 10D-2 0.15641 0.06370 -0.06370 -0.03109 0.03645
224 11D 0 -0.90865 0.45433 -0.45433 -0.00871 0.01741
225 11D+1 0.04098 -0.80272 -0.04098 -0.12732 -0.09765
226 11D-1 -0.04098 -0.04098 -0.80272 0.09765 0.09765
227 11D+2 0.00000 0.78692 0.78692 -0.01508 0.00000
228 11D-2 -0.80272 0.04098 -0.04098 -0.09765 -0.12732
229 12D 0 -1.25619 0.62809 -0.62809 0.01061 -0.02121
230 12D+1 0.41771 -0.91492 -0.41771 -0.27884 -0.04980
231 12D-1 -0.41771 -0.41771 -0.91492 0.04980 0.04980
232 12D+2 0.00000 1.08789 1.08789 0.01837 0.00000
233 12D-2 -0.91492 0.41771 -0.41771 -0.04980 -0.27884
234 13F 0 0.03536 -0.00504 0.00504 -0.09099 -0.14415
235 13F+1 -0.06078 0.05461 -0.02166 -0.03500 -0.07644
236 13F-1 0.06078 -0.02166 0.05461 0.08828 0.07644
237 13F+2 0.00000 -0.07298 -0.07298 -0.02621 0.00000
238 13F-2 0.07628 0.07628 -0.07628 -0.20144 -0.20144
239 13F+3 -0.04071 0.04868 0.02796 0.08798 0.05588
240 13F-3 -0.04071 -0.02796 -0.04868 0.11396 0.05588
241 14F 0 -0.21323 0.05067 -0.05067 0.07801 0.18192
242 14F+1 0.47659 -0.41453 0.13058 0.04869 0.04686
243 14F-1 -0.47659 0.13058 -0.41453 -0.11140 -0.04686
244 14F+2 0.00000 0.56359 0.56359 -0.00116 0.00000
245 14F-2 -0.04721 -0.04721 0.04721 0.24691 0.24691
246 14F+3 0.30507 -0.38519 -0.16858 -0.06097 -0.06238
247 14F-3 0.30507 0.16858 0.38519 -0.14382 -0.06238
248 15G 0 0.00784 -0.02746 0.02746 -0.02234 -0.02890
249 15G+1 0.04754 -0.00886 0.02643 0.02689 0.04583
250 15G-1 -0.04754 0.02643 -0.00886 0.01009 -0.04583
251 15G+2 0.00000 0.03158 0.03158 -0.00587 0.00000
252 15G-2 0.02507 -0.02986 0.02986 -0.05055 -0.07606
253 15G+3 0.01395 -0.02345 -0.04191 0.07115 0.03671
254 15G-3 0.01395 0.04191 0.02345 0.05785 0.03671
255 15G+4 -0.04111 0.00066 -0.00066 -0.02332 -0.01555
256 15G-4 0.00000 -0.03954 -0.03954 -0.02989 0.00000
257 5 H 1S 0.13801 -0.13801 0.13801 -0.20351 0.20351
258 2S 0.12140 -0.12140 0.12140 -0.63432 0.63432
259 3S 2.55369 -2.55369 2.55369 -6.50060 6.50060
260 4S 1.81159 -1.81159 1.81159 -5.18342 5.18342
261 5S 0.19998 -0.19998 0.19998 0.19926 -0.19926
262 6PX -0.04757 0.04757 -0.03568 0.09001 -0.09001
263 6PY 0.04757 -0.03568 0.04757 -0.08782 0.09001
264 6PZ -0.03568 0.04757 -0.04757 0.09001 -0.08782
265 7PX 0.16448 -0.16448 0.31926 -0.47148 0.47148
266 7PY -0.16448 0.31926 -0.16448 0.45860 -0.47148
267 7PZ 0.31926 -0.16448 0.16448 -0.47148 0.45860
268 8PX 1.79393 -1.79393 -1.85296 -1.33926 1.33926
269 8PY -1.79393 -1.85296 -1.79393 1.16186 -1.33926
270 8PZ -1.85296 -1.79393 1.79393 -1.33926 1.16186
271 9PX 0.87599 -0.87599 -0.48473 -1.43351 1.43351
272 9PY -0.87599 -0.48473 -0.87599 1.01504 -1.43351
273 9PZ -0.48473 -0.87599 0.87599 -1.43351 1.01504
274 10D 0 0.09858 0.04929 -0.04929 -0.00026 -0.00052
275 10D+1 -0.06370 0.15641 -0.06370 0.03645 0.03109
276 10D-1 0.06370 -0.06370 0.15641 0.03109 -0.03109
277 10D+2 0.00000 0.08537 0.08537 -0.00045 0.00000
278 10D-2 0.15641 -0.06370 0.06370 0.03109 0.03645
279 11D 0 -0.90865 -0.45433 0.45433 0.00871 0.01741
280 11D+1 -0.04098 -0.80272 -0.04098 -0.12732 0.09765
281 11D-1 0.04098 -0.04098 -0.80272 0.09765 -0.09765
282 11D+2 0.00000 -0.78692 -0.78692 0.01508 0.00000
283 11D-2 -0.80272 -0.04098 0.04098 0.09765 -0.12732
284 12D 0 -1.25619 -0.62809 0.62809 -0.01061 -0.02121
285 12D+1 -0.41771 -0.91492 -0.41771 -0.27884 0.04980
286 12D-1 0.41771 -0.41771 -0.91492 0.04980 -0.04980
287 12D+2 0.00000 -1.08789 -1.08789 -0.01837 0.00000
288 12D-2 -0.91492 -0.41771 0.41771 0.04980 -0.27884
289 13F 0 0.03536 0.00504 -0.00504 0.09099 -0.14415
290 13F+1 0.06078 0.05461 -0.02166 -0.03500 0.07644
291 13F-1 -0.06078 -0.02166 0.05461 0.08828 -0.07644
292 13F+2 0.00000 0.07298 0.07298 0.02621 0.00000
293 13F-2 0.07628 -0.07628 0.07628 0.20144 -0.20144
294 13F+3 0.04071 0.04868 0.02796 0.08798 -0.05588
295 13F-3 0.04071 -0.02796 -0.04868 0.11396 -0.05588
296 14F 0 -0.21323 -0.05067 0.05067 -0.07801 0.18192
297 14F+1 -0.47659 -0.41453 0.13058 0.04869 -0.04686
298 14F-1 0.47659 0.13058 -0.41453 -0.11140 0.04686
299 14F+2 0.00000 -0.56359 -0.56359 0.00116 0.00000
300 14F-2 -0.04721 0.04721 -0.04721 -0.24691 0.24691
301 14F+3 -0.30507 -0.38519 -0.16858 -0.06097 0.06238
302 14F-3 -0.30507 0.16858 0.38519 -0.14382 0.06238
303 15G 0 0.00784 0.02746 -0.02746 0.02234 -0.02890
304 15G+1 -0.04754 -0.00886 0.02643 0.02689 -0.04583
305 15G-1 0.04754 0.02643 -0.00886 0.01009 0.04583
306 15G+2 0.00000 -0.03158 -0.03158 0.00587 0.00000
307 15G-2 0.02507 0.02986 -0.02986 0.05055 -0.07606
308 15G+3 -0.01395 -0.02345 -0.04191 0.07115 -0.03671
309 15G-3 -0.01395 0.04191 0.02345 0.05785 -0.03671
310 15G+4 -0.04111 -0.00066 0.00066 0.02332 -0.01555
311 15G-4 0.00000 0.03954 0.03954 0.02989 0.00000
201 202 203 204 205
(T2)--V (A1)--V (T1)--V (T1)--V (T1)--V
Eigenvalues -- 11.44366 11.56346 11.82486 11.82486 11.82486
1 1 C 1S 0.00000 0.03405 0.00000 0.00000 0.00000
2 2S 0.00000 -0.69764 0.00000 0.00000 0.00000
3 3S 0.00000 -5.23394 0.00000 0.00000 0.00000
4 4S 0.00000 20.07877 0.00000 0.00000 0.00000
5 5S 0.00000 -8.09098 0.00000 0.00000 0.00000
6 6S 0.00000 0.48169 0.00000 0.00000 0.00000
7 7PX 0.98675 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 -4.49007 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 13.36513 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 9.21536 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 0.06217 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 -0.38307 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 -0.28351 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 7.50979 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 2.32963 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 -0.54447 0.00000 -1.27489 0.00000 0.00000
44 16F-1 0.00000 0.00000 0.00000 -1.27489 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 -1.61262
46 16F-2 0.00000 1.37360 0.00000 0.00000 0.00000
47 16F+3 0.70291 0.00000 -0.98752 0.00000 0.00000
48 16F-3 0.00000 0.00000 0.00000 0.98752 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 1.34762 0.00000 4.37919 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.00000 4.37919 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 5.53929
53 17F-2 0.00000 -1.18865 0.00000 0.00000 0.00000
54 17F+3 -1.73977 0.00000 3.39211 0.00000 0.00000
55 17F-3 0.00000 0.00000 0.00000 -3.39211 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.34495 0.00000 1.15498 0.00000 0.00000
58 18F-1 0.00000 0.00000 0.00000 1.15498 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 1.46095
60 18F-2 0.00000 -1.59838 0.00000 0.00000 0.00000
61 18F+3 -0.44533 0.00000 0.89464 0.00000 0.00000
62 18F-3 0.00000 0.00000 0.00000 -0.89464 0.00000
63 19G 0 0.00000 -0.05974 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 0.66042 0.00000
65 19G-1 -0.06877 0.00000 0.66042 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 -0.24962 0.00000
69 19G-3 0.18194 0.00000 0.24962 0.00000 0.00000
70 19G+4 0.00000 -0.05049 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.70602
72 20G 0 0.00000 0.55463 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.00000 1.29812 0.00000
74 20G-1 -0.45128 0.00000 1.29812 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 -0.49064 0.00000
78 20G-3 1.19399 0.00000 0.49064 0.00000 0.00000
79 20G+4 0.00000 0.46875 0.00000 0.00000 0.00000
80 20G-4 0.00000 0.00000 0.00000 0.00000 1.38775
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 -0.50856 0.00000 -0.04261 0.00000 0.00000
83 21H-1 0.00000 0.00000 0.00000 -0.04261 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.06442
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 -0.51650 0.00000 0.01973 0.00000 0.00000
87 21H-3 0.00000 0.00000 0.00000 -0.01973 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 -0.26033 0.00000 0.04411 0.00000 0.00000
91 21H-5 0.00000 0.00000 0.00000 0.04411 0.00000
92 2 H 1S -0.20351 -0.01434 0.00000 0.00000 0.00000
93 2S -0.63432 1.46455 0.00000 0.00000 0.00000
94 3S -6.50060 -0.63325 0.00000 0.00000 0.00000
95 4S -5.18342 -0.21866 0.00000 0.00000 0.00000
96 5S 0.19926 -0.08577 0.00000 0.00000 0.00000
97 6PX -0.08782 0.05586 0.00000 0.00977 -0.00977
98 6PY -0.09001 0.05586 0.00977 0.00000 0.00977
99 6PZ -0.09001 0.05586 -0.00977 -0.00977 0.00000
100 7PX 0.45860 -0.48709 0.00000 -0.12188 0.12188
101 7PY 0.47148 -0.48709 -0.12188 0.00000 -0.12188
102 7PZ 0.47148 -0.48709 0.12188 0.12188 0.00000
103 8PX 1.16186 1.34114 0.00000 2.07886 -2.07886
104 8PY 1.33926 1.34114 2.07886 0.00000 2.07886
105 8PZ 1.33926 1.34114 -2.07886 -2.07886 0.00000
106 9PX 1.01504 0.37924 0.00000 0.60280 -0.60280
107 9PY 1.43351 0.37924 0.60280 0.00000 0.60280
108 9PZ 1.43351 0.37924 -0.60280 -0.60280 0.00000
109 10D 0 -0.00026 0.00000 0.02684 0.02684 0.00000
110 10D+1 -0.03109 0.08813 -0.01486 0.00000 -0.01486
111 10D-1 0.03645 0.08813 0.00000 -0.01486 0.01486
112 10D+2 0.00045 0.00000 0.01549 -0.01549 0.03099
113 10D-2 -0.03109 0.08813 0.01486 0.01486 0.00000
114 11D 0 0.00871 0.00000 0.79726 0.79726 0.00000
115 11D+1 -0.09765 -0.42478 0.47239 0.00000 0.47239
116 11D-1 -0.12732 -0.42478 0.00000 0.47239 -0.47239
117 11D+2 -0.01508 0.00000 0.46030 -0.46030 0.92060
118 11D-2 -0.09765 -0.42478 -0.47239 -0.47239 0.00000
119 12D 0 -0.01061 0.00000 1.19191 1.19191 0.00000
120 12D+1 -0.04980 -0.84803 0.67526 0.00000 0.67526
121 12D-1 -0.27884 -0.84803 0.00000 0.67526 -0.67526
122 12D+2 0.01837 0.00000 0.68815 -0.68815 1.37630
123 12D-2 -0.04980 -0.84803 -0.67526 -0.67526 0.00000
124 13F 0 -0.09099 0.15438 -0.02354 -0.02354 0.00000
125 13F+1 0.08828 -0.09454 0.04490 0.03008 0.05891
126 13F-1 0.03500 -0.09454 0.03008 0.04490 -0.05891
127 13F+2 0.02621 0.00000 0.05628 -0.05628 0.05679
128 13F-2 0.20144 -0.18245 0.00000 0.00000 0.00000
129 13F+3 -0.11396 0.12205 0.03478 0.05307 0.01586
130 13F-3 0.08798 -0.12205 -0.05307 -0.03478 0.01586
131 14F 0 0.07801 -0.34304 -0.28776 -0.28776 0.00000
132 14F+1 -0.11140 0.21007 -0.57044 -0.47664 -0.12421
133 14F-1 -0.04869 0.21007 -0.47664 -0.57044 0.12421
134 14F+2 0.00116 0.00000 -0.38001 0.38001 -0.72156
135 14F-2 -0.24691 0.62651 0.00000 0.00000 0.00000
136 14F+3 0.14382 -0.27120 -0.44186 -0.00522 -0.46020
137 14F-3 -0.06097 0.27120 0.00522 0.44186 -0.46020
138 15G 0 0.02234 -0.04367 -0.01765 -0.01765 0.00000
139 15G+1 -0.01009 -0.00022 0.10213 0.10578 -0.07335
140 15G-1 0.02689 -0.00022 0.10578 0.10213 0.07335
141 15G+2 -0.00587 0.00000 0.01578 -0.01578 0.03157
142 15G-2 -0.05055 0.00064 0.04070 0.04070 0.00000
143 15G+3 0.05785 -0.00059 0.00491 -0.03998 0.07123
144 15G-3 -0.07115 0.00059 0.03998 -0.00491 0.07123
145 15G+4 0.02332 -0.03691 0.02088 0.02088 0.00000
146 15G-4 0.02989 0.00000 0.09380 -0.09380 0.11308
147 3 H 1S 0.20351 -0.01434 0.00000 0.00000 0.00000
148 2S 0.63432 1.46455 0.00000 0.00000 0.00000
149 3S 6.50060 -0.63325 0.00000 0.00000 0.00000
150 4S 5.18342 -0.21866 0.00000 0.00000 0.00000
151 5S -0.19926 -0.08577 0.00000 0.00000 0.00000
152 6PX -0.08782 -0.05586 0.00000 0.00977 0.00977
153 6PY -0.09001 -0.05586 0.00977 0.00000 -0.00977
154 6PZ 0.09001 0.05586 0.00977 0.00977 0.00000
155 7PX 0.45860 0.48709 0.00000 -0.12188 -0.12188
156 7PY 0.47148 0.48709 -0.12188 0.00000 0.12188
157 7PZ -0.47148 -0.48709 -0.12188 -0.12188 0.00000
158 8PX 1.16186 -1.34114 0.00000 2.07886 2.07886
159 8PY 1.33926 -1.34114 2.07886 0.00000 -2.07886
160 8PZ -1.33926 1.34114 2.07886 2.07886 0.00000
161 9PX 1.01504 -0.37924 0.00000 0.60280 0.60280
162 9PY 1.43351 -0.37924 0.60280 0.00000 -0.60280
163 9PZ -1.43351 0.37924 0.60280 0.60280 0.00000
164 10D 0 0.00026 0.00000 -0.02684 -0.02684 0.00000
165 10D+1 -0.03109 -0.08813 -0.01486 0.00000 0.01486
166 10D-1 0.03645 -0.08813 0.00000 -0.01486 -0.01486
167 10D+2 -0.00045 0.00000 -0.01549 0.01549 0.03099
168 10D-2 0.03109 0.08813 -0.01486 -0.01486 0.00000
169 11D 0 -0.00871 0.00000 -0.79726 -0.79726 0.00000
170 11D+1 -0.09765 0.42478 0.47239 0.00000 -0.47239
171 11D-1 -0.12732 0.42478 0.00000 0.47239 0.47239
172 11D+2 0.01508 0.00000 -0.46030 0.46030 0.92060
173 11D-2 0.09765 -0.42478 0.47239 0.47239 0.00000
174 12D 0 0.01061 0.00000 -1.19191 -1.19191 0.00000
175 12D+1 -0.04980 0.84803 0.67526 0.00000 -0.67526
176 12D-1 -0.27884 0.84803 0.00000 0.67526 0.67526
177 12D+2 -0.01837 0.00000 -0.68815 0.68815 1.37630
178 12D-2 0.04980 -0.84803 0.67526 0.67526 0.00000
179 13F 0 0.09099 0.15438 0.02354 0.02354 0.00000
180 13F+1 0.08828 0.09454 0.04490 0.03008 -0.05891
181 13F-1 0.03500 0.09454 0.03008 0.04490 0.05891
182 13F+2 -0.02621 0.00000 -0.05628 0.05628 0.05679
183 13F-2 -0.20144 -0.18245 0.00000 0.00000 0.00000
184 13F+3 -0.11396 -0.12205 0.03478 0.05307 -0.01586
185 13F-3 0.08798 0.12205 -0.05307 -0.03478 -0.01586
186 14F 0 -0.07801 -0.34304 0.28776 0.28776 0.00000
187 14F+1 -0.11140 -0.21007 -0.57044 -0.47664 0.12421
188 14F-1 -0.04869 -0.21007 -0.47664 -0.57044 -0.12421
189 14F+2 -0.00116 0.00000 0.38001 -0.38001 -0.72156
190 14F-2 0.24691 0.62651 0.00000 0.00000 0.00000
191 14F+3 0.14382 0.27120 -0.44186 -0.00522 0.46020
192 14F-3 -0.06097 -0.27120 0.00522 0.44186 0.46020
193 15G 0 -0.02234 -0.04367 0.01765 0.01765 0.00000
194 15G+1 -0.01009 0.00022 0.10213 0.10578 0.07335
195 15G-1 0.02689 0.00022 0.10578 0.10213 -0.07335
196 15G+2 0.00587 0.00000 -0.01578 0.01578 0.03157
197 15G-2 0.05055 0.00064 -0.04070 -0.04070 0.00000
198 15G+3 0.05785 0.00059 0.00491 -0.03998 -0.07123
199 15G-3 -0.07115 -0.00059 0.03998 -0.00491 -0.07123
200 15G+4 -0.02332 -0.03691 -0.02088 -0.02088 0.00000
201 15G-4 -0.02989 0.00000 -0.09380 0.09380 0.11308
202 4 H 1S -0.20351 -0.01434 0.00000 0.00000 0.00000
203 2S -0.63432 1.46455 0.00000 0.00000 0.00000
204 3S -6.50060 -0.63325 0.00000 0.00000 0.00000
205 4S -5.18342 -0.21866 0.00000 0.00000 0.00000
206 5S 0.19926 -0.08577 0.00000 0.00000 0.00000
207 6PX -0.08782 0.05586 0.00000 -0.00977 0.00977
208 6PY 0.09001 -0.05586 -0.00977 0.00000 0.00977
209 6PZ 0.09001 -0.05586 0.00977 -0.00977 0.00000
210 7PX 0.45860 -0.48709 0.00000 0.12188 -0.12188
211 7PY -0.47148 0.48709 0.12188 0.00000 -0.12188
212 7PZ -0.47148 0.48709 -0.12188 0.12188 0.00000
213 8PX 1.16186 1.34114 0.00000 -2.07886 2.07886
214 8PY -1.33926 -1.34114 -2.07886 0.00000 2.07886
215 8PZ -1.33926 -1.34114 2.07886 -2.07886 0.00000
216 9PX 1.01504 0.37924 0.00000 -0.60280 0.60280
217 9PY -1.43351 -0.37924 -0.60280 0.00000 0.60280
218 9PZ -1.43351 -0.37924 0.60280 -0.60280 0.00000
219 10D 0 -0.00026 0.00000 0.02684 -0.02684 0.00000
220 10D+1 0.03109 -0.08813 0.01486 0.00000 -0.01486
221 10D-1 0.03645 0.08813 0.00000 0.01486 -0.01486
222 10D+2 0.00045 0.00000 0.01549 0.01549 -0.03099
223 10D-2 0.03109 -0.08813 -0.01486 0.01486 0.00000
224 11D 0 0.00871 0.00000 0.79726 -0.79726 0.00000
225 11D+1 0.09765 0.42478 -0.47239 0.00000 0.47239
226 11D-1 -0.12732 -0.42478 0.00000 -0.47239 0.47239
227 11D+2 -0.01508 0.00000 0.46030 0.46030 -0.92060
228 11D-2 0.09765 0.42478 0.47239 -0.47239 0.00000
229 12D 0 -0.01061 0.00000 1.19191 -1.19191 0.00000
230 12D+1 0.04980 0.84803 -0.67526 0.00000 0.67526
231 12D-1 -0.27884 -0.84803 0.00000 -0.67526 0.67526
232 12D+2 0.01837 0.00000 0.68815 0.68815 -1.37630
233 12D-2 0.04980 0.84803 0.67526 -0.67526 0.00000
234 13F 0 0.09099 -0.15438 0.02354 -0.02354 0.00000
235 13F+1 0.08828 -0.09454 0.04490 -0.03008 -0.05891
236 13F-1 -0.03500 0.09454 -0.03008 0.04490 -0.05891
237 13F+2 -0.02621 0.00000 -0.05628 -0.05628 0.05679
238 13F-2 0.20144 -0.18245 0.00000 0.00000 0.00000
239 13F+3 -0.11396 0.12205 0.03478 -0.05307 -0.01586
240 13F-3 -0.08798 0.12205 0.05307 -0.03478 0.01586
241 14F 0 -0.07801 0.34304 0.28776 -0.28776 0.00000
242 14F+1 -0.11140 0.21007 -0.57044 0.47664 0.12421
243 14F-1 0.04869 -0.21007 0.47664 -0.57044 0.12421
244 14F+2 -0.00116 0.00000 0.38001 0.38001 -0.72156
245 14F-2 -0.24691 0.62651 0.00000 0.00000 0.00000
246 14F+3 0.14382 -0.27120 -0.44186 0.00522 0.46020
247 14F-3 0.06097 -0.27120 -0.00522 0.44186 -0.46020
248 15G 0 0.02234 -0.04367 -0.01765 0.01765 0.00000
249 15G+1 0.01009 0.00022 -0.10213 0.10578 -0.07335
250 15G-1 0.02689 -0.00022 0.10578 -0.10213 -0.07335
251 15G+2 -0.00587 0.00000 0.01578 0.01578 -0.03157
252 15G-2 0.05055 -0.00064 -0.04070 0.04070 0.00000
253 15G+3 -0.05785 0.00059 -0.00491 -0.03998 0.07123
254 15G-3 -0.07115 0.00059 0.03998 0.00491 -0.07123
255 15G+4 0.02332 -0.03691 0.02088 -0.02088 0.00000
256 15G-4 -0.02989 0.00000 -0.09380 -0.09380 0.11308
257 5 H 1S 0.20351 -0.01434 0.00000 0.00000 0.00000
258 2S 0.63432 1.46455 0.00000 0.00000 0.00000
259 3S 6.50060 -0.63325 0.00000 0.00000 0.00000
260 4S 5.18342 -0.21866 0.00000 0.00000 0.00000
261 5S -0.19926 -0.08577 0.00000 0.00000 0.00000
262 6PX -0.08782 -0.05586 0.00000 -0.00977 -0.00977
263 6PY 0.09001 0.05586 -0.00977 0.00000 -0.00977
264 6PZ -0.09001 -0.05586 -0.00977 0.00977 0.00000
265 7PX 0.45860 0.48709 0.00000 0.12188 0.12188
266 7PY -0.47148 -0.48709 0.12188 0.00000 0.12188
267 7PZ 0.47148 0.48709 0.12188 -0.12188 0.00000
268 8PX 1.16186 -1.34114 0.00000 -2.07886 -2.07886
269 8PY -1.33926 1.34114 -2.07886 0.00000 -2.07886
270 8PZ 1.33926 -1.34114 -2.07886 2.07886 0.00000
271 9PX 1.01504 -0.37924 0.00000 -0.60280 -0.60280
272 9PY -1.43351 0.37924 -0.60280 0.00000 -0.60280
273 9PZ 1.43351 -0.37924 -0.60280 0.60280 0.00000
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276 10D-1 0.03645 -0.08813 0.00000 0.01486 0.01486
277 10D+2 -0.00045 0.00000 -0.01549 -0.01549 -0.03099
278 10D-2 -0.03109 -0.08813 0.01486 -0.01486 0.00000
279 11D 0 -0.00871 0.00000 -0.79726 0.79726 0.00000
280 11D+1 0.09765 -0.42478 -0.47239 0.00000 -0.47239
281 11D-1 -0.12732 0.42478 0.00000 -0.47239 -0.47239
282 11D+2 0.01508 0.00000 -0.46030 -0.46030 -0.92060
283 11D-2 -0.09765 0.42478 -0.47239 0.47239 0.00000
284 12D 0 0.01061 0.00000 -1.19191 1.19191 0.00000
285 12D+1 0.04980 -0.84803 -0.67526 0.00000 -0.67526
286 12D-1 -0.27884 0.84803 0.00000 -0.67526 -0.67526
287 12D+2 -0.01837 0.00000 -0.68815 -0.68815 -1.37630
288 12D-2 -0.04980 0.84803 -0.67526 0.67526 0.00000
289 13F 0 -0.09099 -0.15438 -0.02354 0.02354 0.00000
290 13F+1 0.08828 0.09454 0.04490 -0.03008 0.05891
291 13F-1 -0.03500 -0.09454 -0.03008 0.04490 0.05891
292 13F+2 0.02621 0.00000 0.05628 0.05628 0.05679
293 13F-2 -0.20144 -0.18245 0.00000 0.00000 0.00000
294 13F+3 -0.11396 -0.12205 0.03478 -0.05307 0.01586
295 13F-3 -0.08798 -0.12205 0.05307 -0.03478 -0.01586
296 14F 0 0.07801 0.34304 -0.28776 0.28776 0.00000
297 14F+1 -0.11140 -0.21007 -0.57044 0.47664 -0.12421
298 14F-1 0.04869 0.21007 0.47664 -0.57044 -0.12421
299 14F+2 0.00116 0.00000 -0.38001 -0.38001 -0.72156
300 14F-2 0.24691 0.62651 0.00000 0.00000 0.00000
301 14F+3 0.14382 0.27120 -0.44186 0.00522 -0.46020
302 14F-3 0.06097 0.27120 -0.00522 0.44186 0.46020
303 15G 0 -0.02234 -0.04367 0.01765 -0.01765 0.00000
304 15G+1 0.01009 -0.00022 -0.10213 0.10578 0.07335
305 15G-1 0.02689 0.00022 0.10578 -0.10213 0.07335
306 15G+2 0.00587 0.00000 -0.01578 -0.01578 -0.03157
307 15G-2 -0.05055 -0.00064 0.04070 -0.04070 0.00000
308 15G+3 -0.05785 -0.00059 -0.00491 -0.03998 -0.07123
309 15G-3 -0.07115 -0.00059 0.03998 0.00491 0.07123
310 15G+4 -0.02332 -0.03691 -0.02088 0.02088 0.00000
311 15G-4 0.02989 0.00000 0.09380 0.09380 0.11308
206 207 208 209 210
(E)--V (E)--V (A2)--V (T1)--V (T1)--V
Eigenvalues -- 12.40062 12.40062 12.57411 12.73205 12.73205
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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
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21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
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26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
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29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
30 13D+2 -0.28737 1.17870 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 1.74897 0.42641 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 -0.42641 1.74897 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15D 0 0.04829 0.01177 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 -0.01177 0.04829 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 0.00000 0.00000
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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 -0.06972
48 16F-3 0.00000 0.00000 0.00000 0.06972 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
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51 17F-1 0.00000 0.00000 0.00000 0.41910 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 0.32463
55 17F-3 0.00000 0.00000 0.00000 -0.32463 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
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58 18F-1 0.00000 0.00000 0.00000 0.04477 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 0.03468
62 18F-3 0.00000 0.00000 0.00000 -0.03468 0.00000
63 19G 0 -0.04671 -0.01139 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 -0.05833 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00000 -0.05833
66 19G+2 -0.01764 0.07237 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 0.02205 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.00000 -0.02205
70 19G+4 0.05527 0.01348 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 -0.19755 -0.04816 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.00000 0.34675 0.00000
74 20G-1 0.00000 0.00000 0.00000 0.00000 0.34675
75 20G+2 -0.07461 0.30604 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 -0.13106 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.13106
79 20G+4 0.23374 0.05699 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 0.04484
83 21H-1 0.00000 0.00000 0.00000 0.04484 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 21H-2 0.10500 0.02560 0.00000 0.00000 0.00000
86 21H+3 0.00000 0.00000 0.00000 0.00000 -0.02075
87 21H-3 0.00000 0.00000 0.00000 0.02075 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
89 21H-4 -0.02560 0.10500 0.00000 0.00000 0.00000
90 21H+5 0.00000 0.00000 0.00000 0.00000 -0.04641
91 21H-5 0.00000 0.00000 0.00000 -0.04641 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 0.00349 -0.00365 0.00000 0.01161 0.00000
98 6PY 0.00142 0.00484 0.00000 0.00000 0.01161
99 6PZ -0.00490 -0.00119 0.00000 -0.01161 -0.01161
100 7PX -0.05485 0.05739 0.00000 -0.00077 0.00000
101 7PY -0.02228 -0.07620 0.00000 0.00000 -0.00077
102 7PZ 0.07713 0.01880 0.00000 0.00077 0.00077
103 8PX 0.42715 -0.44696 0.00000 0.20909 0.00000
104 8PY 0.17351 0.59341 0.00000 0.00000 0.20909
105 8PZ -0.60066 -0.14644 0.00000 -0.20909 -0.20909
106 9PX 0.10412 -0.10895 0.00000 0.03987 0.00000
107 9PY 0.04229 0.14465 0.00000 0.00000 0.03987
108 9PZ -0.14642 -0.03570 0.00000 -0.03987 -0.03987
109 10D 0 -0.04942 -0.01205 0.00000 0.04225 0.04225
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111 10D-1 -0.03389 0.03546 0.00000 0.02737 0.00000
112 10D+2 0.01205 -0.04942 0.00000 -0.02439 0.02439
113 10D-2 0.04766 0.01162 0.00000 -0.02737 -0.02737
114 11D 0 0.24308 0.05926 0.00000 0.04435 0.04435
115 11D+1 0.04169 0.14260 0.00000 0.00000 0.04686
116 11D-1 0.10265 -0.10741 0.00000 0.04686 0.00000
117 11D+2 -0.05926 0.24308 0.00000 -0.02561 0.02561
118 11D-2 -0.14434 -0.03519 0.00000 -0.04686 -0.04686
119 12D 0 0.40916 0.09976 0.00000 0.08691 0.08691
120 12D+1 0.05585 0.19102 0.00000 0.00000 0.10257
121 12D-1 0.13750 -0.14388 0.00000 0.10257 0.00000
122 12D+2 -0.09976 0.40916 0.00000 -0.05018 0.05018
123 12D-2 -0.19335 -0.04714 0.00000 -0.10257 -0.10257
124 13F 0 0.00713 0.00174 0.00000 -0.04095 -0.04095
125 13F+1 0.16827 0.15460 -0.16327 0.04868 -0.04843
126 13F-1 0.22054 -0.05980 0.16327 -0.04843 0.04868
127 13F+2 -0.06845 0.28076 0.20652 -0.09330 0.09330
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
129 13F+3 0.12393 0.12646 -0.12647 0.08950 -0.03751
130 13F-3 -0.16823 0.05523 -0.12647 0.03751 -0.08950
131 14F 0 -0.12124 -0.02956 0.00000 0.02461 0.02461
132 14F+1 -0.25367 -0.13672 0.07543 -0.05967 -0.03641
133 14F-1 -0.28814 0.00463 -0.07543 -0.03641 -0.05967
134 14F+2 0.08325 -0.34146 -0.09541 0.09454 -0.09454
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
136 14F+3 -0.08743 -0.22003 0.05843 -0.07735 -0.02820
137 14F-3 0.17889 -0.15509 0.05843 0.02820 0.07735
138 15G 0 0.01990 0.00485 0.00000 0.12875 0.12875
139 15G+1 -0.00138 -0.03819 0.21538 -0.19768 0.07132
140 15G-1 -0.01880 0.03327 -0.21538 0.07132 -0.19768
141 15G+2 0.00752 -0.03083 0.00000 0.11515 -0.11515
142 15G-2 -0.10178 -0.02482 0.00000 0.25597 0.25597
143 15G+3 -0.03091 -0.09306 -0.08140 0.07472 0.24669
144 15G-3 0.07027 -0.06839 -0.08140 -0.24669 -0.07472
145 15G+4 -0.02355 -0.00574 0.00000 -0.15233 -0.15233
146 15G-4 -0.00238 0.00976 0.23025 0.02051 -0.02051
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 -0.00349 0.00365 0.00000 0.01161 0.00000
153 6PY -0.00142 -0.00484 0.00000 0.00000 0.01161
154 6PZ -0.00490 -0.00119 0.00000 0.01161 0.01161
155 7PX 0.05485 -0.05739 0.00000 -0.00077 0.00000
156 7PY 0.02228 0.07620 0.00000 0.00000 -0.00077
157 7PZ 0.07713 0.01880 0.00000 -0.00077 -0.00077
158 8PX -0.42715 0.44696 0.00000 0.20909 0.00000
159 8PY -0.17351 -0.59341 0.00000 0.00000 0.20909
160 8PZ -0.60066 -0.14644 0.00000 0.20909 0.20909
161 9PX -0.10412 0.10895 0.00000 0.03987 0.00000
162 9PY -0.04229 -0.14465 0.00000 0.00000 0.03987
163 9PZ -0.14642 -0.03570 0.00000 0.03987 0.03987
164 10D 0 -0.04942 -0.01205 0.00000 -0.04225 -0.04225
165 10D+1 0.01377 0.04708 0.00000 0.00000 0.02737
166 10D-1 0.03389 -0.03546 0.00000 0.02737 0.00000
167 10D+2 0.01205 -0.04942 0.00000 0.02439 -0.02439
168 10D-2 0.04766 0.01162 0.00000 0.02737 0.02737
169 11D 0 0.24308 0.05926 0.00000 -0.04435 -0.04435
170 11D+1 -0.04169 -0.14260 0.00000 0.00000 0.04686
171 11D-1 -0.10265 0.10741 0.00000 0.04686 0.00000
172 11D+2 -0.05926 0.24308 0.00000 0.02561 -0.02561
173 11D-2 -0.14434 -0.03519 0.00000 0.04686 0.04686
174 12D 0 0.40916 0.09976 0.00000 -0.08691 -0.08691
175 12D+1 -0.05585 -0.19102 0.00000 0.00000 0.10257
176 12D-1 -0.13750 0.14388 0.00000 0.10257 0.00000
177 12D+2 -0.09976 0.40916 0.00000 0.05018 -0.05018
178 12D-2 -0.19335 -0.04714 0.00000 0.10257 0.10257
179 13F 0 0.00713 0.00174 0.00000 0.04095 0.04095
180 13F+1 -0.16827 -0.15460 0.16327 0.04868 -0.04843
181 13F-1 -0.22054 0.05980 -0.16327 -0.04843 0.04868
182 13F+2 -0.06845 0.28076 0.20652 0.09330 -0.09330
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
184 13F+3 -0.12393 -0.12646 0.12647 0.08950 -0.03751
185 13F-3 0.16823 -0.05523 0.12647 0.03751 -0.08950
186 14F 0 -0.12124 -0.02956 0.00000 -0.02461 -0.02461
187 14F+1 0.25367 0.13672 -0.07543 -0.05967 -0.03641
188 14F-1 0.28814 -0.00463 0.07543 -0.03641 -0.05967
189 14F+2 0.08325 -0.34146 -0.09541 -0.09454 0.09454
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
191 14F+3 0.08743 0.22003 -0.05843 -0.07735 -0.02820
192 14F-3 -0.17889 0.15509 -0.05843 0.02820 0.07735
193 15G 0 0.01990 0.00485 0.00000 -0.12875 -0.12875
194 15G+1 0.00138 0.03819 -0.21538 -0.19768 0.07132
195 15G-1 0.01880 -0.03327 0.21538 0.07132 -0.19768
196 15G+2 0.00752 -0.03083 0.00000 -0.11515 0.11515
197 15G-2 -0.10178 -0.02482 0.00000 -0.25597 -0.25597
198 15G+3 0.03091 0.09306 0.08140 0.07472 0.24669
199 15G-3 -0.07027 0.06839 0.08140 -0.24669 -0.07472
200 15G+4 -0.02355 -0.00574 0.00000 0.15233 0.15233
201 15G-4 -0.00238 0.00976 0.23025 -0.02051 0.02051
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212 7PZ -0.07713 -0.01880 0.00000 0.00077 -0.00077
213 8PX 0.42715 -0.44696 0.00000 -0.20909 0.00000
214 8PY -0.17351 -0.59341 0.00000 0.00000 -0.20909
215 8PZ 0.60066 0.14644 0.00000 -0.20909 0.20909
216 9PX 0.10412 -0.10895 0.00000 -0.03987 0.00000
217 9PY -0.04229 -0.14465 0.00000 0.00000 -0.03987
218 9PZ 0.14642 0.03570 0.00000 -0.03987 0.03987
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224 11D 0 0.24308 0.05926 0.00000 -0.04435 0.04435
225 11D+1 -0.04169 -0.14260 0.00000 0.00000 -0.04686
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228 11D-2 0.14434 0.03519 0.00000 -0.04686 0.04686
229 12D 0 0.40916 0.09976 0.00000 -0.08691 0.08691
230 12D+1 -0.05585 -0.19102 0.00000 0.00000 -0.10257
231 12D-1 0.13750 -0.14388 0.00000 -0.10257 0.00000
232 12D+2 -0.09976 0.40916 0.00000 0.05018 0.05018
233 12D-2 0.19335 0.04714 0.00000 -0.10257 0.10257
234 13F 0 -0.00713 -0.00174 0.00000 -0.04095 0.04095
235 13F+1 0.16827 0.15460 -0.16327 -0.04868 -0.04843
236 13F-1 -0.22054 0.05980 -0.16327 -0.04843 -0.04868
237 13F+2 0.06845 -0.28076 -0.20652 -0.09330 -0.09330
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
239 13F+3 0.12393 0.12646 -0.12647 -0.08950 -0.03751
240 13F-3 0.16823 -0.05523 0.12647 0.03751 0.08950
241 14F 0 0.12124 0.02956 0.00000 0.02461 -0.02461
242 14F+1 -0.25367 -0.13672 0.07543 0.05967 -0.03641
243 14F-1 0.28814 -0.00463 0.07543 -0.03641 0.05967
244 14F+2 -0.08325 0.34146 0.09541 0.09454 0.09454
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
246 14F+3 -0.08743 -0.22003 0.05843 0.07735 -0.02820
247 14F-3 -0.17889 0.15509 -0.05843 0.02820 -0.07735
248 15G 0 0.01990 0.00485 0.00000 -0.12875 0.12875
249 15G+1 0.00138 0.03819 -0.21538 -0.19768 -0.07132
250 15G-1 -0.01880 0.03327 -0.21538 -0.07132 -0.19768
251 15G+2 0.00752 -0.03083 0.00000 -0.11515 -0.11515
252 15G-2 0.10178 0.02482 0.00000 0.25597 -0.25597
253 15G+3 0.03091 0.09306 0.08140 0.07472 -0.24669
254 15G-3 0.07027 -0.06839 -0.08140 0.24669 -0.07472
255 15G+4 -0.02355 -0.00574 0.00000 0.15233 -0.15233
256 15G-4 0.00238 -0.00976 -0.23025 0.02051 0.02051
257 5 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
258 2S 0.00000 0.00000 0.00000 0.00000 0.00000
259 3S 0.00000 0.00000 0.00000 0.00000 0.00000
260 4S 0.00000 0.00000 0.00000 0.00000 0.00000
261 5S 0.00000 0.00000 0.00000 0.00000 0.00000
262 6PX -0.00349 0.00365 0.00000 -0.01161 0.00000
263 6PY 0.00142 0.00484 0.00000 0.00000 -0.01161
264 6PZ 0.00490 0.00119 0.00000 0.01161 -0.01161
265 7PX 0.05485 -0.05739 0.00000 0.00077 0.00000
266 7PY -0.02228 -0.07620 0.00000 0.00000 0.00077
267 7PZ -0.07713 -0.01880 0.00000 -0.00077 0.00077
268 8PX -0.42715 0.44696 0.00000 -0.20909 0.00000
269 8PY 0.17351 0.59341 0.00000 0.00000 -0.20909
270 8PZ 0.60066 0.14644 0.00000 0.20909 -0.20909
271 9PX -0.10412 0.10895 0.00000 -0.03987 0.00000
272 9PY 0.04229 0.14465 0.00000 0.00000 -0.03987
273 9PZ 0.14642 0.03570 0.00000 0.03987 -0.03987
274 10D 0 -0.04942 -0.01205 0.00000 0.04225 -0.04225
275 10D+1 -0.01377 -0.04708 0.00000 0.00000 -0.02737
276 10D-1 0.03389 -0.03546 0.00000 -0.02737 0.00000
277 10D+2 0.01205 -0.04942 0.00000 -0.02439 -0.02439
278 10D-2 -0.04766 -0.01162 0.00000 0.02737 -0.02737
279 11D 0 0.24308 0.05926 0.00000 0.04435 -0.04435
280 11D+1 0.04169 0.14260 0.00000 0.00000 -0.04686
281 11D-1 -0.10265 0.10741 0.00000 -0.04686 0.00000
282 11D+2 -0.05926 0.24308 0.00000 -0.02561 -0.02561
283 11D-2 0.14434 0.03519 0.00000 0.04686 -0.04686
284 12D 0 0.40916 0.09976 0.00000 0.08691 -0.08691
285 12D+1 0.05585 0.19102 0.00000 0.00000 -0.10257
286 12D-1 -0.13750 0.14388 0.00000 -0.10257 0.00000
287 12D+2 -0.09976 0.40916 0.00000 -0.05018 -0.05018
288 12D-2 0.19335 0.04714 0.00000 0.10257 -0.10257
289 13F 0 -0.00713 -0.00174 0.00000 0.04095 -0.04095
290 13F+1 -0.16827 -0.15460 0.16327 -0.04868 -0.04843
291 13F-1 0.22054 -0.05980 0.16327 -0.04843 -0.04868
292 13F+2 0.06845 -0.28076 -0.20652 0.09330 0.09330
293 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
294 13F+3 -0.12393 -0.12646 0.12647 -0.08950 -0.03751
295 13F-3 -0.16823 0.05523 -0.12647 0.03751 0.08950
296 14F 0 0.12124 0.02956 0.00000 -0.02461 0.02461
297 14F+1 0.25367 0.13672 -0.07543 0.05967 -0.03641
298 14F-1 -0.28814 0.00463 -0.07543 -0.03641 0.05967
299 14F+2 -0.08325 0.34146 0.09541 -0.09454 -0.09454
300 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
301 14F+3 0.08743 0.22003 -0.05843 0.07735 -0.02820
302 14F-3 0.17889 -0.15509 0.05843 0.02820 -0.07735
303 15G 0 0.01990 0.00485 0.00000 0.12875 -0.12875
304 15G+1 -0.00138 -0.03819 0.21538 -0.19768 -0.07132
305 15G-1 0.01880 -0.03327 0.21538 -0.07132 -0.19768
306 15G+2 0.00752 -0.03083 0.00000 0.11515 0.11515
307 15G-2 0.10178 0.02482 0.00000 -0.25597 0.25597
308 15G+3 -0.03091 -0.09306 -0.08140 0.07472 -0.24669
309 15G-3 -0.07027 0.06839 0.08140 0.24669 -0.07472
310 15G+4 -0.02355 -0.00574 0.00000 -0.15233 0.15233
311 15G-4 0.00238 -0.00976 -0.23025 -0.02051 -0.02051
211 212 213 214 215
(T1)--V (T2)--V (T2)--V (T2)--V (E)--V
Eigenvalues -- 12.73205 12.76250 12.76250 12.76250 12.81222
1 1 C 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 -0.07438 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 -0.07438 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 -0.07438 0.00000
10 8PX 0.00000 0.52336 0.00000 0.00000 0.00000
11 8PY 0.00000 0.00000 0.52336 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.52336 0.00000
13 9PX 0.00000 -0.77300 0.00000 0.00000 0.00000
14 9PY 0.00000 0.00000 -0.77300 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 -0.77300 0.00000
16 10PX 0.00000 -0.33103 0.00000 0.00000 0.00000
17 10PY 0.00000 0.00000 -0.33103 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 -0.33103 0.00000
19 11PX 0.00000 0.00318 0.00000 0.00000 0.00000
20 11PY 0.00000 0.00000 0.00318 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00318 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.27457
23 12D+1 0.00000 0.00000 -0.29178 0.00000 0.00000
24 12D-1 0.00000 -0.29178 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.17567
26 12D-2 0.00000 0.00000 0.00000 -0.29178 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.28790
28 13D+1 0.00000 0.00000 0.43375 0.00000 0.00000
29 13D-1 0.00000 0.43375 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 -0.18420
31 13D-2 0.00000 0.00000 0.00000 0.43375 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.44379
33 14D+1 0.00000 0.00000 1.68393 0.00000 0.00000
34 14D-1 0.00000 1.68393 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 -0.28394
36 14D-2 0.00000 0.00000 0.00000 1.68393 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.03745
38 15D+1 0.00000 0.00000 -0.00857 0.00000 0.00000
39 15D-1 0.00000 -0.00857 0.00000 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 -0.02396
41 15D-2 0.00000 0.00000 0.00000 -0.00857 0.00000
42 16F 0 0.00000 0.00000 0.00000 0.15177 0.00000
43 16F+1 0.00000 -0.09294 0.00000 0.00000 0.00000
44 16F-1 0.00000 0.00000 -0.09294 0.00000 0.00000
45 16F+2 -0.11386 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 0.11998 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.00000 -0.11998 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 -0.64672 0.00000
50 17F+1 0.00000 0.39603 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.39603 0.00000 0.00000
52 17F+2 0.53012 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 -0.51128 0.00000 0.00000 0.00000
55 17F-3 0.00000 0.00000 0.51128 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.08587 0.00000
57 18F+1 0.00000 -0.05258 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.00000 -0.05258 0.00000 0.00000
59 18F+2 0.05663 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 0.06789 0.00000 0.00000 0.00000
62 18F-3 0.00000 0.00000 -0.06789 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.05726
64 19G+1 0.00000 0.00000 -0.02010 0.00000 0.00000
65 19G-1 0.00000 -0.02010 0.00000 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.05675
67 19G-2 0.00000 0.00000 0.00000 0.05684 0.00000
68 19G+3 0.00000 0.00000 -0.05317 0.00000 0.00000
69 19G-3 0.00000 0.05317 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 0.00000 -0.06775
71 19G-4 -0.06236 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 0.00000 -0.27060
73 20G+1 0.00000 0.00000 0.19030 0.00000 0.00000
74 20G-1 0.00000 0.19030 0.00000 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 -0.26822
76 20G-2 0.00000 0.00000 0.00000 -0.53826 0.00000
77 20G+3 0.00000 0.00000 0.50350 0.00000 0.00000
78 20G-3 0.00000 -0.50350 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.32018
80 20G-4 0.37070 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.18794 0.00000
82 21H+1 0.00000 0.03686 0.00000 0.00000 0.00000
83 21H-1 0.00000 0.00000 0.03686 0.00000 0.00000
84 21H+2 -0.06778 0.00000 0.00000 0.00000 0.00000
85 21H-2 0.00000 0.00000 0.00000 0.00000 -0.01095
86 21H+3 0.00000 -0.17344 0.00000 0.00000 0.00000
87 21H-3 0.00000 0.00000 0.17344 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 -0.09449 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00701
90 21H+5 0.00000 0.11318 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.00000 0.11318 0.00000 0.00000
92 2 H 1S 0.00000 -0.01125 -0.01125 -0.01125 0.00000
93 2S 0.00000 0.17420 0.17420 0.17420 0.00000
94 3S 0.00000 -0.74693 -0.74693 -0.74693 0.00000
95 4S 0.00000 0.02361 0.02361 0.02361 0.00000
96 5S 0.00000 -0.04180 -0.04180 -0.04180 0.00000
97 6PX -0.01161 -0.01661 -0.01814 -0.01814 0.00550
98 6PY 0.01161 -0.01814 -0.01661 -0.01814 -0.00028
99 6PZ 0.00000 -0.01814 -0.01814 -0.01661 -0.00522
100 7PX 0.00077 -0.01272 0.00541 0.00541 -0.02080
101 7PY -0.00077 0.00541 -0.01272 0.00541 0.00107
102 7PZ 0.00000 0.00541 0.00541 -0.01272 0.01974
103 8PX -0.20909 0.82144 0.01519 0.01519 0.21312
104 8PY 0.20909 0.01519 0.82144 0.01519 -0.01094
105 8PZ 0.00000 0.01519 0.01519 0.82144 -0.20219
106 9PX -0.03987 0.21568 0.00288 0.00288 0.05344
107 9PY 0.03987 0.00288 0.21568 0.00288 -0.00274
108 9PZ 0.00000 0.00288 0.00288 0.21568 -0.05070
109 10D 0 0.00000 0.00412 0.00412 -0.00823 0.12569
110 10D+1 0.02737 0.02627 0.06450 0.02627 0.00193
111 10D-1 -0.02737 0.06450 0.02627 0.02627 -0.03761
112 10D+2 0.04878 -0.00713 0.00713 0.00000 -0.08042
113 10D-2 0.00000 0.02627 0.02627 0.06450 0.03568
114 11D 0 0.00000 0.09167 0.09167 -0.18333 -0.00773
115 11D+1 0.04686 -0.13715 0.00151 -0.13715 -0.00132
116 11D-1 -0.04686 0.00151 -0.13715 -0.13715 0.02568
117 11D+2 0.05122 -0.15877 0.15877 0.00000 0.00495
118 11D-2 0.00000 -0.13715 -0.13715 0.00151 -0.02436
119 12D 0 0.00000 0.18423 0.18423 -0.36845 0.20070
120 12D+1 0.10257 -0.12525 0.04664 -0.12525 -0.00020
121 12D-1 -0.10257 0.04664 -0.12525 -0.12525 0.00381
122 12D+2 0.10036 -0.31909 0.31909 0.00000 -0.12841
123 12D-2 0.00000 -0.12525 -0.12525 0.04664 -0.00362
124 13F 0 0.00000 0.11811 0.11811 -0.08069 0.00926
125 13F+1 0.09883 0.04941 -0.06658 -0.07808 0.01010
126 13F-1 -0.09883 -0.06658 0.04941 -0.07808 0.00865
127 13F+2 -0.06126 -0.00727 0.00727 0.00000 -0.00611
128 13F-2 0.00000 -0.07315 -0.07315 -0.07315 0.00000
129 13F+3 0.02476 -0.06379 0.09783 0.08892 -0.00452
130 13F-3 0.02476 -0.09783 0.06379 -0.08892 -0.00733
131 14F 0 0.00000 -0.11597 -0.11597 0.11141 -0.08848
132 14F+1 -0.08981 -0.06822 -0.01864 0.16068 -0.07141
133 14F-1 0.08981 -0.01864 -0.06822 0.16068 -0.02811
134 14F+2 -0.04605 0.11341 -0.11341 0.00000 0.02118
135 14F-2 0.00000 0.07208 0.07208 0.07208 0.00000
136 14F+3 -0.03843 0.08807 -0.16114 -0.02223 0.06266
137 14F-3 -0.03843 0.16114 -0.08807 0.02223 0.02783
138 15G 0 0.00000 0.01101 0.01101 0.29533 0.12859
139 15G+1 0.10968 0.14466 -0.08479 -0.07846 -0.18921
140 15G-1 -0.10968 -0.08479 0.14466 -0.07846 0.00084
141 15G+2 -0.23031 -0.25431 0.25431 0.00000 0.12746
142 15G-2 0.00000 -0.09362 -0.09362 0.23981 0.23059
143 15G+3 0.23219 0.04540 -0.22433 0.12974 0.05818
144 15G-3 0.23219 0.22433 -0.04540 -0.12974 -0.25953
145 15G+4 0.00000 0.20154 0.20154 -0.13488 -0.15215
146 15G-4 -0.21133 -0.11927 0.11927 0.00000 0.10658
147 3 H 1S 0.00000 0.01125 0.01125 -0.01125 0.00000
148 2S 0.00000 -0.17420 -0.17420 0.17420 0.00000
149 3S 0.00000 0.74693 0.74693 -0.74693 0.00000
150 4S 0.00000 -0.02361 -0.02361 0.02361 0.00000
151 5S 0.00000 0.04180 0.04180 -0.04180 0.00000
152 6PX 0.01161 -0.01661 -0.01814 0.01814 -0.00550
153 6PY -0.01161 -0.01814 -0.01661 0.01814 0.00028
154 6PZ 0.00000 0.01814 0.01814 -0.01661 -0.00522
155 7PX -0.00077 -0.01272 0.00541 -0.00541 0.02080
156 7PY 0.00077 0.00541 -0.01272 -0.00541 -0.00107
157 7PZ 0.00000 -0.00541 -0.00541 -0.01272 0.01974
158 8PX 0.20909 0.82144 0.01519 -0.01519 -0.21312
159 8PY -0.20909 0.01519 0.82144 -0.01519 0.01094
160 8PZ 0.00000 -0.01519 -0.01519 0.82144 -0.20219
161 9PX 0.03987 0.21568 0.00288 -0.00288 -0.05344
162 9PY -0.03987 0.00288 0.21568 -0.00288 0.00274
163 9PZ 0.00000 -0.00288 -0.00288 0.21568 -0.05070
164 10D 0 0.00000 -0.00412 -0.00412 -0.00823 0.12569
165 10D+1 -0.02737 0.02627 0.06450 -0.02627 -0.00193
166 10D-1 0.02737 0.06450 0.02627 -0.02627 0.03761
167 10D+2 0.04878 0.00713 -0.00713 0.00000 -0.08042
168 10D-2 0.00000 -0.02627 -0.02627 0.06450 0.03568
169 11D 0 0.00000 -0.09167 -0.09167 -0.18333 -0.00773
170 11D+1 -0.04686 -0.13715 0.00151 0.13715 0.00132
171 11D-1 0.04686 0.00151 -0.13715 0.13715 -0.02568
172 11D+2 0.05122 0.15877 -0.15877 0.00000 0.00495
173 11D-2 0.00000 0.13715 0.13715 0.00151 -0.02436
174 12D 0 0.00000 -0.18423 -0.18423 -0.36845 0.20070
175 12D+1 -0.10257 -0.12525 0.04664 0.12525 0.00020
176 12D-1 0.10257 0.04664 -0.12525 0.12525 -0.00381
177 12D+2 0.10036 0.31909 -0.31909 0.00000 -0.12841
178 12D-2 0.00000 0.12525 0.12525 0.04664 -0.00362
179 13F 0 0.00000 -0.11811 -0.11811 -0.08069 0.00926
180 13F+1 -0.09883 0.04941 -0.06658 0.07808 -0.01010
181 13F-1 0.09883 -0.06658 0.04941 0.07808 -0.00865
182 13F+2 -0.06126 0.00727 -0.00727 0.00000 -0.00611
183 13F-2 0.00000 0.07315 0.07315 -0.07315 0.00000
184 13F+3 -0.02476 -0.06379 0.09783 -0.08892 0.00452
185 13F-3 -0.02476 -0.09783 0.06379 0.08892 0.00733
186 14F 0 0.00000 0.11597 0.11597 0.11141 -0.08848
187 14F+1 0.08981 -0.06822 -0.01864 -0.16068 0.07141
188 14F-1 -0.08981 -0.01864 -0.06822 -0.16068 0.02811
189 14F+2 -0.04605 -0.11341 0.11341 0.00000 0.02118
190 14F-2 0.00000 -0.07208 -0.07208 0.07208 0.00000
191 14F+3 0.03843 0.08807 -0.16114 0.02223 -0.06266
192 14F-3 0.03843 0.16114 -0.08807 -0.02223 -0.02783
193 15G 0 0.00000 -0.01101 -0.01101 0.29533 0.12859
194 15G+1 -0.10968 0.14466 -0.08479 0.07846 0.18921
195 15G-1 0.10968 -0.08479 0.14466 0.07846 -0.00084
196 15G+2 -0.23031 0.25431 -0.25431 0.00000 0.12746
197 15G-2 0.00000 0.09362 0.09362 0.23981 0.23059
198 15G+3 -0.23219 0.04540 -0.22433 -0.12974 -0.05818
199 15G-3 -0.23219 0.22433 -0.04540 0.12974 0.25953
200 15G+4 0.00000 -0.20154 -0.20154 -0.13488 -0.15215
201 15G-4 -0.21133 0.11927 -0.11927 0.00000 0.10658
202 4 H 1S 0.00000 -0.01125 0.01125 0.01125 0.00000
203 2S 0.00000 0.17420 -0.17420 -0.17420 0.00000
204 3S 0.00000 -0.74693 0.74693 0.74693 0.00000
205 4S 0.00000 0.02361 -0.02361 -0.02361 0.00000
206 5S 0.00000 -0.04180 0.04180 0.04180 0.00000
207 6PX 0.01161 -0.01661 0.01814 0.01814 0.00550
208 6PY 0.01161 0.01814 -0.01661 -0.01814 0.00028
209 6PZ 0.00000 0.01814 -0.01814 -0.01661 0.00522
210 7PX -0.00077 -0.01272 -0.00541 -0.00541 -0.02080
211 7PY -0.00077 -0.00541 -0.01272 0.00541 -0.00107
212 7PZ 0.00000 -0.00541 0.00541 -0.01272 -0.01974
213 8PX 0.20909 0.82144 -0.01519 -0.01519 0.21312
214 8PY 0.20909 -0.01519 0.82144 0.01519 0.01094
215 8PZ 0.00000 -0.01519 0.01519 0.82144 0.20219
216 9PX 0.03987 0.21568 -0.00288 -0.00288 0.05344
217 9PY 0.03987 -0.00288 0.21568 0.00288 0.00274
218 9PZ 0.00000 -0.00288 0.00288 0.21568 0.05070
219 10D 0 0.00000 0.00412 -0.00412 0.00823 0.12569
220 10D+1 0.02737 -0.02627 0.06450 0.02627 -0.00193
221 10D-1 0.02737 0.06450 -0.02627 -0.02627 -0.03761
222 10D+2 -0.04878 -0.00713 -0.00713 0.00000 -0.08042
223 10D-2 0.00000 -0.02627 0.02627 0.06450 -0.03568
224 11D 0 0.00000 0.09167 -0.09167 0.18333 -0.00773
225 11D+1 0.04686 0.13715 0.00151 -0.13715 0.00132
226 11D-1 0.04686 0.00151 0.13715 0.13715 0.02568
227 11D+2 -0.05122 -0.15877 -0.15877 0.00000 0.00495
228 11D-2 0.00000 0.13715 -0.13715 0.00151 0.02436
229 12D 0 0.00000 0.18423 -0.18423 0.36845 0.20070
230 12D+1 0.10257 0.12525 0.04664 -0.12525 0.00020
231 12D-1 0.10257 0.04664 0.12525 0.12525 0.00381
232 12D+2 -0.10036 -0.31909 -0.31909 0.00000 -0.12841
233 12D-2 0.00000 0.12525 -0.12525 0.04664 0.00362
234 13F 0 0.00000 -0.11811 0.11811 -0.08069 -0.00926
235 13F+1 -0.09883 0.04941 0.06658 0.07808 0.01010
236 13F-1 -0.09883 0.06658 0.04941 -0.07808 -0.00865
237 13F+2 -0.06126 0.00727 0.00727 0.00000 0.00611
238 13F-2 0.00000 -0.07315 0.07315 0.07315 0.00000
239 13F+3 -0.02476 -0.06379 -0.09783 -0.08892 -0.00452
240 13F-3 0.02476 0.09783 0.06379 -0.08892 0.00733
241 14F 0 0.00000 0.11597 -0.11597 0.11141 0.08848
242 14F+1 0.08981 -0.06822 0.01864 -0.16068 -0.07141
243 14F-1 0.08981 0.01864 -0.06822 0.16068 0.02811
244 14F+2 -0.04605 -0.11341 -0.11341 0.00000 -0.02118
245 14F-2 0.00000 0.07208 -0.07208 -0.07208 0.00000
246 14F+3 0.03843 0.08807 0.16114 0.02223 0.06266
247 14F-3 -0.03843 -0.16114 -0.08807 0.02223 -0.02783
248 15G 0 0.00000 0.01101 -0.01101 -0.29533 0.12859
249 15G+1 0.10968 -0.14466 -0.08479 -0.07846 0.18921
250 15G-1 0.10968 -0.08479 -0.14466 0.07846 0.00084
251 15G+2 0.23031 -0.25431 -0.25431 0.00000 0.12746
252 15G-2 0.00000 0.09362 -0.09362 0.23981 -0.23059
253 15G+3 0.23219 -0.04540 -0.22433 0.12974 -0.05818
254 15G-3 -0.23219 0.22433 0.04540 0.12974 -0.25953
255 15G+4 0.00000 0.20154 -0.20154 0.13488 -0.15215
256 15G-4 -0.21133 0.11927 0.11927 0.00000 -0.10658
257 5 H 1S 0.00000 0.01125 -0.01125 0.01125 0.00000
258 2S 0.00000 -0.17420 0.17420 -0.17420 0.00000
259 3S 0.00000 0.74693 -0.74693 0.74693 0.00000
260 4S 0.00000 -0.02361 0.02361 -0.02361 0.00000
261 5S 0.00000 0.04180 -0.04180 0.04180 0.00000
262 6PX -0.01161 -0.01661 0.01814 -0.01814 -0.00550
263 6PY -0.01161 0.01814 -0.01661 0.01814 -0.00028
264 6PZ 0.00000 -0.01814 0.01814 -0.01661 0.00522
265 7PX 0.00077 -0.01272 -0.00541 0.00541 0.02080
266 7PY 0.00077 -0.00541 -0.01272 -0.00541 0.00107
267 7PZ 0.00000 0.00541 -0.00541 -0.01272 -0.01974
268 8PX -0.20909 0.82144 -0.01519 0.01519 -0.21312
269 8PY -0.20909 -0.01519 0.82144 -0.01519 -0.01094
270 8PZ 0.00000 0.01519 -0.01519 0.82144 0.20219
271 9PX -0.03987 0.21568 -0.00288 0.00288 -0.05344
272 9PY -0.03987 -0.00288 0.21568 -0.00288 -0.00274
273 9PZ 0.00000 0.00288 -0.00288 0.21568 0.05070
274 10D 0 0.00000 -0.00412 0.00412 0.00823 0.12569
275 10D+1 -0.02737 -0.02627 0.06450 -0.02627 0.00193
276 10D-1 -0.02737 0.06450 -0.02627 0.02627 0.03761
277 10D+2 -0.04878 0.00713 0.00713 0.00000 -0.08042
278 10D-2 0.00000 0.02627 -0.02627 0.06450 -0.03568
279 11D 0 0.00000 -0.09167 0.09167 0.18333 -0.00773
280 11D+1 -0.04686 0.13715 0.00151 0.13715 -0.00132
281 11D-1 -0.04686 0.00151 0.13715 -0.13715 -0.02568
282 11D+2 -0.05122 0.15877 0.15877 0.00000 0.00495
283 11D-2 0.00000 -0.13715 0.13715 0.00151 0.02436
284 12D 0 0.00000 -0.18423 0.18423 0.36845 0.20070
285 12D+1 -0.10257 0.12525 0.04664 0.12525 -0.00020
286 12D-1 -0.10257 0.04664 0.12525 -0.12525 -0.00381
287 12D+2 -0.10036 0.31909 0.31909 0.00000 -0.12841
288 12D-2 0.00000 -0.12525 0.12525 0.04664 0.00362
289 13F 0 0.00000 0.11811 -0.11811 -0.08069 -0.00926
290 13F+1 0.09883 0.04941 0.06658 -0.07808 -0.01010
291 13F-1 0.09883 0.06658 0.04941 0.07808 0.00865
292 13F+2 -0.06126 -0.00727 -0.00727 0.00000 0.00611
293 13F-2 0.00000 0.07315 -0.07315 0.07315 0.00000
294 13F+3 0.02476 -0.06379 -0.09783 0.08892 0.00452
295 13F-3 -0.02476 0.09783 0.06379 0.08892 -0.00733
296 14F 0 0.00000 -0.11597 0.11597 0.11141 0.08848
297 14F+1 -0.08981 -0.06822 0.01864 0.16068 0.07141
298 14F-1 -0.08981 0.01864 -0.06822 -0.16068 -0.02811
299 14F+2 -0.04605 0.11341 0.11341 0.00000 -0.02118
300 14F-2 0.00000 -0.07208 0.07208 -0.07208 0.00000
301 14F+3 -0.03843 0.08807 0.16114 -0.02223 -0.06266
302 14F-3 0.03843 -0.16114 -0.08807 -0.02223 0.02783
303 15G 0 0.00000 -0.01101 0.01101 -0.29533 0.12859
304 15G+1 -0.10968 -0.14466 -0.08479 0.07846 -0.18921
305 15G-1 -0.10968 -0.08479 -0.14466 -0.07846 -0.00084
306 15G+2 0.23031 0.25431 0.25431 0.00000 0.12746
307 15G-2 0.00000 -0.09362 0.09362 0.23981 -0.23059
308 15G+3 -0.23219 -0.04540 -0.22433 -0.12974 0.05818
309 15G-3 0.23219 0.22433 0.04540 -0.12974 0.25953
310 15G+4 0.00000 -0.20154 0.20154 0.13488 -0.15215
311 15G-4 -0.21133 -0.11927 -0.11927 0.00000 -0.10658
216 217 218 219 220
(E)--V (T1)--V (T1)--V (T1)--V (T2)--V
Eigenvalues -- 12.81222 12.86299 12.86299 12.86299 12.95448
1 1 C 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 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 0.00000 0.30375
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 -1.22719
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 -0.67943
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 -1.87098
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 -0.06816
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
22 12D 0 -0.17567 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.46318
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
25 12D+2 -0.27457 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.18420 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 0.00000 -0.94909
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.28790 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.28394 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 0.00000 -2.53066
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.44379 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15D 0 0.02396 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 0.00000 0.00000 -0.97404
39 15D-1 0.00000 0.00000 0.00000 0.00000 0.00000
40 15D+2 0.03745 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 -0.09940 0.00000 0.00000 0.00000
44 16F-1 0.00000 0.00000 -0.09940 0.00000 0.08901
45 16F+2 0.00000 0.00000 0.00000 -0.12573 0.00000
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00000 -0.07699 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.00000 0.07699 0.00000 0.11492
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.23593 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.23593 0.00000 -0.50675
52 17F+2 0.00000 0.00000 0.00000 0.29843 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.00000 0.18275 0.00000 0.00000 0.00000
55 17F-3 0.00000 0.00000 -0.18275 0.00000 -0.65421
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.72490 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.00000 0.72490 0.00000 -0.50406
59 18F+2 0.00000 0.00000 0.00000 0.91693 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.00000 0.56150 0.00000 0.00000 0.00000
62 18F-3 0.00000 0.00000 -0.56150 0.00000 -0.65073
63 19G 0 0.03663 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.08272 0.00000 0.04154
65 19G-1 0.00000 0.08272 0.00000 0.00000 0.00000
66 19G+2 -0.08870 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 -0.03127 0.00000 0.10991
69 19G-3 0.00000 0.03127 0.00000 0.00000 0.00000
70 19G+4 -0.04334 0.00000 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.08843 0.00000
72 20G 0 -0.17313 0.00000 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 -0.02296 0.00000 -0.24208
74 20G-1 0.00000 -0.02296 0.00000 0.00000 0.00000
75 20G+2 0.41922 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 0.00868 0.00000 -0.64047
78 20G-3 0.00000 -0.00868 0.00000 0.00000 0.00000
79 20G+4 0.20486 0.00000 0.00000 0.00000 0.00000
80 20G-4 0.00000 0.00000 0.00000 -0.02454 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.00000 -0.05102 0.00000 0.00000 0.00000
83 21H-1 0.00000 0.00000 -0.05102 0.00000 -0.15480
84 21H+2 0.00000 0.00000 0.00000 0.07714 0.00000
85 21H-2 -0.00701 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.00000 0.02362 0.00000 0.00000 0.00000
87 21H-3 0.00000 0.00000 -0.02362 0.00000 -0.12424
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
89 21H-4 -0.01095 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00000 0.05281 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.00000 0.05281 0.00000 -0.20511
92 2 H 1S 0.00000 0.00000 0.00000 0.00000 0.09284
93 2S 0.00000 0.00000 0.00000 0.00000 -0.65445
94 3S 0.00000 0.00000 0.00000 0.00000 2.63120
95 4S 0.00000 0.00000 0.00000 0.00000 1.52862
96 5S 0.00000 0.00000 0.00000 0.00000 0.00546
97 6PX -0.00285 0.00000 -0.02368 0.02368 -0.00010
98 6PY 0.00619 -0.02368 0.00000 -0.02368 0.00736
99 6PZ -0.00334 0.02368 0.02368 0.00000 -0.00010
100 7PX 0.01078 0.00000 -0.05443 0.05443 0.09122
101 7PY -0.02341 -0.05443 0.00000 -0.05443 0.11737
102 7PZ 0.01263 0.05443 0.05443 0.00000 0.09122
103 8PX -0.11042 0.00000 0.34830 -0.34830 -0.43505
104 8PY 0.23978 0.34830 0.00000 0.34830 -1.54199
105 8PZ -0.12936 -0.34830 -0.34830 0.00000 -0.43505
106 9PX -0.02769 0.00000 0.20721 -0.20721 -0.37050
107 9PY 0.06013 0.20721 0.00000 0.20721 -0.70163
108 9PZ -0.03244 -0.20721 -0.20721 0.00000 -0.37050
109 10D 0 0.08042 -0.04928 -0.04928 0.00000 0.00090
110 10D+1 -0.04232 0.01329 0.00000 0.01329 -0.01894
111 10D-1 0.01949 0.00000 0.01329 -0.01329 -0.04804
112 10D+2 0.12569 -0.02845 0.02845 -0.05690 0.00155
113 10D-2 0.02283 -0.01329 -0.01329 0.00000 -0.04804
114 11D 0 -0.00495 0.06781 0.06781 0.00000 -0.11484
115 11D+1 0.02889 0.00273 0.00000 0.00273 0.01671
116 11D-1 -0.01331 0.00000 0.00273 -0.00273 0.24507
117 11D+2 -0.00773 0.03915 -0.03915 0.07830 -0.19891
118 11D-2 -0.01559 -0.00273 -0.00273 0.00000 0.24507
119 12D 0 0.12841 0.25129 0.25129 0.00000 -0.15565
120 12D+1 0.00429 0.03657 0.00000 0.03657 0.01728
121 12D-1 -0.00198 0.00000 0.03657 -0.03657 0.41958
122 12D+2 0.20070 0.14508 -0.14508 0.29016 -0.26960
123 12D-2 -0.00232 -0.03657 -0.03657 0.00000 0.41958
124 13F 0 0.00592 0.13395 0.13395 0.00000 0.17502
125 13F+1 0.00487 0.29899 -0.12478 -0.28884 -0.21984
126 13F-1 0.00713 -0.12478 0.29899 0.28884 -0.11485
127 13F+2 0.00955 -0.26160 0.26160 0.37820 -0.14251
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.41722
129 13F+3 0.01016 0.23160 -0.26609 -0.05430 0.05109
130 13F-3 0.00836 0.26609 -0.23160 -0.05430 -0.14827
131 14F 0 -0.05661 -0.12063 -0.12063 0.00000 -0.00659
132 14F+1 0.00200 -0.17573 0.02885 0.17659 0.17402
133 14F-1 -0.06567 0.02885 -0.17573 -0.17659 0.04299
134 14F+2 -0.03311 0.12993 -0.12993 -0.22229 0.21502
135 14F-2 0.00000 0.00000 0.00000 0.00000 -0.36562
136 14F+3 -0.05957 -0.13612 0.17494 -0.01580 0.12646
137 14F-3 -0.08186 -0.17494 0.13612 -0.01580 0.05550
138 15G 0 0.08227 0.00190 0.00190 0.00000 -0.00045
139 15G+1 0.08826 -0.02974 -0.01118 0.10219 -0.03760
140 15G-1 -0.20878 -0.01118 -0.02974 -0.10219 0.01101
141 15G+2 -0.19921 -0.00170 0.00170 -0.00340 -0.02038
142 15G-2 0.14754 0.10245 0.10245 0.00000 -0.01901
143 15G+3 0.25899 0.12077 0.00423 0.07090 -0.09947
144 15G-3 0.05572 -0.00423 -0.12077 0.07090 -0.01616
145 15G+4 -0.09735 -0.00225 -0.00225 0.00000 -0.01578
146 15G-4 -0.16658 -0.07052 0.07052 -0.01195 0.00458
147 3 H 1S 0.00000 0.00000 0.00000 0.00000 -0.09284
148 2S 0.00000 0.00000 0.00000 0.00000 0.65445
149 3S 0.00000 0.00000 0.00000 0.00000 -2.63120
150 4S 0.00000 0.00000 0.00000 0.00000 -1.52862
151 5S 0.00000 0.00000 0.00000 0.00000 -0.00546
152 6PX 0.00285 0.00000 -0.02368 -0.02368 -0.00010
153 6PY -0.00619 -0.02368 0.00000 0.02368 0.00736
154 6PZ -0.00334 -0.02368 -0.02368 0.00000 0.00010
155 7PX -0.01078 0.00000 -0.05443 -0.05443 0.09122
156 7PY 0.02341 -0.05443 0.00000 0.05443 0.11737
157 7PZ 0.01263 -0.05443 -0.05443 0.00000 -0.09122
158 8PX 0.11042 0.00000 0.34830 0.34830 -0.43505
159 8PY -0.23978 0.34830 0.00000 -0.34830 -1.54199
160 8PZ -0.12936 0.34830 0.34830 0.00000 0.43505
161 9PX 0.02769 0.00000 0.20721 0.20721 -0.37050
162 9PY -0.06013 0.20721 0.00000 -0.20721 -0.70163
163 9PZ -0.03244 0.20721 0.20721 0.00000 0.37050
164 10D 0 0.08042 0.04928 0.04928 0.00000 -0.00090
165 10D+1 0.04232 0.01329 0.00000 -0.01329 -0.01894
166 10D-1 -0.01949 0.00000 0.01329 0.01329 -0.04804
167 10D+2 0.12569 0.02845 -0.02845 -0.05690 -0.00155
168 10D-2 0.02283 0.01329 0.01329 0.00000 0.04804
169 11D 0 -0.00495 -0.06781 -0.06781 0.00000 0.11484
170 11D+1 -0.02889 0.00273 0.00000 -0.00273 0.01671
171 11D-1 0.01331 0.00000 0.00273 0.00273 0.24507
172 11D+2 -0.00773 -0.03915 0.03915 0.07830 0.19891
173 11D-2 -0.01559 0.00273 0.00273 0.00000 -0.24507
174 12D 0 0.12841 -0.25129 -0.25129 0.00000 0.15565
175 12D+1 -0.00429 0.03657 0.00000 -0.03657 0.01728
176 12D-1 0.00198 0.00000 0.03657 0.03657 0.41958
177 12D+2 0.20070 -0.14508 0.14508 0.29016 0.26960
178 12D-2 -0.00232 0.03657 0.03657 0.00000 -0.41958
179 13F 0 0.00592 -0.13395 -0.13395 0.00000 -0.17502
180 13F+1 -0.00487 0.29899 -0.12478 0.28884 -0.21984
181 13F-1 -0.00713 -0.12478 0.29899 -0.28884 -0.11485
182 13F+2 0.00955 0.26160 -0.26160 0.37820 0.14251
183 13F-2 0.00000 0.00000 0.00000 0.00000 -0.41722
184 13F+3 -0.01016 0.23160 -0.26609 0.05430 0.05109
185 13F-3 -0.00836 0.26609 -0.23160 0.05430 -0.14827
186 14F 0 -0.05661 0.12063 0.12063 0.00000 0.00659
187 14F+1 -0.00200 -0.17573 0.02885 -0.17659 0.17402
188 14F-1 0.06567 0.02885 -0.17573 0.17659 0.04299
189 14F+2 -0.03311 -0.12993 0.12993 -0.22229 -0.21502
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.36562
191 14F+3 0.05957 -0.13612 0.17494 0.01580 0.12646
192 14F-3 0.08186 -0.17494 0.13612 0.01580 0.05550
193 15G 0 0.08227 -0.00190 -0.00190 0.00000 0.00045
194 15G+1 -0.08826 -0.02974 -0.01118 -0.10219 -0.03760
195 15G-1 0.20878 -0.01118 -0.02974 0.10219 0.01101
196 15G+2 -0.19921 0.00170 -0.00170 -0.00340 0.02038
197 15G-2 0.14754 -0.10245 -0.10245 0.00000 0.01901
198 15G+3 -0.25899 0.12077 0.00423 -0.07090 -0.09947
199 15G-3 -0.05572 -0.00423 -0.12077 -0.07090 -0.01616
200 15G+4 -0.09735 0.00225 0.00225 0.00000 0.01578
201 15G-4 -0.16658 0.07052 -0.07052 -0.01195 -0.00458
202 4 H 1S 0.00000 0.00000 0.00000 0.00000 -0.09284
203 2S 0.00000 0.00000 0.00000 0.00000 0.65445
204 3S 0.00000 0.00000 0.00000 0.00000 -2.63120
205 4S 0.00000 0.00000 0.00000 0.00000 -1.52862
206 5S 0.00000 0.00000 0.00000 0.00000 -0.00546
207 6PX -0.00285 0.00000 0.02368 -0.02368 0.00010
208 6PY -0.00619 0.02368 0.00000 -0.02368 0.00736
209 6PZ 0.00334 -0.02368 0.02368 0.00000 -0.00010
210 7PX 0.01078 0.00000 0.05443 -0.05443 -0.09122
211 7PY 0.02341 0.05443 0.00000 -0.05443 0.11737
212 7PZ -0.01263 -0.05443 0.05443 0.00000 0.09122
213 8PX -0.11042 0.00000 -0.34830 0.34830 0.43505
214 8PY -0.23978 -0.34830 0.00000 0.34830 -1.54199
215 8PZ 0.12936 0.34830 -0.34830 0.00000 -0.43505
216 9PX -0.02769 0.00000 -0.20721 0.20721 0.37050
217 9PY -0.06013 -0.20721 0.00000 0.20721 -0.70163
218 9PZ 0.03244 0.20721 -0.20721 0.00000 -0.37050
219 10D 0 0.08042 -0.04928 0.04928 0.00000 -0.00090
220 10D+1 0.04232 -0.01329 0.00000 0.01329 -0.01894
221 10D-1 0.01949 0.00000 -0.01329 0.01329 0.04804
222 10D+2 0.12569 -0.02845 -0.02845 0.05690 -0.00155
223 10D-2 -0.02283 0.01329 -0.01329 0.00000 -0.04804
224 11D 0 -0.00495 0.06781 -0.06781 0.00000 0.11484
225 11D+1 -0.02889 -0.00273 0.00000 0.00273 0.01671
226 11D-1 -0.01331 0.00000 -0.00273 0.00273 -0.24507
227 11D+2 -0.00773 0.03915 0.03915 -0.07830 0.19891
228 11D-2 0.01559 0.00273 -0.00273 0.00000 0.24507
229 12D 0 0.12841 0.25129 -0.25129 0.00000 0.15565
230 12D+1 -0.00429 -0.03657 0.00000 0.03657 0.01728
231 12D-1 -0.00198 0.00000 -0.03657 0.03657 -0.41958
232 12D+2 0.20070 0.14508 0.14508 -0.29016 0.26960
233 12D-2 0.00232 0.03657 -0.03657 0.00000 0.41958
234 13F 0 -0.00592 -0.13395 0.13395 0.00000 0.17502
235 13F+1 0.00487 0.29899 0.12478 0.28884 0.21984
236 13F-1 -0.00713 0.12478 0.29899 0.28884 -0.11485
237 13F+2 -0.00955 0.26160 0.26160 0.37820 -0.14251
238 13F-2 0.00000 0.00000 0.00000 0.00000 -0.41722
239 13F+3 0.01016 0.23160 0.26609 0.05430 -0.05109
240 13F-3 -0.00836 -0.26609 -0.23160 -0.05430 -0.14827
241 14F 0 0.05661 0.12063 -0.12063 0.00000 -0.00659
242 14F+1 0.00200 -0.17573 -0.02885 -0.17659 -0.17402
243 14F-1 0.06567 -0.02885 -0.17573 -0.17659 0.04299
244 14F+2 0.03311 -0.12993 -0.12993 -0.22229 0.21502
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.36562
246 14F+3 -0.05957 -0.13612 -0.17494 0.01580 -0.12646
247 14F-3 0.08186 0.17494 0.13612 -0.01580 0.05550
248 15G 0 0.08227 0.00190 -0.00190 0.00000 0.00045
249 15G+1 -0.08826 0.02974 -0.01118 0.10219 -0.03760
250 15G-1 -0.20878 -0.01118 0.02974 0.10219 -0.01101
251 15G+2 -0.19921 -0.00170 -0.00170 0.00340 0.02038
252 15G-2 -0.14754 -0.10245 0.10245 0.00000 -0.01901
253 15G+3 -0.25899 -0.12077 0.00423 0.07090 -0.09947
254 15G-3 0.05572 -0.00423 0.12077 -0.07090 0.01616
255 15G+4 -0.09735 -0.00225 0.00225 0.00000 0.01578
256 15G-4 0.16658 0.07052 0.07052 -0.01195 0.00458
257 5 H 1S 0.00000 0.00000 0.00000 0.00000 0.09284
258 2S 0.00000 0.00000 0.00000 0.00000 -0.65445
259 3S 0.00000 0.00000 0.00000 0.00000 2.63120
260 4S 0.00000 0.00000 0.00000 0.00000 1.52862
261 5S 0.00000 0.00000 0.00000 0.00000 0.00546
262 6PX 0.00285 0.00000 0.02368 0.02368 0.00010
263 6PY 0.00619 0.02368 0.00000 0.02368 0.00736
264 6PZ 0.00334 0.02368 -0.02368 0.00000 0.00010
265 7PX -0.01078 0.00000 0.05443 0.05443 -0.09122
266 7PY -0.02341 0.05443 0.00000 0.05443 0.11737
267 7PZ -0.01263 0.05443 -0.05443 0.00000 -0.09122
268 8PX 0.11042 0.00000 -0.34830 -0.34830 0.43505
269 8PY 0.23978 -0.34830 0.00000 -0.34830 -1.54199
270 8PZ 0.12936 -0.34830 0.34830 0.00000 0.43505
271 9PX 0.02769 0.00000 -0.20721 -0.20721 0.37050
272 9PY 0.06013 -0.20721 0.00000 -0.20721 -0.70163
273 9PZ 0.03244 -0.20721 0.20721 0.00000 0.37050
274 10D 0 0.08042 0.04928 -0.04928 0.00000 0.00090
275 10D+1 -0.04232 -0.01329 0.00000 -0.01329 -0.01894
276 10D-1 -0.01949 0.00000 -0.01329 -0.01329 0.04804
277 10D+2 0.12569 0.02845 0.02845 0.05690 0.00155
278 10D-2 -0.02283 -0.01329 0.01329 0.00000 0.04804
279 11D 0 -0.00495 -0.06781 0.06781 0.00000 -0.11484
280 11D+1 0.02889 -0.00273 0.00000 -0.00273 0.01671
281 11D-1 0.01331 0.00000 -0.00273 -0.00273 -0.24507
282 11D+2 -0.00773 -0.03915 -0.03915 -0.07830 -0.19891
283 11D-2 0.01559 -0.00273 0.00273 0.00000 -0.24507
284 12D 0 0.12841 -0.25129 0.25129 0.00000 -0.15565
285 12D+1 0.00429 -0.03657 0.00000 -0.03657 0.01728
286 12D-1 0.00198 0.00000 -0.03657 -0.03657 -0.41958
287 12D+2 0.20070 -0.14508 -0.14508 -0.29016 -0.26960
288 12D-2 0.00232 -0.03657 0.03657 0.00000 -0.41958
289 13F 0 -0.00592 0.13395 -0.13395 0.00000 -0.17502
290 13F+1 -0.00487 0.29899 0.12478 -0.28884 0.21984
291 13F-1 0.00713 0.12478 0.29899 -0.28884 -0.11485
292 13F+2 -0.00955 -0.26160 -0.26160 0.37820 0.14251
293 13F-2 0.00000 0.00000 0.00000 0.00000 0.41722
294 13F+3 -0.01016 0.23160 0.26609 -0.05430 -0.05109
295 13F-3 0.00836 -0.26609 -0.23160 0.05430 -0.14827
296 14F 0 0.05661 -0.12063 0.12063 0.00000 0.00659
297 14F+1 -0.00200 -0.17573 -0.02885 0.17659 -0.17402
298 14F-1 -0.06567 -0.02885 -0.17573 0.17659 0.04299
299 14F+2 0.03311 0.12993 0.12993 -0.22229 -0.21502
300 14F-2 0.00000 0.00000 0.00000 0.00000 -0.36562
301 14F+3 0.05957 -0.13612 -0.17494 -0.01580 -0.12646
302 14F-3 -0.08186 0.17494 0.13612 0.01580 0.05550
303 15G 0 0.08227 -0.00190 0.00190 0.00000 -0.00045
304 15G+1 0.08826 0.02974 -0.01118 -0.10219 -0.03760
305 15G-1 0.20878 -0.01118 0.02974 -0.10219 -0.01101
306 15G+2 -0.19921 0.00170 0.00170 0.00340 -0.02038
307 15G-2 -0.14754 0.10245 -0.10245 0.00000 0.01901
308 15G+3 0.25899 -0.12077 0.00423 -0.07090 -0.09947
309 15G-3 -0.05572 -0.00423 0.12077 0.07090 0.01616
310 15G+4 -0.09735 0.00225 -0.00225 0.00000 -0.01578
311 15G-4 0.16658 -0.07052 -0.07052 -0.01195 -0.00458
221 222 223 224 225
(T2)--V (T2)--V (A2)--V (T2)--V (T2)--V
Eigenvalues -- 12.95448 12.95448 13.00076 13.02189 13.02189
1 1 C 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 0.30375 0.00000 0.00000 0.00000 -0.56595
8 7PY 0.00000 0.00000 0.00000 -0.56595 0.00000
9 7PZ 0.00000 0.30375 0.00000 0.00000 0.00000
10 8PX -1.22719 0.00000 0.00000 0.00000 2.15675
11 8PY 0.00000 0.00000 0.00000 2.15675 0.00000
12 8PZ 0.00000 -1.22719 0.00000 0.00000 0.00000
13 9PX -0.67943 0.00000 0.00000 0.00000 2.26822
14 9PY 0.00000 0.00000 0.00000 2.26822 0.00000
15 9PZ 0.00000 -0.67943 0.00000 0.00000 0.00000
16 10PX -1.87098 0.00000 0.00000 0.00000 1.02509
17 10PY 0.00000 0.00000 0.00000 1.02509 0.00000
18 10PZ 0.00000 -1.87098 0.00000 0.00000 0.00000
19 11PX -0.06816 0.00000 0.00000 0.00000 0.15811
20 11PY 0.00000 0.00000 0.00000 0.15811 0.00000
21 11PZ 0.00000 -0.06816 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 -1.08284 0.00000
24 12D-1 0.46318 0.00000 0.00000 0.00000 -1.08284
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.46318 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 2.17346 0.00000
29 13D-1 -0.94909 0.00000 0.00000 0.00000 2.17346
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 -0.94909 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 0.04081 0.00000
34 14D-1 -2.53066 0.00000 0.00000 0.00000 0.04081
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 -2.53066 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 0.09085 0.00000
39 15D-1 -0.97404 0.00000 0.00000 0.00000 0.09085
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 -0.97404 0.00000 0.00000 0.00000
42 16F 0 0.00000 -0.14536 0.00000 0.00000 0.00000
43 16F+1 0.08901 0.00000 0.00000 0.00000 -0.09091
44 16F-1 0.00000 0.00000 0.00000 -0.09091 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 -0.11492 0.00000 0.00000 0.00000 0.11736
48 16F-3 0.00000 0.00000 0.00000 -0.11736 0.00000
49 17F 0 0.00000 0.82752 0.00000 0.00000 0.00000
50 17F+1 -0.50675 0.00000 0.00000 0.00000 0.34859
51 17F-1 0.00000 0.00000 0.00000 0.34859 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 0.65421 0.00000 0.00000 0.00000 -0.45003
55 17F-3 0.00000 0.00000 0.00000 0.45003 0.00000
56 18F 0 0.00000 0.82312 0.00000 0.00000 0.00000
57 18F+1 -0.50406 0.00000 0.00000 0.00000 -0.17718
58 18F-1 0.00000 0.00000 0.00000 -0.17718 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 0.65073 0.00000 0.00000 0.00000 0.22874
62 18F-3 0.00000 0.00000 0.00000 -0.22874 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 0.01100 0.00000
65 19G-1 0.04154 0.00000 0.00000 0.00000 0.01100
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 -0.11750 0.00000 0.00000 0.00000
68 19G+3 0.00000 0.00000 0.00000 0.02911 0.00000
69 19G-3 -0.10991 0.00000 0.00000 0.00000 -0.02911
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 -0.06948 0.00000
74 20G-1 -0.24208 0.00000 0.00000 0.00000 -0.06948
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.68469 0.00000 0.00000 0.00000
77 20G+3 0.00000 0.00000 0.00000 -0.18383 0.00000
78 20G-3 0.64047 0.00000 0.00000 0.00000 0.18383
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 -0.28381 0.00000 0.00000 0.00000
82 21H+1 -0.15480 0.00000 0.00000 0.00000 0.06261
83 21H-1 0.00000 0.00000 0.00000 0.06261 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 0.12424 0.00000 0.00000 0.00000 0.19028
87 21H-3 0.00000 0.00000 0.00000 -0.19028 0.00000
88 21H+4 0.00000 -0.03038 0.00000 0.00000 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 -0.20511 0.00000 0.00000 0.00000 -0.02461
91 21H-5 0.00000 0.00000 0.00000 -0.02461 0.00000
92 2 H 1S 0.09284 0.09284 0.00000 -0.14602 -0.14602
93 2S -0.65445 -0.65445 0.00000 0.80987 0.80987
94 3S 2.63120 2.63120 0.00000 -1.98017 -1.98017
95 4S 1.52862 1.52862 0.00000 -1.63389 -1.63389
96 5S 0.00546 0.00546 0.00000 -0.06649 -0.06649
97 6PX 0.00736 -0.00010 0.00000 -0.00343 -0.00409
98 6PY -0.00010 -0.00010 0.00000 -0.00409 -0.00343
99 6PZ -0.00010 0.00736 0.00000 -0.00343 -0.00343
100 7PX 0.11737 0.09122 0.00000 -0.12488 -0.19538
101 7PY 0.09122 0.09122 0.00000 -0.19538 -0.12488
102 7PZ 0.09122 0.11737 0.00000 -0.12488 -0.12488
103 8PX -1.54199 -0.43505 0.00000 0.94417 0.90885
104 8PY -0.43505 -0.43505 0.00000 0.90885 0.94417
105 8PZ -0.43505 -1.54199 0.00000 0.94417 0.94417
106 9PX -0.70163 -0.37050 0.00000 0.69601 0.78729
107 9PY -0.37050 -0.37050 0.00000 0.78729 0.69601
108 9PZ -0.37050 -0.70163 0.00000 0.69601 0.69601
109 10D 0 0.00090 -0.00179 0.00000 -0.01225 -0.01225
110 10D+1 -0.04804 -0.04804 0.00000 0.08144 0.03803
111 10D-1 -0.01894 -0.04804 0.00000 0.03803 0.08144
112 10D+2 -0.00155 0.00000 0.00000 -0.02122 0.02122
113 10D-2 -0.04804 -0.01894 0.00000 0.03803 0.03803
114 11D 0 -0.11484 0.22968 0.00000 -0.01230 -0.01230
115 11D+1 0.24507 0.24507 0.00000 -0.24687 -0.23522
116 11D-1 0.01671 0.24507 0.00000 -0.23522 -0.24687
117 11D+2 0.19891 0.00000 0.00000 -0.02130 0.02130
118 11D-2 0.24507 0.01671 0.00000 -0.23522 -0.23522
119 12D 0 -0.15565 0.31131 0.00000 0.03897 0.03897
120 12D+1 0.41958 0.41958 0.00000 -0.42115 -0.58714
121 12D-1 0.01728 0.41958 0.00000 -0.58714 -0.42115
122 12D+2 0.26960 0.00000 0.00000 0.06750 -0.06750
123 12D-2 0.41958 0.01728 0.00000 -0.58714 -0.58714
124 13F 0 0.17502 0.18754 0.00000 0.23748 0.23748
125 13F+1 -0.11485 0.00549 -0.22415 -0.07155 -0.10225
126 13F-1 -0.21984 0.00549 0.22415 -0.10225 -0.07155
127 13F+2 0.14251 0.00000 0.28353 0.09345 -0.09345
128 13F-2 0.41722 0.41722 0.00000 0.00074 0.00074
129 13F+3 0.14827 0.22563 -0.17362 0.24497 0.13201
130 13F-3 -0.05109 -0.22563 -0.17362 -0.13201 -0.24497
131 14F 0 -0.00659 -0.07021 0.00000 -0.26725 -0.26725
132 14F+1 0.04299 -0.16595 0.12011 0.05841 0.16696
133 14F-1 0.17402 -0.16595 -0.12011 0.16696 0.05841
134 14F+2 -0.21502 0.00000 -0.15193 -0.13313 0.13313
135 14F-2 -0.36562 -0.36562 0.00000 0.29353 0.29353
136 14F+3 -0.05550 -0.13688 0.09304 -0.29281 -0.21554
137 14F-3 -0.12646 0.13688 0.09304 0.21554 0.29281
138 15G 0 -0.00045 -0.02323 0.00000 0.06108 0.06108
139 15G+1 0.01101 0.00243 -0.16356 0.04389 -0.06238
140 15G-1 -0.03760 0.00243 0.16356 -0.06238 0.04389
141 15G+2 0.02038 0.00000 0.00000 -0.07303 0.07303
142 15G-2 -0.01901 0.10634 0.00000 -0.03521 -0.03521
143 15G+3 0.01616 0.01940 0.06182 0.11613 0.06122
144 15G-3 0.09947 -0.01940 0.06182 -0.06122 -0.11613
145 15G+4 -0.01578 0.01118 0.00000 -0.00358 -0.00358
146 15G-4 -0.00458 0.00000 -0.17485 -0.08000 0.08000
147 3 H 1S -0.09284 0.09284 0.00000 0.14602 0.14602
148 2S 0.65445 -0.65445 0.00000 -0.80987 -0.80987
149 3S -2.63120 2.63120 0.00000 1.98017 1.98017
150 4S -1.52862 1.52862 0.00000 1.63389 1.63389
151 5S -0.00546 0.00546 0.00000 0.06649 0.06649
152 6PX 0.00736 0.00010 0.00000 -0.00343 -0.00409
153 6PY -0.00010 0.00010 0.00000 -0.00409 -0.00343
154 6PZ 0.00010 0.00736 0.00000 0.00343 0.00343
155 7PX 0.11737 -0.09122 0.00000 -0.12488 -0.19538
156 7PY 0.09122 -0.09122 0.00000 -0.19538 -0.12488
157 7PZ -0.09122 0.11737 0.00000 0.12488 0.12488
158 8PX -1.54199 0.43505 0.00000 0.94417 0.90885
159 8PY -0.43505 0.43505 0.00000 0.90885 0.94417
160 8PZ 0.43505 -1.54199 0.00000 -0.94417 -0.94417
161 9PX -0.70163 0.37050 0.00000 0.69601 0.78729
162 9PY -0.37050 0.37050 0.00000 0.78729 0.69601
163 9PZ 0.37050 -0.70163 0.00000 -0.69601 -0.69601
164 10D 0 -0.00090 -0.00179 0.00000 0.01225 0.01225
165 10D+1 -0.04804 0.04804 0.00000 0.08144 0.03803
166 10D-1 -0.01894 0.04804 0.00000 0.03803 0.08144
167 10D+2 0.00155 0.00000 0.00000 0.02122 -0.02122
168 10D-2 0.04804 -0.01894 0.00000 -0.03803 -0.03803
169 11D 0 0.11484 0.22968 0.00000 0.01230 0.01230
170 11D+1 0.24507 -0.24507 0.00000 -0.24687 -0.23522
171 11D-1 0.01671 -0.24507 0.00000 -0.23522 -0.24687
172 11D+2 -0.19891 0.00000 0.00000 0.02130 -0.02130
173 11D-2 -0.24507 0.01671 0.00000 0.23522 0.23522
174 12D 0 0.15565 0.31131 0.00000 -0.03897 -0.03897
175 12D+1 0.41958 -0.41958 0.00000 -0.42115 -0.58714
176 12D-1 0.01728 -0.41958 0.00000 -0.58714 -0.42115
177 12D+2 -0.26960 0.00000 0.00000 -0.06750 0.06750
178 12D-2 -0.41958 0.01728 0.00000 0.58714 0.58714
179 13F 0 -0.17502 0.18754 0.00000 -0.23748 -0.23748
180 13F+1 -0.11485 -0.00549 0.22415 -0.07155 -0.10225
181 13F-1 -0.21984 -0.00549 -0.22415 -0.10225 -0.07155
182 13F+2 -0.14251 0.00000 0.28353 -0.09345 0.09345
183 13F-2 -0.41722 0.41722 0.00000 -0.00074 -0.00074
184 13F+3 0.14827 -0.22563 0.17362 0.24497 0.13201
185 13F-3 -0.05109 0.22563 0.17362 -0.13201 -0.24497
186 14F 0 0.00659 -0.07021 0.00000 0.26725 0.26725
187 14F+1 0.04299 0.16595 -0.12011 0.05841 0.16696
188 14F-1 0.17402 0.16595 0.12011 0.16696 0.05841
189 14F+2 0.21502 0.00000 -0.15193 0.13313 -0.13313
190 14F-2 0.36562 -0.36562 0.00000 -0.29353 -0.29353
191 14F+3 -0.05550 0.13688 -0.09304 -0.29281 -0.21554
192 14F-3 -0.12646 -0.13688 -0.09304 0.21554 0.29281
193 15G 0 0.00045 -0.02323 0.00000 -0.06108 -0.06108
194 15G+1 0.01101 -0.00243 0.16356 0.04389 -0.06238
195 15G-1 -0.03760 -0.00243 -0.16356 -0.06238 0.04389
196 15G+2 -0.02038 0.00000 0.00000 0.07303 -0.07303
197 15G-2 0.01901 0.10634 0.00000 0.03521 0.03521
198 15G+3 0.01616 -0.01940 -0.06182 0.11613 0.06122
199 15G-3 0.09947 0.01940 -0.06182 -0.06122 -0.11613
200 15G+4 0.01578 0.01118 0.00000 0.00358 0.00358
201 15G-4 0.00458 0.00000 -0.17485 0.08000 -0.08000
202 4 H 1S 0.09284 -0.09284 0.00000 0.14602 -0.14602
203 2S -0.65445 0.65445 0.00000 -0.80987 0.80987
204 3S 2.63120 -2.63120 0.00000 1.98017 -1.98017
205 4S 1.52862 -1.52862 0.00000 1.63389 -1.63389
206 5S 0.00546 -0.00546 0.00000 0.06649 -0.06649
207 6PX 0.00736 0.00010 0.00000 0.00343 -0.00409
208 6PY 0.00010 -0.00010 0.00000 -0.00409 0.00343
209 6PZ 0.00010 0.00736 0.00000 -0.00343 0.00343
210 7PX 0.11737 -0.09122 0.00000 0.12488 -0.19538
211 7PY -0.09122 0.09122 0.00000 -0.19538 0.12488
212 7PZ -0.09122 0.11737 0.00000 -0.12488 0.12488
213 8PX -1.54199 0.43505 0.00000 -0.94417 0.90885
214 8PY 0.43505 -0.43505 0.00000 0.90885 -0.94417
215 8PZ 0.43505 -1.54199 0.00000 0.94417 -0.94417
216 9PX -0.70163 0.37050 0.00000 -0.69601 0.78729
217 9PY 0.37050 -0.37050 0.00000 0.78729 -0.69601
218 9PZ 0.37050 -0.70163 0.00000 0.69601 -0.69601
219 10D 0 0.00090 0.00179 0.00000 0.01225 -0.01225
220 10D+1 0.04804 -0.04804 0.00000 0.08144 -0.03803
221 10D-1 -0.01894 0.04804 0.00000 -0.03803 0.08144
222 10D+2 -0.00155 0.00000 0.00000 0.02122 0.02122
223 10D-2 0.04804 -0.01894 0.00000 0.03803 -0.03803
224 11D 0 -0.11484 -0.22968 0.00000 0.01230 -0.01230
225 11D+1 -0.24507 0.24507 0.00000 -0.24687 0.23522
226 11D-1 0.01671 -0.24507 0.00000 0.23522 -0.24687
227 11D+2 0.19891 0.00000 0.00000 0.02130 0.02130
228 11D-2 -0.24507 0.01671 0.00000 -0.23522 0.23522
229 12D 0 -0.15565 -0.31131 0.00000 -0.03897 0.03897
230 12D+1 -0.41958 0.41958 0.00000 -0.42115 0.58714
231 12D-1 0.01728 -0.41958 0.00000 0.58714 -0.42115
232 12D+2 0.26960 0.00000 0.00000 -0.06750 -0.06750
233 12D-2 -0.41958 0.01728 0.00000 -0.58714 0.58714
234 13F 0 -0.17502 0.18754 0.00000 0.23748 -0.23748
235 13F+1 -0.11485 -0.00549 -0.22415 0.07155 -0.10225
236 13F-1 0.21984 0.00549 -0.22415 -0.10225 0.07155
237 13F+2 -0.14251 0.00000 -0.28353 0.09345 0.09345
238 13F-2 0.41722 -0.41722 0.00000 -0.00074 0.00074
239 13F+3 0.14827 -0.22563 -0.17362 -0.24497 0.13201
240 13F-3 0.05109 -0.22563 0.17362 -0.13201 0.24497
241 14F 0 0.00659 -0.07021 0.00000 -0.26725 0.26725
242 14F+1 0.04299 0.16595 0.12011 -0.05841 0.16696
243 14F-1 -0.17402 -0.16595 0.12011 0.16696 -0.05841
244 14F+2 0.21502 0.00000 0.15193 -0.13313 -0.13313
245 14F-2 -0.36562 0.36562 0.00000 -0.29353 0.29353
246 14F+3 -0.05550 0.13688 0.09304 0.29281 -0.21554
247 14F-3 0.12646 0.13688 -0.09304 0.21554 -0.29281
248 15G 0 -0.00045 0.02323 0.00000 -0.06108 0.06108
249 15G+1 -0.01101 0.00243 0.16356 0.04389 0.06238
250 15G-1 -0.03760 -0.00243 0.16356 0.06238 0.04389
251 15G+2 0.02038 0.00000 0.00000 0.07303 0.07303
252 15G-2 0.01901 0.10634 0.00000 -0.03521 0.03521
253 15G+3 -0.01616 0.01940 -0.06182 0.11613 -0.06122
254 15G-3 0.09947 0.01940 0.06182 0.06122 -0.11613
255 15G+4 -0.01578 -0.01118 0.00000 0.00358 -0.00358
256 15G-4 0.00458 0.00000 0.17485 -0.08000 -0.08000
257 5 H 1S -0.09284 -0.09284 0.00000 -0.14602 0.14602
258 2S 0.65445 0.65445 0.00000 0.80987 -0.80987
259 3S -2.63120 -2.63120 0.00000 -1.98017 1.98017
260 4S -1.52862 -1.52862 0.00000 -1.63389 1.63389
261 5S -0.00546 -0.00546 0.00000 -0.06649 0.06649
262 6PX 0.00736 -0.00010 0.00000 0.00343 -0.00409
263 6PY 0.00010 0.00010 0.00000 -0.00409 0.00343
264 6PZ -0.00010 0.00736 0.00000 0.00343 -0.00343
265 7PX 0.11737 0.09122 0.00000 0.12488 -0.19538
266 7PY -0.09122 -0.09122 0.00000 -0.19538 0.12488
267 7PZ 0.09122 0.11737 0.00000 0.12488 -0.12488
268 8PX -1.54199 -0.43505 0.00000 -0.94417 0.90885
269 8PY 0.43505 0.43505 0.00000 0.90885 -0.94417
270 8PZ -0.43505 -1.54199 0.00000 -0.94417 0.94417
271 9PX -0.70163 -0.37050 0.00000 -0.69601 0.78729
272 9PY 0.37050 0.37050 0.00000 0.78729 -0.69601
273 9PZ -0.37050 -0.70163 0.00000 -0.69601 0.69601
274 10D 0 -0.00090 0.00179 0.00000 -0.01225 0.01225
275 10D+1 0.04804 0.04804 0.00000 0.08144 -0.03803
276 10D-1 -0.01894 -0.04804 0.00000 -0.03803 0.08144
277 10D+2 0.00155 0.00000 0.00000 -0.02122 -0.02122
278 10D-2 -0.04804 -0.01894 0.00000 -0.03803 0.03803
279 11D 0 0.11484 -0.22968 0.00000 -0.01230 0.01230
280 11D+1 -0.24507 -0.24507 0.00000 -0.24687 0.23522
281 11D-1 0.01671 0.24507 0.00000 0.23522 -0.24687
282 11D+2 -0.19891 0.00000 0.00000 -0.02130 -0.02130
283 11D-2 0.24507 0.01671 0.00000 0.23522 -0.23522
284 12D 0 0.15565 -0.31131 0.00000 0.03897 -0.03897
285 12D+1 -0.41958 -0.41958 0.00000 -0.42115 0.58714
286 12D-1 0.01728 0.41958 0.00000 0.58714 -0.42115
287 12D+2 -0.26960 0.00000 0.00000 0.06750 0.06750
288 12D-2 0.41958 0.01728 0.00000 0.58714 -0.58714
289 13F 0 0.17502 0.18754 0.00000 -0.23748 0.23748
290 13F+1 -0.11485 0.00549 0.22415 0.07155 -0.10225
291 13F-1 0.21984 -0.00549 0.22415 -0.10225 0.07155
292 13F+2 0.14251 0.00000 -0.28353 -0.09345 -0.09345
293 13F-2 -0.41722 -0.41722 0.00000 0.00074 -0.00074
294 13F+3 0.14827 0.22563 0.17362 -0.24497 0.13201
295 13F-3 0.05109 0.22563 -0.17362 -0.13201 0.24497
296 14F 0 -0.00659 -0.07021 0.00000 0.26725 -0.26725
297 14F+1 0.04299 -0.16595 -0.12011 -0.05841 0.16696
298 14F-1 -0.17402 0.16595 -0.12011 0.16696 -0.05841
299 14F+2 -0.21502 0.00000 0.15193 0.13313 0.13313
300 14F-2 0.36562 0.36562 0.00000 0.29353 -0.29353
301 14F+3 -0.05550 -0.13688 -0.09304 0.29281 -0.21554
302 14F-3 0.12646 -0.13688 0.09304 0.21554 -0.29281
303 15G 0 0.00045 0.02323 0.00000 0.06108 -0.06108
304 15G+1 -0.01101 -0.00243 -0.16356 0.04389 0.06238
305 15G-1 -0.03760 0.00243 -0.16356 0.06238 0.04389
306 15G+2 -0.02038 0.00000 0.00000 -0.07303 -0.07303
307 15G-2 -0.01901 0.10634 0.00000 0.03521 -0.03521
308 15G+3 -0.01616 -0.01940 0.06182 0.11613 -0.06122
309 15G-3 0.09947 -0.01940 -0.06182 0.06122 -0.11613
310 15G+4 0.01578 -0.01118 0.00000 -0.00358 0.00358
311 15G-4 -0.00458 0.00000 0.17485 0.08000 0.08000
226 227 228 229 230
(T2)--V (A1)--V (T1)--V (T1)--V (T1)--V
Eigenvalues -- 13.02189 13.02748 13.26315 13.26315 13.26315
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2 2S 0.00000 0.11334 0.00000 0.00000 0.00000
3 3S 0.00000 0.94958 0.00000 0.00000 0.00000
4 4S 0.00000 -6.93970 0.00000 0.00000 0.00000
5 5S 0.00000 13.91451 0.00000 0.00000 0.00000
6 6S 0.00000 0.60329 0.00000 0.00000 0.00000
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 -0.56595 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 2.15675 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 2.26822 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 1.02509 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 0.15811 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 -1.08284 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 2.17346 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 0.04081 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 0.09085 0.00000 0.00000 0.00000 0.00000
42 16F 0 0.14845 0.00000 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.00000 -0.12138 0.00000
44 16F-1 0.00000 0.00000 0.00000 0.00000 -0.12138
45 16F+2 0.00000 0.00000 -0.15353 0.00000 0.00000
46 16F-2 0.00000 -0.24081 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.00000 0.00000 -0.09402 0.00000
48 16F-3 0.00000 0.00000 0.00000 0.00000 0.09402
49 17F 0 -0.56924 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.00000 0.40106 0.00000
51 17F-1 0.00000 0.00000 0.00000 0.00000 0.40106
52 17F+2 0.00000 0.00000 0.50731 0.00000 0.00000
53 17F-2 0.00000 0.60542 0.00000 0.00000 0.00000
54 17F+3 0.00000 0.00000 0.00000 0.31066 0.00000
55 17F-3 0.00000 0.00000 0.00000 0.00000 -0.31066
56 18F 0 0.28934 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 0.00000 0.02154 0.00000
58 18F-1 0.00000 0.00000 0.00000 0.00000 0.02154
59 18F+2 0.00000 0.00000 0.02725 0.00000 0.00000
60 18F-2 0.00000 2.27988 0.00000 0.00000 0.00000
61 18F+3 0.00000 0.00000 0.00000 0.01669 0.00000
62 18F-3 0.00000 0.00000 0.00000 0.00000 -0.01669
63 19G 0 0.00000 -0.05824 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 0.00000 -0.00296
65 19G-1 0.00000 0.00000 0.00000 -0.00296 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 -0.03112 0.00000 0.00000 0.00000 0.00000
68 19G+3 0.00000 0.00000 0.00000 0.00000 0.00112
69 19G-3 0.00000 0.00000 0.00000 -0.00112 0.00000
70 19G+4 0.00000 -0.04922 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 -0.00317 0.00000 0.00000
72 20G 0 0.00000 -0.25325 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.00000 0.00000 0.40008
74 20G-1 0.00000 0.00000 0.00000 0.40008 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.19652 0.00000 0.00000 0.00000 0.00000
77 20G+3 0.00000 0.00000 0.00000 0.00000 -0.15122
78 20G-3 0.00000 0.00000 0.00000 0.15122 0.00000
79 20G+4 0.00000 -0.21403 0.00000 0.00000 0.00000
80 20G-4 0.00000 0.00000 0.42770 0.00000 0.00000
81 21H 0 -0.08645 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 0.00000 0.03652 0.00000
83 21H-1 0.00000 0.00000 0.00000 0.00000 0.03652
84 21H+2 0.00000 0.00000 -0.05522 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 -0.01691 0.00000
87 21H-3 0.00000 0.00000 0.00000 0.00000 0.01691
88 21H+4 0.18237 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 -0.03781 0.00000
91 21H-5 0.00000 0.00000 0.00000 0.00000 -0.03781
92 2 H 1S -0.14602 -0.14207 0.00000 0.00000 0.00000
93 2S 0.80987 0.10255 0.00000 0.00000 0.00000
94 3S -1.98017 -3.68427 0.00000 0.00000 0.00000
95 4S -1.63389 -0.42238 0.00000 0.00000 0.00000
96 5S -0.06649 -0.03579 0.00000 0.00000 0.00000
97 6PX -0.00343 -0.02623 -0.01200 0.00000 0.01200
98 6PY -0.00343 -0.02623 0.01200 0.01200 0.00000
99 6PZ -0.00409 -0.02623 0.00000 -0.01200 -0.01200
100 7PX -0.12488 0.08913 -0.01148 0.00000 0.01148
101 7PY -0.12488 0.08913 0.01148 0.01148 0.00000
102 7PZ -0.19538 0.08913 0.00000 -0.01148 -0.01148
103 8PX 0.94417 0.37549 -0.19135 0.00000 0.19135
104 8PY 0.94417 0.37549 0.19135 0.19135 0.00000
105 8PZ 0.90885 0.37549 0.00000 -0.19135 -0.19135
106 9PX 0.69601 0.08686 -0.03264 0.00000 0.03264
107 9PY 0.69601 0.08686 0.03264 0.03264 0.00000
108 9PZ 0.78729 0.08686 0.00000 -0.03264 -0.03264
109 10D 0 0.02450 0.00000 0.00000 -0.20282 -0.20282
110 10D+1 0.03803 0.00476 0.12561 0.12561 0.00000
111 10D-1 0.03803 0.00476 -0.12561 0.00000 0.12561
112 10D+2 0.00000 0.00000 -0.23420 -0.11710 0.11710
113 10D-2 0.08144 0.00476 0.00000 -0.12561 -0.12561
114 11D 0 0.02460 0.00000 0.00000 0.21587 0.21587
115 11D+1 -0.23522 -0.02772 -0.01449 -0.01449 0.00000
116 11D-1 -0.23522 -0.02772 0.01449 0.00000 -0.01449
117 11D+2 0.00000 0.00000 0.24926 0.12463 -0.12463
118 11D-2 -0.24687 -0.02772 0.00000 0.01449 0.01449
119 12D 0 -0.07794 0.00000 0.00000 0.04816 0.04816
120 12D+1 -0.58714 0.20559 0.09780 0.09780 0.00000
121 12D-1 -0.58714 0.20559 -0.09780 0.00000 0.09780
122 12D+2 0.00000 0.00000 0.05561 0.02781 -0.02781
123 12D-2 -0.42115 0.20559 0.00000 -0.09780 -0.09780
124 13F 0 0.16698 0.21550 0.00000 0.26243 0.26243
125 13F+1 -0.21930 -0.13197 -0.05189 -0.10696 0.26952
126 13F-1 -0.21930 -0.13197 0.05189 0.26952 -0.10696
127 13F+2 0.00000 0.00000 -0.13529 0.13765 -0.13765
128 13F-2 0.00074 0.42863 0.00000 0.00000 0.00000
129 13F+3 0.13052 0.17037 0.29176 -0.08285 -0.12318
130 13F-3 -0.13052 -0.17037 0.29176 0.12318 0.08285
131 14F 0 -0.27264 -0.07119 0.00000 -0.14192 -0.14192
132 14F+1 0.26891 0.04360 -0.02411 0.01274 -0.19793
133 14F-1 0.26891 0.04360 0.02411 -0.19793 0.01274
134 14F+2 0.00000 0.00000 0.01611 -0.14043 0.14043
135 14F-2 0.29353 -0.35869 0.00000 0.00000 0.00000
136 14F+3 -0.12976 -0.05628 -0.19819 0.00987 0.02621
137 14F-3 0.12976 0.05628 -0.19819 -0.02621 -0.00987
138 15G 0 -0.02057 -0.10632 0.00000 0.01587 0.01587
139 15G+1 0.08728 0.01954 0.15466 -0.12488 0.18642
140 15G-1 0.08728 0.01954 -0.15466 0.18642 -0.12488
141 15G+2 0.00000 0.00000 -0.02839 -0.01419 0.01419
142 15G-2 -0.12415 -0.05526 0.00000 0.04210 0.04210
143 15G+3 0.00465 0.05169 -0.01344 0.09221 -0.07046
144 15G-3 -0.00465 -0.05169 -0.01344 0.07046 -0.09221
145 15G+4 0.09303 -0.08985 0.00000 -0.01878 -0.01878
146 15G-4 0.00000 0.00000 0.19929 -0.14942 0.14942
147 3 H 1S -0.14602 -0.14207 0.00000 0.00000 0.00000
148 2S 0.80987 0.10255 0.00000 0.00000 0.00000
149 3S -1.98017 -3.68427 0.00000 0.00000 0.00000
150 4S -1.63389 -0.42238 0.00000 0.00000 0.00000
151 5S -0.06649 -0.03579 0.00000 0.00000 0.00000
152 6PX 0.00343 0.02623 0.01200 0.00000 0.01200
153 6PY 0.00343 0.02623 -0.01200 0.01200 0.00000
154 6PZ -0.00409 -0.02623 0.00000 0.01200 0.01200
155 7PX 0.12488 -0.08913 0.01148 0.00000 0.01148
156 7PY 0.12488 -0.08913 -0.01148 0.01148 0.00000
157 7PZ -0.19538 0.08913 0.00000 0.01148 0.01148
158 8PX -0.94417 -0.37549 0.19135 0.00000 0.19135
159 8PY -0.94417 -0.37549 -0.19135 0.19135 0.00000
160 8PZ 0.90885 0.37549 0.00000 0.19135 0.19135
161 9PX -0.69601 -0.08686 0.03264 0.00000 0.03264
162 9PY -0.69601 -0.08686 -0.03264 0.03264 0.00000
163 9PZ 0.78729 0.08686 0.00000 0.03264 0.03264
164 10D 0 0.02450 0.00000 0.00000 0.20282 0.20282
165 10D+1 -0.03803 -0.00476 -0.12561 0.12561 0.00000
166 10D-1 -0.03803 -0.00476 0.12561 0.00000 0.12561
167 10D+2 0.00000 0.00000 -0.23420 0.11710 -0.11710
168 10D-2 0.08144 0.00476 0.00000 0.12561 0.12561
169 11D 0 0.02460 0.00000 0.00000 -0.21587 -0.21587
170 11D+1 0.23522 0.02772 0.01449 -0.01449 0.00000
171 11D-1 0.23522 0.02772 -0.01449 0.00000 -0.01449
172 11D+2 0.00000 0.00000 0.24926 -0.12463 0.12463
173 11D-2 -0.24687 -0.02772 0.00000 -0.01449 -0.01449
174 12D 0 -0.07794 0.00000 0.00000 -0.04816 -0.04816
175 12D+1 0.58714 -0.20559 -0.09780 0.09780 0.00000
176 12D-1 0.58714 -0.20559 0.09780 0.00000 0.09780
177 12D+2 0.00000 0.00000 0.05561 -0.02781 0.02781
178 12D-2 -0.42115 0.20559 0.00000 0.09780 0.09780
179 13F 0 0.16698 0.21550 0.00000 -0.26243 -0.26243
180 13F+1 0.21930 0.13197 0.05189 -0.10696 0.26952
181 13F-1 0.21930 0.13197 -0.05189 0.26952 -0.10696
182 13F+2 0.00000 0.00000 -0.13529 -0.13765 0.13765
183 13F-2 0.00074 0.42863 0.00000 0.00000 0.00000
184 13F+3 -0.13052 -0.17037 -0.29176 -0.08285 -0.12318
185 13F-3 0.13052 0.17037 -0.29176 0.12318 0.08285
186 14F 0 -0.27264 -0.07119 0.00000 0.14192 0.14192
187 14F+1 -0.26891 -0.04360 0.02411 0.01274 -0.19793
188 14F-1 -0.26891 -0.04360 -0.02411 -0.19793 0.01274
189 14F+2 0.00000 0.00000 0.01611 0.14043 -0.14043
190 14F-2 0.29353 -0.35869 0.00000 0.00000 0.00000
191 14F+3 0.12976 0.05628 0.19819 0.00987 0.02621
192 14F-3 -0.12976 -0.05628 0.19819 -0.02621 -0.00987
193 15G 0 -0.02057 -0.10632 0.00000 -0.01587 -0.01587
194 15G+1 -0.08728 -0.01954 -0.15466 -0.12488 0.18642
195 15G-1 -0.08728 -0.01954 0.15466 0.18642 -0.12488
196 15G+2 0.00000 0.00000 -0.02839 0.01419 -0.01419
197 15G-2 -0.12415 -0.05526 0.00000 -0.04210 -0.04210
198 15G+3 -0.00465 -0.05169 0.01344 0.09221 -0.07046
199 15G-3 0.00465 0.05169 0.01344 0.07046 -0.09221
200 15G+4 0.09303 -0.08985 0.00000 0.01878 0.01878
201 15G-4 0.00000 0.00000 0.19929 0.14942 -0.14942
202 4 H 1S 0.14602 -0.14207 0.00000 0.00000 0.00000
203 2S -0.80987 0.10255 0.00000 0.00000 0.00000
204 3S 1.98017 -3.68427 0.00000 0.00000 0.00000
205 4S 1.63389 -0.42238 0.00000 0.00000 0.00000
206 5S 0.06649 -0.03579 0.00000 0.00000 0.00000
207 6PX 0.00343 -0.02623 0.01200 0.00000 -0.01200
208 6PY -0.00343 0.02623 0.01200 -0.01200 0.00000
209 6PZ -0.00409 0.02623 0.00000 0.01200 -0.01200
210 7PX 0.12488 0.08913 0.01148 0.00000 -0.01148
211 7PY -0.12488 -0.08913 0.01148 -0.01148 0.00000
212 7PZ -0.19538 -0.08913 0.00000 0.01148 -0.01148
213 8PX -0.94417 0.37549 0.19135 0.00000 -0.19135
214 8PY 0.94417 -0.37549 0.19135 -0.19135 0.00000
215 8PZ 0.90885 -0.37549 0.00000 0.19135 -0.19135
216 9PX -0.69601 0.08686 0.03264 0.00000 -0.03264
217 9PY 0.69601 -0.08686 0.03264 -0.03264 0.00000
218 9PZ 0.78729 -0.08686 0.00000 0.03264 -0.03264
219 10D 0 -0.02450 0.00000 0.00000 -0.20282 0.20282
220 10D+1 0.03803 -0.00476 0.12561 -0.12561 0.00000
221 10D-1 -0.03803 0.00476 0.12561 0.00000 -0.12561
222 10D+2 0.00000 0.00000 0.23420 -0.11710 -0.11710
223 10D-2 0.08144 -0.00476 0.00000 0.12561 -0.12561
224 11D 0 -0.02460 0.00000 0.00000 0.21587 -0.21587
225 11D+1 -0.23522 0.02772 -0.01449 0.01449 0.00000
226 11D-1 0.23522 -0.02772 -0.01449 0.00000 0.01449
227 11D+2 0.00000 0.00000 -0.24926 0.12463 0.12463
228 11D-2 -0.24687 0.02772 0.00000 -0.01449 0.01449
229 12D 0 0.07794 0.00000 0.00000 0.04816 -0.04816
230 12D+1 -0.58714 -0.20559 0.09780 -0.09780 0.00000
231 12D-1 0.58714 0.20559 0.09780 0.00000 -0.09780
232 12D+2 0.00000 0.00000 -0.05561 0.02781 0.02781
233 12D-2 -0.42115 -0.20559 0.00000 0.09780 -0.09780
234 13F 0 0.16698 -0.21550 0.00000 -0.26243 0.26243
235 13F+1 0.21930 -0.13197 0.05189 -0.10696 -0.26952
236 13F-1 -0.21930 0.13197 0.05189 -0.26952 -0.10696
237 13F+2 0.00000 0.00000 -0.13529 -0.13765 -0.13765
238 13F-2 -0.00074 0.42863 0.00000 0.00000 0.00000
239 13F+3 -0.13052 0.17037 -0.29176 -0.08285 0.12318
240 13F-3 -0.13052 0.17037 0.29176 -0.12318 0.08285
241 14F 0 -0.27264 0.07119 0.00000 0.14192 -0.14192
242 14F+1 -0.26891 0.04360 0.02411 0.01274 0.19793
243 14F-1 0.26891 -0.04360 0.02411 0.19793 0.01274
244 14F+2 0.00000 0.00000 0.01611 0.14043 0.14043
245 14F-2 -0.29353 -0.35869 0.00000 0.00000 0.00000
246 14F+3 0.12976 -0.05628 0.19819 0.00987 -0.02621
247 14F-3 0.12976 -0.05628 -0.19819 0.02621 -0.00987
248 15G 0 0.02057 -0.10632 0.00000 0.01587 -0.01587
249 15G+1 0.08728 -0.01954 0.15466 0.12488 0.18642
250 15G-1 -0.08728 0.01954 0.15466 0.18642 0.12488
251 15G+2 0.00000 0.00000 0.02839 -0.01419 -0.01419
252 15G-2 -0.12415 0.05526 0.00000 -0.04210 0.04210
253 15G+3 0.00465 -0.05169 -0.01344 -0.09221 -0.07046
254 15G-3 0.00465 -0.05169 0.01344 0.07046 0.09221
255 15G+4 -0.09303 -0.08985 0.00000 -0.01878 0.01878
256 15G-4 0.00000 0.00000 0.19929 0.14942 0.14942
257 5 H 1S 0.14602 -0.14207 0.00000 0.00000 0.00000
258 2S -0.80987 0.10255 0.00000 0.00000 0.00000
259 3S 1.98017 -3.68427 0.00000 0.00000 0.00000
260 4S 1.63389 -0.42238 0.00000 0.00000 0.00000
261 5S 0.06649 -0.03579 0.00000 0.00000 0.00000
262 6PX -0.00343 0.02623 -0.01200 0.00000 -0.01200
263 6PY 0.00343 -0.02623 -0.01200 -0.01200 0.00000
264 6PZ -0.00409 0.02623 0.00000 -0.01200 0.01200
265 7PX -0.12488 -0.08913 -0.01148 0.00000 -0.01148
266 7PY 0.12488 0.08913 -0.01148 -0.01148 0.00000
267 7PZ -0.19538 -0.08913 0.00000 -0.01148 0.01148
268 8PX 0.94417 -0.37549 -0.19135 0.00000 -0.19135
269 8PY -0.94417 0.37549 -0.19135 -0.19135 0.00000
270 8PZ 0.90885 -0.37549 0.00000 -0.19135 0.19135
271 9PX 0.69601 -0.08686 -0.03264 0.00000 -0.03264
272 9PY -0.69601 0.08686 -0.03264 -0.03264 0.00000
273 9PZ 0.78729 -0.08686 0.00000 -0.03264 0.03264
274 10D 0 -0.02450 0.00000 0.00000 0.20282 -0.20282
275 10D+1 -0.03803 0.00476 -0.12561 -0.12561 0.00000
276 10D-1 0.03803 -0.00476 -0.12561 0.00000 -0.12561
277 10D+2 0.00000 0.00000 0.23420 0.11710 0.11710
278 10D-2 0.08144 -0.00476 0.00000 -0.12561 0.12561
279 11D 0 -0.02460 0.00000 0.00000 -0.21587 0.21587
280 11D+1 0.23522 -0.02772 0.01449 0.01449 0.00000
281 11D-1 -0.23522 0.02772 0.01449 0.00000 0.01449
282 11D+2 0.00000 0.00000 -0.24926 -0.12463 -0.12463
283 11D-2 -0.24687 0.02772 0.00000 0.01449 -0.01449
284 12D 0 0.07794 0.00000 0.00000 -0.04816 0.04816
285 12D+1 0.58714 0.20559 -0.09780 -0.09780 0.00000
286 12D-1 -0.58714 -0.20559 -0.09780 0.00000 -0.09780
287 12D+2 0.00000 0.00000 -0.05561 -0.02781 -0.02781
288 12D-2 -0.42115 -0.20559 0.00000 -0.09780 0.09780
289 13F 0 0.16698 -0.21550 0.00000 0.26243 -0.26243
290 13F+1 -0.21930 0.13197 -0.05189 -0.10696 -0.26952
291 13F-1 0.21930 -0.13197 -0.05189 -0.26952 -0.10696
292 13F+2 0.00000 0.00000 -0.13529 0.13765 0.13765
293 13F-2 -0.00074 0.42863 0.00000 0.00000 0.00000
294 13F+3 0.13052 -0.17037 0.29176 -0.08285 0.12318
295 13F-3 0.13052 -0.17037 -0.29176 -0.12318 0.08285
296 14F 0 -0.27264 0.07119 0.00000 -0.14192 0.14192
297 14F+1 0.26891 -0.04360 -0.02411 0.01274 0.19793
298 14F-1 -0.26891 0.04360 -0.02411 0.19793 0.01274
299 14F+2 0.00000 0.00000 0.01611 -0.14043 -0.14043
300 14F-2 -0.29353 -0.35869 0.00000 0.00000 0.00000
301 14F+3 -0.12976 0.05628 -0.19819 0.00987 -0.02621
302 14F-3 -0.12976 0.05628 0.19819 0.02621 -0.00987
303 15G 0 0.02057 -0.10632 0.00000 -0.01587 0.01587
304 15G+1 -0.08728 0.01954 -0.15466 0.12488 0.18642
305 15G-1 0.08728 -0.01954 -0.15466 0.18642 0.12488
306 15G+2 0.00000 0.00000 0.02839 0.01419 0.01419
307 15G-2 -0.12415 0.05526 0.00000 0.04210 -0.04210
308 15G+3 -0.00465 0.05169 0.01344 -0.09221 -0.07046
309 15G-3 -0.00465 0.05169 -0.01344 0.07046 0.09221
310 15G+4 -0.09303 -0.08985 0.00000 0.01878 -0.01878
311 15G-4 0.00000 0.00000 0.19929 -0.14942 -0.14942
231 232 233 234 235
(E)--V (E)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 13.42937 13.42937 13.43401 13.43401 13.43401
1 1 C 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 0.00000 0.04036 0.00000
8 7PY 0.00000 0.00000 0.04036 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.04036
10 8PX 0.00000 0.00000 0.00000 0.02782 0.00000
11 8PY 0.00000 0.00000 0.02782 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.02782
13 9PX 0.00000 0.00000 0.00000 -0.48731 0.00000
14 9PY 0.00000 0.00000 -0.48731 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 -0.48731
16 10PX 0.00000 0.00000 0.00000 0.63985 0.00000
17 10PY 0.00000 0.00000 0.63985 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.63985
19 11PX 0.00000 0.00000 0.00000 -0.11726 0.00000
20 11PY 0.00000 0.00000 -0.11726 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.11726
22 12D 0 -0.11705 0.32416 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.15646 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.15646 0.00000
25 12D+2 -0.32416 -0.11705 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.15646
27 13D 0 0.14646 -0.40560 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 -0.24442 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 -0.24442 0.00000
30 13D+2 0.40560 0.14646 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 -0.24442
32 14D 0 -0.21989 0.60894 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 1.12055 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 1.12055 0.00000
35 14D+2 -0.60894 -0.21989 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 1.12055
37 15D 0 -0.29024 0.80378 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 -0.17038 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 -0.17038 0.00000
40 15D+2 -0.80378 -0.29024 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 0.00000 -0.17038
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.00694
43 16F+1 0.00000 0.00000 0.00000 -0.00425 0.00000
44 16F-1 0.00000 0.00000 -0.00425 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 0.00548 0.00000
48 16F-3 0.00000 0.00000 -0.00548 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 -0.14150
50 17F+1 0.00000 0.00000 0.00000 0.08665 0.00000
51 17F-1 0.00000 0.00000 0.08665 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 -0.11186 0.00000
55 17F-3 0.00000 0.00000 0.11186 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.44862
57 18F+1 0.00000 0.00000 0.00000 -0.27472 0.00000
58 18F-1 0.00000 0.00000 -0.27472 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 0.35466 0.00000
62 18F-3 0.00000 0.00000 -0.35466 0.00000 0.00000
63 19G 0 0.05825 -0.16131 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 -0.04087 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 -0.04087 0.00000
66 19G+2 -0.24991 -0.09024 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.11560
68 19G+3 0.00000 0.00000 -0.10814 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.10814 0.00000
70 19G+4 -0.06892 0.19087 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 -0.20596 0.57038 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.16577 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.00000 0.16577 0.00000
75 20G+2 0.88363 0.31908 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.00000 -0.46888
77 20G+3 0.00000 0.00000 0.43860 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.00000 -0.43860 0.00000
79 20G+4 0.24370 -0.67488 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 0.47207
82 21H+1 0.00000 0.00000 0.00000 0.30820 0.00000
83 21H-1 0.00000 0.00000 0.30820 0.00000 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 21H-2 0.04754 -0.13165 0.00000 0.00000 0.00000
86 21H+3 0.00000 0.00000 0.00000 -0.13622 0.00000
87 21H-3 0.00000 0.00000 0.13622 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.13907
89 21H-4 0.13165 0.04754 0.00000 0.00000 0.00000
90 21H+5 0.00000 0.00000 0.00000 0.35867 0.00000
91 21H-5 0.00000 0.00000 0.35867 0.00000 0.00000
92 2 H 1S 0.00000 0.00000 0.02045 0.02045 0.02045
93 2S 0.00000 0.00000 0.18134 0.18134 0.18134
94 3S 0.00000 0.00000 -0.29948 -0.29948 -0.29948
95 4S 0.00000 0.00000 -0.19005 -0.19005 -0.19005
96 5S 0.00000 0.00000 0.08180 0.08180 0.08180
97 6PX -0.00549 -0.00651 0.01900 0.00418 0.01900
98 6PY 0.00838 -0.00150 0.00418 0.01900 0.01900
99 6PZ -0.00289 0.00801 0.01900 0.01900 0.00418
100 7PX -0.04161 -0.04934 -0.09664 0.00423 -0.09664
101 7PY 0.06353 -0.01137 0.00423 -0.09664 -0.09664
102 7PZ -0.02192 0.06070 -0.09664 -0.09664 0.00423
103 8PX -0.03396 -0.04027 -0.00503 0.37365 -0.00503
104 8PY 0.05186 -0.00928 0.37365 -0.00503 -0.00503
105 8PZ -0.01789 0.04955 -0.00503 -0.00503 0.37365
106 9PX 0.21668 0.25690 0.10017 -0.05329 0.10017
107 9PY -0.33082 0.05920 -0.05329 0.10017 0.10017
108 9PZ 0.11414 -0.31610 0.10017 0.10017 -0.05329
109 10D 0 0.01962 -0.05434 -0.11613 -0.11613 0.23227
110 10D+1 -0.08885 0.01590 -0.05264 0.03099 0.03099
111 10D-1 0.05820 0.06900 0.03099 -0.05264 0.03099
112 10D+2 0.05434 0.01962 -0.20115 0.20115 0.00000
113 10D-2 0.03066 -0.08490 0.03099 0.03099 -0.05264
114 11D 0 0.02481 -0.06870 0.16487 0.16487 -0.32975
115 11D+1 0.09455 -0.01692 0.16539 -0.07467 -0.07467
116 11D-1 -0.06192 -0.07342 -0.07467 0.16539 -0.07467
117 11D+2 0.06870 0.02481 0.28557 -0.28557 0.00000
118 11D-2 -0.03262 0.09034 -0.07467 -0.07467 0.16539
119 12D 0 0.05837 -0.16165 0.06474 0.06474 -0.12947
120 12D+1 -0.32269 0.05774 -0.11763 0.06999 0.06999
121 12D-1 0.21135 0.25059 0.06999 -0.11763 0.06999
122 12D+2 0.16165 0.05837 0.11213 -0.11213 0.00000
123 12D-2 0.11134 -0.30833 0.06999 0.06999 -0.11763
124 13F 0 0.14604 -0.40444 0.09828 0.09828 -0.23301
125 13F+1 -0.28742 -0.10205 -0.13382 0.14269 0.01345
126 13F-1 0.28631 0.10513 0.14269 -0.13382 0.01345
127 13F+2 -0.18312 -0.06612 -0.09314 0.09314 0.00000
128 13F-2 0.00000 0.00000 -0.01118 -0.01118 -0.01118
129 13F+3 0.12804 0.33672 0.02066 -0.18421 0.13473
130 13F-3 0.31363 -0.17724 0.18421 -0.02066 -0.13473
131 14F 0 -0.14464 0.40055 -0.08794 -0.08794 0.20085
132 14F+1 0.26357 0.11886 0.06881 -0.12299 0.03889
133 14F-1 -0.27870 -0.07695 -0.12299 0.06881 0.03889
134 14F+2 0.14852 0.05363 0.01892 -0.01892 0.00000
135 14F-2 0.00000 0.00000 -0.06359 -0.06359 -0.06359
136 14F+3 -0.14315 -0.31970 -0.05793 0.15878 -0.08111
137 14F-3 -0.31438 0.15449 -0.15878 0.05793 0.08111
138 15G 0 0.02393 -0.06627 0.26432 0.26432 0.21460
139 15G+1 -0.03176 -0.07390 -0.00633 -0.14637 0.03067
140 15G-1 0.07165 -0.03656 -0.14637 -0.00633 0.03067
141 15G+2 -0.10267 -0.03707 -0.04447 0.04447 0.00000
142 15G-2 -0.01753 0.04854 0.16363 0.16363 0.01789
143 15G+3 -0.04230 0.03765 -0.01674 -0.11960 -0.18652
144 15G-3 -0.00849 -0.05599 0.11960 0.01674 0.18652
145 15G+4 -0.02832 0.07842 0.18978 0.18978 0.24860
146 15G-4 0.07877 0.02844 -0.09463 0.09463 0.00000
147 3 H 1S 0.00000 0.00000 -0.02045 -0.02045 0.02045
148 2S 0.00000 0.00000 -0.18134 -0.18134 0.18134
149 3S 0.00000 0.00000 0.29948 0.29948 -0.29948
150 4S 0.00000 0.00000 0.19005 0.19005 -0.19005
151 5S 0.00000 0.00000 -0.08180 -0.08180 0.08180
152 6PX 0.00549 0.00651 0.01900 0.00418 -0.01900
153 6PY -0.00838 0.00150 0.00418 0.01900 -0.01900
154 6PZ -0.00289 0.00801 -0.01900 -0.01900 0.00418
155 7PX 0.04161 0.04934 -0.09664 0.00423 0.09664
156 7PY -0.06353 0.01137 0.00423 -0.09664 0.09664
157 7PZ -0.02192 0.06070 0.09664 0.09664 0.00423
158 8PX 0.03396 0.04027 -0.00503 0.37365 0.00503
159 8PY -0.05186 0.00928 0.37365 -0.00503 0.00503
160 8PZ -0.01789 0.04955 0.00503 0.00503 0.37365
161 9PX -0.21668 -0.25690 0.10017 -0.05329 -0.10017
162 9PY 0.33082 -0.05920 -0.05329 0.10017 -0.10017
163 9PZ 0.11414 -0.31610 -0.10017 -0.10017 -0.05329
164 10D 0 0.01962 -0.05434 0.11613 0.11613 0.23227
165 10D+1 0.08885 -0.01590 -0.05264 0.03099 -0.03099
166 10D-1 -0.05820 -0.06900 0.03099 -0.05264 -0.03099
167 10D+2 0.05434 0.01962 0.20115 -0.20115 0.00000
168 10D-2 0.03066 -0.08490 -0.03099 -0.03099 -0.05264
169 11D 0 0.02481 -0.06870 -0.16487 -0.16487 -0.32975
170 11D+1 -0.09455 0.01692 0.16539 -0.07467 0.07467
171 11D-1 0.06192 0.07342 -0.07467 0.16539 0.07467
172 11D+2 0.06870 0.02481 -0.28557 0.28557 0.00000
173 11D-2 -0.03262 0.09034 0.07467 0.07467 0.16539
174 12D 0 0.05837 -0.16165 -0.06474 -0.06474 -0.12947
175 12D+1 0.32269 -0.05774 -0.11763 0.06999 -0.06999
176 12D-1 -0.21135 -0.25059 0.06999 -0.11763 -0.06999
177 12D+2 0.16165 0.05837 -0.11213 0.11213 0.00000
178 12D-2 0.11134 -0.30833 -0.06999 -0.06999 -0.11763
179 13F 0 0.14604 -0.40444 -0.09828 -0.09828 -0.23301
180 13F+1 0.28742 0.10205 -0.13382 0.14269 -0.01345
181 13F-1 -0.28631 -0.10513 0.14269 -0.13382 -0.01345
182 13F+2 -0.18312 -0.06612 0.09314 -0.09314 0.00000
183 13F-2 0.00000 0.00000 0.01118 0.01118 -0.01118
184 13F+3 -0.12804 -0.33672 0.02066 -0.18421 -0.13473
185 13F-3 -0.31363 0.17724 0.18421 -0.02066 0.13473
186 14F 0 -0.14464 0.40055 0.08794 0.08794 0.20085
187 14F+1 -0.26357 -0.11886 0.06881 -0.12299 -0.03889
188 14F-1 0.27870 0.07695 -0.12299 0.06881 -0.03889
189 14F+2 0.14852 0.05363 -0.01892 0.01892 0.00000
190 14F-2 0.00000 0.00000 0.06359 0.06359 -0.06359
191 14F+3 0.14315 0.31970 -0.05793 0.15878 0.08111
192 14F-3 0.31438 -0.15449 -0.15878 0.05793 -0.08111
193 15G 0 0.02393 -0.06627 -0.26432 -0.26432 0.21460
194 15G+1 0.03176 0.07390 -0.00633 -0.14637 -0.03067
195 15G-1 -0.07165 0.03656 -0.14637 -0.00633 -0.03067
196 15G+2 -0.10267 -0.03707 0.04447 -0.04447 0.00000
197 15G-2 -0.01753 0.04854 -0.16363 -0.16363 0.01789
198 15G+3 0.04230 -0.03765 -0.01674 -0.11960 0.18652
199 15G-3 0.00849 0.05599 0.11960 0.01674 -0.18652
200 15G+4 -0.02832 0.07842 -0.18978 -0.18978 0.24860
201 15G-4 0.07877 0.02844 0.09463 -0.09463 0.00000
202 4 H 1S 0.00000 0.00000 -0.02045 0.02045 -0.02045
203 2S 0.00000 0.00000 -0.18134 0.18134 -0.18134
204 3S 0.00000 0.00000 0.29948 -0.29948 0.29948
205 4S 0.00000 0.00000 0.19005 -0.19005 0.19005
206 5S 0.00000 0.00000 -0.08180 0.08180 -0.08180
207 6PX -0.00549 -0.00651 -0.01900 0.00418 -0.01900
208 6PY -0.00838 0.00150 0.00418 -0.01900 0.01900
209 6PZ 0.00289 -0.00801 0.01900 -0.01900 0.00418
210 7PX -0.04161 -0.04934 0.09664 0.00423 0.09664
211 7PY -0.06353 0.01137 0.00423 0.09664 -0.09664
212 7PZ 0.02192 -0.06070 -0.09664 0.09664 0.00423
213 8PX -0.03396 -0.04027 0.00503 0.37365 0.00503
214 8PY -0.05186 0.00928 0.37365 0.00503 -0.00503
215 8PZ 0.01789 -0.04955 -0.00503 0.00503 0.37365
216 9PX 0.21668 0.25690 -0.10017 -0.05329 -0.10017
217 9PY 0.33082 -0.05920 -0.05329 -0.10017 0.10017
218 9PZ -0.11414 0.31610 0.10017 -0.10017 -0.05329
219 10D 0 0.01962 -0.05434 0.11613 -0.11613 -0.23227
220 10D+1 0.08885 -0.01590 -0.05264 -0.03099 0.03099
221 10D-1 0.05820 0.06900 -0.03099 -0.05264 -0.03099
222 10D+2 0.05434 0.01962 0.20115 0.20115 0.00000
223 10D-2 -0.03066 0.08490 0.03099 -0.03099 -0.05264
224 11D 0 0.02481 -0.06870 -0.16487 0.16487 0.32975
225 11D+1 -0.09455 0.01692 0.16539 0.07467 -0.07467
226 11D-1 -0.06192 -0.07342 0.07467 0.16539 0.07467
227 11D+2 0.06870 0.02481 -0.28557 -0.28557 0.00000
228 11D-2 0.03262 -0.09034 -0.07467 0.07467 0.16539
229 12D 0 0.05837 -0.16165 -0.06474 0.06474 0.12947
230 12D+1 0.32269 -0.05774 -0.11763 -0.06999 0.06999
231 12D-1 0.21135 0.25059 -0.06999 -0.11763 -0.06999
232 12D+2 0.16165 0.05837 -0.11213 -0.11213 0.00000
233 12D-2 -0.11134 0.30833 0.06999 -0.06999 -0.11763
234 13F 0 -0.14604 0.40444 0.09828 -0.09828 -0.23301
235 13F+1 -0.28742 -0.10205 0.13382 0.14269 -0.01345
236 13F-1 -0.28631 -0.10513 0.14269 0.13382 0.01345
237 13F+2 0.18312 0.06612 -0.09314 -0.09314 0.00000
238 13F-2 0.00000 0.00000 0.01118 -0.01118 0.01118
239 13F+3 0.12804 0.33672 -0.02066 -0.18421 -0.13473
240 13F-3 -0.31363 0.17724 0.18421 0.02066 -0.13473
241 14F 0 0.14464 -0.40055 -0.08794 0.08794 0.20085
242 14F+1 0.26357 0.11886 -0.06881 -0.12299 -0.03889
243 14F-1 0.27870 0.07695 -0.12299 -0.06881 0.03889
244 14F+2 -0.14852 -0.05363 0.01892 0.01892 0.00000
245 14F-2 0.00000 0.00000 0.06359 -0.06359 0.06359
246 14F+3 -0.14315 -0.31970 0.05793 0.15878 0.08111
247 14F-3 0.31438 -0.15449 -0.15878 -0.05793 0.08111
248 15G 0 0.02393 -0.06627 -0.26432 0.26432 -0.21460
249 15G+1 0.03176 0.07390 -0.00633 0.14637 0.03067
250 15G-1 0.07165 -0.03656 0.14637 -0.00633 -0.03067
251 15G+2 -0.10267 -0.03707 0.04447 0.04447 0.00000
252 15G-2 0.01753 -0.04854 0.16363 -0.16363 0.01789
253 15G+3 0.04230 -0.03765 -0.01674 0.11960 -0.18652
254 15G-3 -0.00849 -0.05599 -0.11960 0.01674 -0.18652
255 15G+4 -0.02832 0.07842 -0.18978 0.18978 -0.24860
256 15G-4 -0.07877 -0.02844 -0.09463 -0.09463 0.00000
257 5 H 1S 0.00000 0.00000 0.02045 -0.02045 -0.02045
258 2S 0.00000 0.00000 0.18134 -0.18134 -0.18134
259 3S 0.00000 0.00000 -0.29948 0.29948 0.29948
260 4S 0.00000 0.00000 -0.19005 0.19005 0.19005
261 5S 0.00000 0.00000 0.08180 -0.08180 -0.08180
262 6PX 0.00549 0.00651 -0.01900 0.00418 0.01900
263 6PY 0.00838 -0.00150 0.00418 -0.01900 -0.01900
264 6PZ 0.00289 -0.00801 -0.01900 0.01900 0.00418
265 7PX 0.04161 0.04934 0.09664 0.00423 -0.09664
266 7PY 0.06353 -0.01137 0.00423 0.09664 0.09664
267 7PZ 0.02192 -0.06070 0.09664 -0.09664 0.00423
268 8PX 0.03396 0.04027 0.00503 0.37365 -0.00503
269 8PY 0.05186 -0.00928 0.37365 0.00503 0.00503
270 8PZ 0.01789 -0.04955 0.00503 -0.00503 0.37365
271 9PX -0.21668 -0.25690 -0.10017 -0.05329 0.10017
272 9PY -0.33082 0.05920 -0.05329 -0.10017 -0.10017
273 9PZ -0.11414 0.31610 -0.10017 0.10017 -0.05329
274 10D 0 0.01962 -0.05434 -0.11613 0.11613 -0.23227
275 10D+1 -0.08885 0.01590 -0.05264 -0.03099 -0.03099
276 10D-1 -0.05820 -0.06900 -0.03099 -0.05264 0.03099
277 10D+2 0.05434 0.01962 -0.20115 -0.20115 0.00000
278 10D-2 -0.03066 0.08490 -0.03099 0.03099 -0.05264
279 11D 0 0.02481 -0.06870 0.16487 -0.16487 0.32975
280 11D+1 0.09455 -0.01692 0.16539 0.07467 0.07467
281 11D-1 0.06192 0.07342 0.07467 0.16539 -0.07467
282 11D+2 0.06870 0.02481 0.28557 0.28557 0.00000
283 11D-2 0.03262 -0.09034 0.07467 -0.07467 0.16539
284 12D 0 0.05837 -0.16165 0.06474 -0.06474 0.12947
285 12D+1 -0.32269 0.05774 -0.11763 -0.06999 -0.06999
286 12D-1 -0.21135 -0.25059 -0.06999 -0.11763 0.06999
287 12D+2 0.16165 0.05837 0.11213 0.11213 0.00000
288 12D-2 -0.11134 0.30833 -0.06999 0.06999 -0.11763
289 13F 0 -0.14604 0.40444 -0.09828 0.09828 -0.23301
290 13F+1 0.28742 0.10205 0.13382 0.14269 0.01345
291 13F-1 0.28631 0.10513 0.14269 0.13382 -0.01345
292 13F+2 0.18312 0.06612 0.09314 0.09314 0.00000
293 13F-2 0.00000 0.00000 -0.01118 0.01118 0.01118
294 13F+3 -0.12804 -0.33672 -0.02066 -0.18421 0.13473
295 13F-3 0.31363 -0.17724 0.18421 0.02066 0.13473
296 14F 0 0.14464 -0.40055 0.08794 -0.08794 0.20085
297 14F+1 -0.26357 -0.11886 -0.06881 -0.12299 0.03889
298 14F-1 -0.27870 -0.07695 -0.12299 -0.06881 -0.03889
299 14F+2 -0.14852 -0.05363 -0.01892 -0.01892 0.00000
300 14F-2 0.00000 0.00000 -0.06359 0.06359 0.06359
301 14F+3 0.14315 0.31970 0.05793 0.15878 -0.08111
302 14F-3 -0.31438 0.15449 -0.15878 -0.05793 -0.08111
303 15G 0 0.02393 -0.06627 0.26432 -0.26432 -0.21460
304 15G+1 -0.03176 -0.07390 -0.00633 0.14637 -0.03067
305 15G-1 -0.07165 0.03656 0.14637 -0.00633 0.03067
306 15G+2 -0.10267 -0.03707 -0.04447 -0.04447 0.00000
307 15G-2 0.01753 -0.04854 -0.16363 0.16363 0.01789
308 15G+3 -0.04230 0.03765 -0.01674 0.11960 0.18652
309 15G-3 0.00849 0.05599 -0.11960 0.01674 0.18652
310 15G+4 -0.02832 0.07842 0.18978 -0.18978 -0.24860
311 15G-4 -0.07877 -0.02844 0.09463 0.09463 0.00000
236 237 238 239 240
(T2)--V (T2)--V (T2)--V (A1)--V (T1)--V
Eigenvalues -- 13.56129 13.56129 13.56129 13.64170 13.99825
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2 2S 0.00000 0.00000 0.00000 0.04147 0.00000
3 3S 0.00000 0.00000 0.00000 -0.06450 0.00000
4 4S 0.00000 0.00000 0.00000 0.55089 0.00000
5 5S 0.00000 0.00000 0.00000 1.59549 0.00000
6 6S 0.00000 0.00000 0.00000 0.00629 0.00000
7 7PX 0.00000 0.00000 -0.07720 0.00000 0.00000
8 7PY -0.07720 0.00000 0.00000 0.00000 0.00000
9 7PZ 0.00000 -0.07720 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 0.36501 0.00000 0.00000
11 8PY 0.36501 0.00000 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.36501 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 3.84289 0.00000 0.00000
14 9PY 3.84289 0.00000 0.00000 0.00000 0.00000
15 9PZ 0.00000 3.84289 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 0.91813 0.00000 0.00000
17 10PY 0.91813 0.00000 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.91813 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.16758 0.00000 0.00000
20 11PY 0.16758 0.00000 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.16758 0.00000 0.00000 0.00000
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23 12D+1 0.02190 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.02190 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.02190 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.28288 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.28288 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.28288 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 1.98169 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 1.98169 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 1.98169 0.00000 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.07869 0.00000 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.07869 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.07869 0.00000 0.00000 0.00000
42 16F 0 0.00000 -0.16198 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.09919 0.00000 -0.24975
44 16F-1 0.09919 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 -0.07640 0.00000
47 16F+3 0.00000 0.00000 -0.12805 0.00000 -0.19345
48 16F-3 0.12805 0.00000 0.00000 0.00000 0.00000
49 17F 0 0.00000 -0.06370 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.03901 0.00000 0.52516
51 17F-1 0.03901 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 0.42331 0.00000
54 17F+3 0.00000 0.00000 -0.05036 0.00000 0.40679
55 17F-3 0.05036 0.00000 0.00000 0.00000 0.00000
56 18F 0 0.00000 0.40508 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 -0.24806 0.00000 -0.29174
58 18F-1 -0.24806 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 0.30972 0.00000
61 18F+3 0.00000 0.00000 0.32024 0.00000 -0.22598
62 18F-3 -0.32024 0.00000 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 -0.03500 0.00000
64 19G+1 0.00033 0.00000 0.00000 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00033 0.00000 0.22467
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 -0.00094 0.00000 0.00000 0.00000
68 19G+3 0.00088 0.00000 0.00000 0.00000 0.00000
69 19G-3 0.00000 0.00000 -0.00088 0.00000 0.08492
70 19G+4 0.00000 0.00000 0.00000 -0.02958 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 0.25275 0.00000
73 20G+1 0.08439 0.00000 0.00000 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.08439 0.00000 0.12609
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 -0.23869 0.00000 0.00000 0.00000
77 20G+3 0.22328 0.00000 0.00000 0.00000 0.00000
78 20G-3 0.00000 0.00000 -0.22328 0.00000 0.04766
79 20G+4 0.00000 0.00000 0.00000 0.21362 0.00000
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 0.00852 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 0.12856 0.00000 -0.01399
83 21H-1 0.12856 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 0.16835 0.00000 0.00647
87 21H-3 -0.16835 0.00000 0.00000 0.00000 0.00000
88 21H+4 0.00000 0.21724 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 0.04891 0.00000 0.01448
91 21H-5 0.04891 0.00000 0.00000 0.00000 0.00000
92 2 H 1S 0.02988 0.02988 0.02988 0.21167 0.00000
93 2S 0.49677 0.49677 0.49677 -0.22748 0.00000
94 3S -2.22896 -2.22896 -2.22896 -0.51033 0.00000
95 4S -1.21985 -1.21985 -1.21985 -0.11808 0.00000
96 5S -0.05803 -0.05803 -0.05803 0.02380 0.00000
97 6PX 0.01760 0.01760 0.06700 0.01990 0.00000
98 6PY 0.06700 0.01760 0.01760 0.01990 0.04296
99 6PZ 0.01760 0.06700 0.01760 0.01990 -0.04296
100 7PX -0.18718 -0.18718 -0.20236 -0.01679 0.00000
101 7PY -0.20236 -0.18718 -0.18718 -0.01679 -0.00054
102 7PZ -0.18718 -0.20236 -0.18718 -0.01679 0.00054
103 8PX 0.87178 0.87178 0.92913 0.21125 0.00000
104 8PY 0.92913 0.87178 0.87178 0.21125 0.08204
105 8PZ 0.87178 0.92913 0.87178 0.21125 -0.08204
106 9PX 0.54839 0.54839 0.50630 0.00990 0.00000
107 9PY 0.50630 0.54839 0.54839 0.00990 -0.05806
108 9PZ 0.54839 0.50630 0.54839 0.00990 0.05806
109 10D 0 0.04480 -0.08959 0.04480 0.00000 -0.35450
110 10D+1 0.12590 -0.21364 -0.21364 -0.01590 0.34127
111 10D-1 -0.21364 -0.21364 0.12590 -0.01590 0.00000
112 10D+2 0.07759 0.00000 -0.07759 0.00000 -0.20467
113 10D-2 -0.21364 0.12590 -0.21364 -0.01590 -0.34127
114 11D 0 -0.03791 0.07582 -0.03791 0.00000 0.47013
115 11D+1 -0.12754 0.08506 0.08506 -0.02488 -0.27113
116 11D-1 0.08506 0.08506 -0.12754 -0.02488 0.00000
117 11D+2 -0.06567 0.00000 0.06567 0.00000 0.27143
118 11D-2 0.08506 -0.12754 0.08506 -0.02488 0.27113
119 12D 0 0.08806 -0.17613 0.08806 0.00000 -0.22160
120 12D+1 -0.49365 -0.33909 -0.33909 -0.04789 0.23205
121 12D-1 -0.33909 -0.33909 -0.49365 -0.04789 0.00000
122 12D+2 0.15253 0.00000 -0.15253 0.00000 -0.12794
123 12D-2 -0.33909 -0.49365 -0.33909 -0.04789 -0.23205
124 13F 0 0.13968 -0.29195 0.13968 0.15738 -0.19398
125 13F+1 -0.24071 0.06964 0.17879 -0.09637 -0.03587
126 13F-1 0.17879 0.06964 -0.24071 -0.09637 -0.17065
127 13F+2 -0.19628 0.00000 0.19628 0.00000 -0.06560
128 13F-2 -0.11032 -0.11032 -0.11032 0.04765 0.00000
129 13F+3 -0.00977 0.23062 -0.23081 0.12442 -0.02778
130 13F-3 0.23081 -0.23062 0.00977 -0.12442 -0.11319
131 14F 0 -0.15257 0.18483 -0.15257 -0.15743 0.14864
132 14F+1 0.19358 -0.00672 -0.11318 0.09641 -0.03872
133 14F-1 -0.11318 -0.00672 0.19358 0.09641 0.09075
134 14F+2 0.12668 0.00000 -0.12668 0.00000 -0.00034
135 14F-2 0.18173 0.18173 0.18173 -0.05963 0.00000
136 14F+3 -0.04305 -0.19819 0.14612 -0.12446 -0.02999
137 14F-3 -0.14612 0.19819 0.04305 0.12446 0.11772
138 15G 0 -0.08503 -0.06399 -0.08503 0.34872 -0.04143
139 15G+1 0.06472 0.04099 0.03310 -0.01840 -0.09130
140 15G-1 0.03310 0.04099 0.06472 -0.01840 -0.14471
141 15G+2 0.01882 0.00000 -0.01882 0.00000 0.03706
142 15G-2 -0.10479 -0.18306 -0.10479 0.05206 -0.04587
143 15G+3 0.17124 0.09653 0.09951 -0.04869 -0.01453
144 15G-3 -0.09951 -0.09653 -0.17124 0.04869 -0.05470
145 15G+4 -0.05764 -0.08254 -0.05764 0.29472 0.04902
146 15G-4 -0.00422 0.00000 0.00422 0.00000 -0.08026
147 3 H 1S -0.02988 0.02988 -0.02988 0.21167 0.00000
148 2S -0.49677 0.49677 -0.49677 -0.22748 0.00000
149 3S 2.22896 -2.22896 2.22896 -0.51033 0.00000
150 4S 1.21985 -1.21985 1.21985 -0.11808 0.00000
151 5S 0.05803 -0.05803 0.05803 0.02380 0.00000
152 6PX 0.01760 -0.01760 0.06700 -0.01990 0.00000
153 6PY 0.06700 -0.01760 0.01760 -0.01990 0.04296
154 6PZ -0.01760 0.06700 -0.01760 0.01990 0.04296
155 7PX -0.18718 0.18718 -0.20236 0.01679 0.00000
156 7PY -0.20236 0.18718 -0.18718 0.01679 -0.00054
157 7PZ 0.18718 -0.20236 0.18718 -0.01679 -0.00054
158 8PX 0.87178 -0.87178 0.92913 -0.21125 0.00000
159 8PY 0.92913 -0.87178 0.87178 -0.21125 0.08204
160 8PZ -0.87178 0.92913 -0.87178 0.21125 0.08204
161 9PX 0.54839 -0.54839 0.50630 -0.00990 0.00000
162 9PY 0.50630 -0.54839 0.54839 -0.00990 -0.05806
163 9PZ -0.54839 0.50630 -0.54839 0.00990 -0.05806
164 10D 0 -0.04480 -0.08959 -0.04480 0.00000 0.35450
165 10D+1 0.12590 0.21364 -0.21364 0.01590 0.34127
166 10D-1 -0.21364 0.21364 0.12590 0.01590 0.00000
167 10D+2 -0.07759 0.00000 0.07759 0.00000 0.20467
168 10D-2 0.21364 0.12590 0.21364 -0.01590 0.34127
169 11D 0 0.03791 0.07582 0.03791 0.00000 -0.47013
170 11D+1 -0.12754 -0.08506 0.08506 0.02488 -0.27113
171 11D-1 0.08506 -0.08506 -0.12754 0.02488 0.00000
172 11D+2 0.06567 0.00000 -0.06567 0.00000 -0.27143
173 11D-2 -0.08506 -0.12754 -0.08506 -0.02488 -0.27113
174 12D 0 -0.08806 -0.17613 -0.08806 0.00000 0.22160
175 12D+1 -0.49365 0.33909 -0.33909 0.04789 0.23205
176 12D-1 -0.33909 0.33909 -0.49365 0.04789 0.00000
177 12D+2 -0.15253 0.00000 0.15253 0.00000 0.12794
178 12D-2 0.33909 -0.49365 0.33909 -0.04789 0.23205
179 13F 0 -0.13968 -0.29195 -0.13968 0.15738 0.19398
180 13F+1 -0.24071 -0.06964 0.17879 0.09637 -0.03587
181 13F-1 0.17879 -0.06964 -0.24071 0.09637 -0.17065
182 13F+2 0.19628 0.00000 -0.19628 0.00000 0.06560
183 13F-2 0.11032 -0.11032 0.11032 0.04765 0.00000
184 13F+3 -0.00977 -0.23062 -0.23081 -0.12442 -0.02778
185 13F-3 0.23081 0.23062 0.00977 0.12442 -0.11319
186 14F 0 0.15257 0.18483 0.15257 -0.15743 -0.14864
187 14F+1 0.19358 0.00672 -0.11318 -0.09641 -0.03872
188 14F-1 -0.11318 0.00672 0.19358 -0.09641 0.09075
189 14F+2 -0.12668 0.00000 0.12668 0.00000 0.00034
190 14F-2 -0.18173 0.18173 -0.18173 -0.05963 0.00000
191 14F+3 -0.04305 0.19819 0.14612 0.12446 -0.02999
192 14F-3 -0.14612 -0.19819 0.04305 -0.12446 0.11772
193 15G 0 0.08503 -0.06399 0.08503 0.34872 0.04143
194 15G+1 0.06472 -0.04099 0.03310 0.01840 -0.09130
195 15G-1 0.03310 -0.04099 0.06472 0.01840 -0.14471
196 15G+2 -0.01882 0.00000 0.01882 0.00000 -0.03706
197 15G-2 0.10479 -0.18306 0.10479 0.05206 0.04587
198 15G+3 0.17124 -0.09653 0.09951 0.04869 -0.01453
199 15G-3 -0.09951 0.09653 -0.17124 -0.04869 -0.05470
200 15G+4 0.05764 -0.08254 0.05764 0.29472 -0.04902
201 15G-4 0.00422 0.00000 -0.00422 0.00000 0.08026
202 4 H 1S -0.02988 -0.02988 0.02988 0.21167 0.00000
203 2S -0.49677 -0.49677 0.49677 -0.22748 0.00000
204 3S 2.22896 2.22896 -2.22896 -0.51033 0.00000
205 4S 1.21985 1.21985 -1.21985 -0.11808 0.00000
206 5S 0.05803 0.05803 -0.05803 0.02380 0.00000
207 6PX -0.01760 -0.01760 0.06700 0.01990 0.00000
208 6PY 0.06700 0.01760 -0.01760 -0.01990 -0.04296
209 6PZ 0.01760 0.06700 -0.01760 -0.01990 0.04296
210 7PX 0.18718 0.18718 -0.20236 -0.01679 0.00000
211 7PY -0.20236 -0.18718 0.18718 0.01679 0.00054
212 7PZ -0.18718 -0.20236 0.18718 0.01679 -0.00054
213 8PX -0.87178 -0.87178 0.92913 0.21125 0.00000
214 8PY 0.92913 0.87178 -0.87178 -0.21125 -0.08204
215 8PZ 0.87178 0.92913 -0.87178 -0.21125 0.08204
216 9PX -0.54839 -0.54839 0.50630 0.00990 0.00000
217 9PY 0.50630 0.54839 -0.54839 -0.00990 0.05806
218 9PZ 0.54839 0.50630 -0.54839 -0.00990 -0.05806
219 10D 0 -0.04480 0.08959 0.04480 0.00000 -0.35450
220 10D+1 0.12590 -0.21364 0.21364 0.01590 -0.34127
221 10D-1 0.21364 0.21364 0.12590 -0.01590 0.00000
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223 10D-2 -0.21364 0.12590 0.21364 0.01590 0.34127
224 11D 0 0.03791 -0.07582 -0.03791 0.00000 0.47013
225 11D+1 -0.12754 0.08506 -0.08506 0.02488 0.27113
226 11D-1 -0.08506 -0.08506 -0.12754 -0.02488 0.00000
227 11D+2 0.06567 0.00000 0.06567 0.00000 0.27143
228 11D-2 0.08506 -0.12754 -0.08506 0.02488 -0.27113
229 12D 0 -0.08806 0.17613 0.08806 0.00000 -0.22160
230 12D+1 -0.49365 -0.33909 0.33909 0.04789 -0.23205
231 12D-1 0.33909 0.33909 -0.49365 -0.04789 0.00000
232 12D+2 -0.15253 0.00000 -0.15253 0.00000 -0.12794
233 12D-2 -0.33909 -0.49365 0.33909 0.04789 0.23205
234 13F 0 0.13968 -0.29195 -0.13968 -0.15738 0.19398
235 13F+1 0.24071 -0.06964 0.17879 -0.09637 -0.03587
236 13F-1 0.17879 0.06964 0.24071 0.09637 0.17065
237 13F+2 -0.19628 0.00000 -0.19628 0.00000 0.06560
238 13F-2 0.11032 0.11032 -0.11032 0.04765 0.00000
239 13F+3 0.00977 -0.23062 -0.23081 0.12442 -0.02778
240 13F-3 0.23081 -0.23062 -0.00977 0.12442 0.11319
241 14F 0 -0.15257 0.18483 0.15257 0.15743 -0.14864
242 14F+1 -0.19358 0.00672 -0.11318 0.09641 -0.03872
243 14F-1 -0.11318 -0.00672 -0.19358 -0.09641 -0.09075
244 14F+2 0.12668 0.00000 0.12668 0.00000 0.00034
245 14F-2 -0.18173 -0.18173 0.18173 -0.05963 0.00000
246 14F+3 0.04305 0.19819 0.14612 -0.12446 -0.02999
247 14F-3 -0.14612 0.19819 -0.04305 -0.12446 -0.11772
248 15G 0 0.08503 0.06399 -0.08503 0.34872 -0.04143
249 15G+1 0.06472 0.04099 -0.03310 0.01840 0.09130
250 15G-1 -0.03310 -0.04099 0.06472 -0.01840 -0.14471
251 15G+2 -0.01882 0.00000 -0.01882 0.00000 0.03706
252 15G-2 -0.10479 -0.18306 0.10479 -0.05206 0.04587
253 15G+3 0.17124 0.09653 -0.09951 0.04869 0.01453
254 15G-3 0.09951 0.09653 -0.17124 0.04869 -0.05470
255 15G+4 0.05764 0.08254 -0.05764 0.29472 0.04902
256 15G-4 -0.00422 0.00000 -0.00422 0.00000 0.08026
257 5 H 1S 0.02988 -0.02988 -0.02988 0.21167 0.00000
258 2S 0.49677 -0.49677 -0.49677 -0.22748 0.00000
259 3S -2.22896 2.22896 2.22896 -0.51033 0.00000
260 4S -1.21985 1.21985 1.21985 -0.11808 0.00000
261 5S -0.05803 0.05803 0.05803 0.02380 0.00000
262 6PX -0.01760 0.01760 0.06700 -0.01990 0.00000
263 6PY 0.06700 -0.01760 -0.01760 0.01990 -0.04296
264 6PZ -0.01760 0.06700 0.01760 -0.01990 -0.04296
265 7PX 0.18718 -0.18718 -0.20236 0.01679 0.00000
266 7PY -0.20236 0.18718 0.18718 -0.01679 0.00054
267 7PZ 0.18718 -0.20236 -0.18718 0.01679 0.00054
268 8PX -0.87178 0.87178 0.92913 -0.21125 0.00000
269 8PY 0.92913 -0.87178 -0.87178 0.21125 -0.08204
270 8PZ -0.87178 0.92913 0.87178 -0.21125 -0.08204
271 9PX -0.54839 0.54839 0.50630 -0.00990 0.00000
272 9PY 0.50630 -0.54839 -0.54839 0.00990 0.05806
273 9PZ -0.54839 0.50630 0.54839 -0.00990 0.05806
274 10D 0 0.04480 0.08959 -0.04480 0.00000 0.35450
275 10D+1 0.12590 0.21364 0.21364 -0.01590 -0.34127
276 10D-1 0.21364 -0.21364 0.12590 0.01590 0.00000
277 10D+2 0.07759 0.00000 0.07759 0.00000 0.20467
278 10D-2 0.21364 0.12590 -0.21364 0.01590 -0.34127
279 11D 0 -0.03791 -0.07582 0.03791 0.00000 -0.47013
280 11D+1 -0.12754 -0.08506 -0.08506 -0.02488 0.27113
281 11D-1 -0.08506 0.08506 -0.12754 0.02488 0.00000
282 11D+2 -0.06567 0.00000 -0.06567 0.00000 -0.27143
283 11D-2 -0.08506 -0.12754 0.08506 0.02488 0.27113
284 12D 0 0.08806 0.17613 -0.08806 0.00000 0.22160
285 12D+1 -0.49365 0.33909 0.33909 -0.04789 -0.23205
286 12D-1 0.33909 -0.33909 -0.49365 0.04789 0.00000
287 12D+2 0.15253 0.00000 0.15253 0.00000 0.12794
288 12D-2 0.33909 -0.49365 -0.33909 0.04789 -0.23205
289 13F 0 -0.13968 -0.29195 0.13968 -0.15738 -0.19398
290 13F+1 0.24071 0.06964 0.17879 0.09637 -0.03587
291 13F-1 0.17879 -0.06964 0.24071 -0.09637 0.17065
292 13F+2 0.19628 0.00000 0.19628 0.00000 -0.06560
293 13F-2 -0.11032 0.11032 0.11032 0.04765 0.00000
294 13F+3 0.00977 0.23062 -0.23081 -0.12442 -0.02778
295 13F-3 0.23081 0.23062 -0.00977 -0.12442 0.11319
296 14F 0 0.15257 0.18483 -0.15257 0.15743 0.14864
297 14F+1 -0.19358 -0.00672 -0.11318 -0.09641 -0.03872
298 14F-1 -0.11318 0.00672 -0.19358 0.09641 -0.09075
299 14F+2 -0.12668 0.00000 -0.12668 0.00000 -0.00034
300 14F-2 0.18173 -0.18173 -0.18173 -0.05963 0.00000
301 14F+3 0.04305 -0.19819 0.14612 0.12446 -0.02999
302 14F-3 -0.14612 -0.19819 -0.04305 0.12446 -0.11772
303 15G 0 -0.08503 0.06399 0.08503 0.34872 0.04143
304 15G+1 0.06472 -0.04099 -0.03310 -0.01840 0.09130
305 15G-1 -0.03310 0.04099 0.06472 0.01840 -0.14471
306 15G+2 0.01882 0.00000 0.01882 0.00000 -0.03706
307 15G-2 0.10479 -0.18306 -0.10479 -0.05206 -0.04587
308 15G+3 0.17124 -0.09653 -0.09951 -0.04869 0.01453
309 15G-3 0.09951 -0.09653 -0.17124 -0.04869 -0.05470
310 15G+4 -0.05764 0.08254 0.05764 0.29472 -0.04902
311 15G-4 0.00422 0.00000 0.00422 0.00000 -0.08026
241 242 243 244 245
(T1)--V (T1)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 13.99825 13.99825 14.07913 14.07913 14.07913
1 1 C 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 0.00000 0.00000 0.01806
8 7PY 0.00000 0.00000 0.01806 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.01806 0.00000
10 8PX 0.00000 0.00000 0.00000 0.00000 -0.20130
11 8PY 0.00000 0.00000 -0.20130 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 -0.20130 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 0.98736
14 9PY 0.00000 0.00000 0.98736 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.98736 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 2.92285
17 10PY 0.00000 0.00000 2.92285 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 2.92285 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 0.10032
20 11PY 0.00000 0.00000 0.10032 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.10032 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 -0.12549 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 -0.12549
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 -0.12549 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.17294 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.17294
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.17294 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.94733 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.94733
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.94733 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 1.13841 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 0.00000 1.13841
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 1.13841 0.00000
42 16F 0 0.00000 0.00000 0.00000 0.06089 0.00000
43 16F+1 0.00000 0.00000 0.00000 0.00000 -0.03729
44 16F-1 0.00000 -0.24975 -0.03729 0.00000 0.00000
45 16F+2 -0.31591 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 0.04814
48 16F-3 0.00000 0.19345 -0.04814 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.05201 0.00000
50 17F+1 0.00000 0.00000 0.00000 0.00000 -0.03185
51 17F-1 0.00000 0.52516 -0.03185 0.00000 0.00000
52 17F+2 0.66428 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 0.04112
55 17F-3 0.00000 -0.40679 -0.04112 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.80806 0.00000
57 18F+1 0.00000 0.00000 0.00000 0.00000 -0.49483
58 18F-1 0.00000 -0.29174 -0.49483 0.00000 0.00000
59 18F+2 -0.36903 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 0.63883
62 18F-3 0.00000 0.22598 -0.63883 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.22467 -0.00017 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00000 -0.00017
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00047 0.00000
68 19G+3 0.00000 -0.08492 -0.00044 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.00044
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
71 19G-4 0.24018 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 0.12609 -0.03694 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.00000 0.00000 -0.03694
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.10449 0.00000
77 20G+3 0.00000 -0.04766 -0.09774 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.00000 0.09774
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
80 20G-4 0.13480 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 -0.01992 0.00000
82 21H+1 0.00000 0.00000 0.00000 0.00000 -0.09104
83 21H-1 0.00000 -0.01399 -0.09104 0.00000 0.00000
84 21H+2 0.02114 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 -0.10262
87 21H-3 0.00000 -0.00647 0.10262 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 -0.14210 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 -0.04206
91 21H-5 0.00000 0.01448 -0.04206 0.00000 0.00000
92 2 H 1S 0.00000 0.00000 -0.03297 -0.03297 -0.03297
93 2S 0.00000 0.00000 0.05160 0.05160 0.05160
94 3S 0.00000 0.00000 -0.80048 -0.80048 -0.80048
95 4S 0.00000 0.00000 -1.62472 -1.62472 -1.62472
96 5S 0.00000 0.00000 0.10639 0.10639 0.10639
97 6PX -0.04296 0.04296 -0.01010 -0.01010 0.01701
98 6PY 0.04296 0.00000 0.01701 -0.01010 -0.01010
99 6PZ 0.00000 -0.04296 -0.01010 0.01701 -0.01010
100 7PX 0.00054 -0.00054 0.04085 0.04085 0.05062
101 7PY -0.00054 0.00000 0.05062 0.04085 0.04085
102 7PZ 0.00000 0.00054 0.04085 0.05062 0.04085
103 8PX -0.08204 0.08204 0.19659 0.19659 0.02713
104 8PY 0.08204 0.00000 0.02713 0.19659 0.19659
105 8PZ 0.00000 -0.08204 0.19659 0.02713 0.19659
106 9PX 0.05806 -0.05806 0.28196 0.28196 0.13611
107 9PY -0.05806 0.00000 0.13611 0.28196 0.28196
108 9PZ 0.00000 0.05806 0.28196 0.13611 0.28196
109 10D 0 0.00000 -0.35450 0.20885 -0.41771 0.20885
110 10D+1 0.34127 0.00000 -0.44441 0.23935 0.23935
111 10D-1 -0.34127 0.34127 0.23935 0.23935 -0.44441
112 10D+2 -0.40935 0.20467 0.36175 0.00000 -0.36175
113 10D-2 0.00000 -0.34127 0.23935 -0.44441 0.23935
114 11D 0 0.00000 0.47013 -0.20664 0.41328 -0.20664
115 11D+1 -0.27113 0.00000 0.40518 -0.28125 -0.28125
116 11D-1 0.27113 -0.27113 -0.28125 -0.28125 0.40518
117 11D+2 0.54286 -0.27143 -0.35792 0.00000 0.35792
118 11D-2 0.00000 0.27113 -0.28125 0.40518 -0.28125
119 12D 0 0.00000 -0.22160 0.19295 -0.38589 0.19295
120 12D+1 0.23205 0.00000 -0.48470 0.28241 0.28241
121 12D-1 -0.23205 0.23205 0.28241 0.28241 -0.48470
122 12D+2 -0.25589 0.12794 0.33419 0.00000 -0.33419
123 12D-2 0.00000 -0.23205 0.28241 -0.48470 0.28241
124 13F 0 0.00000 -0.19398 0.08729 -0.17666 0.08729
125 13F+1 0.06693 -0.17065 -0.09758 -0.00932 0.10818
126 13F-1 -0.06693 -0.03587 0.10818 -0.00932 -0.09758
127 13F+2 -0.04537 0.06560 -0.05582 0.00000 0.05582
128 13F-2 0.00000 0.00000 -0.00445 -0.00445 -0.00445
129 13F+3 -0.19352 0.11319 0.03482 0.10319 -0.13966
130 13F-3 -0.19352 0.02778 0.13966 -0.10319 -0.03482
131 14F 0 0.00000 0.14864 -0.13183 0.24506 -0.13183
132 14F+1 -0.09129 0.09075 0.14269 0.01877 -0.15007
133 14F-1 0.09129 -0.03872 -0.15007 0.01877 0.14269
134 14F+2 -0.04898 0.00034 0.07837 0.00000 -0.07837
135 14F-2 0.00000 0.00000 0.00181 0.00181 0.00181
136 14F+3 0.11730 -0.11772 -0.05623 -0.15221 0.19374
137 14F-3 0.11730 0.02999 -0.19374 0.15221 0.05623
138 15G 0 0.00000 -0.04143 0.06088 -0.10274 0.06088
139 15G+1 0.05886 -0.14471 -0.00143 -0.08409 0.09777
140 15G-1 -0.05886 -0.09130 0.09777 -0.08409 -0.00143
141 15G+2 0.07412 -0.03706 -0.14634 0.00000 0.14634
142 15G-2 0.00000 -0.04587 -0.01935 0.00406 -0.01935
143 15G+3 -0.07129 0.05470 -0.00380 0.05247 -0.01627
144 15G-3 -0.07129 0.01453 0.01627 -0.05247 0.00380
145 15G+4 0.00000 0.04902 -0.05917 0.13442 -0.05917
146 15G-4 -0.15471 0.08026 0.09721 0.00000 -0.09721
147 3 H 1S 0.00000 0.00000 0.03297 -0.03297 0.03297
148 2S 0.00000 0.00000 -0.05160 0.05160 -0.05160
149 3S 0.00000 0.00000 0.80048 -0.80048 0.80048
150 4S 0.00000 0.00000 1.62472 -1.62472 1.62472
151 5S 0.00000 0.00000 -0.10639 0.10639 -0.10639
152 6PX 0.04296 0.04296 -0.01010 0.01010 0.01701
153 6PY -0.04296 0.00000 0.01701 0.01010 -0.01010
154 6PZ 0.00000 0.04296 0.01010 0.01701 0.01010
155 7PX -0.00054 -0.00054 0.04085 -0.04085 0.05062
156 7PY 0.00054 0.00000 0.05062 -0.04085 0.04085
157 7PZ 0.00000 -0.00054 -0.04085 0.05062 -0.04085
158 8PX 0.08204 0.08204 0.19659 -0.19659 0.02713
159 8PY -0.08204 0.00000 0.02713 -0.19659 0.19659
160 8PZ 0.00000 0.08204 -0.19659 0.02713 -0.19659
161 9PX -0.05806 -0.05806 0.28196 -0.28196 0.13611
162 9PY 0.05806 0.00000 0.13611 -0.28196 0.28196
163 9PZ 0.00000 -0.05806 -0.28196 0.13611 -0.28196
164 10D 0 0.00000 0.35450 -0.20885 -0.41771 -0.20885
165 10D+1 -0.34127 0.00000 -0.44441 -0.23935 0.23935
166 10D-1 0.34127 0.34127 0.23935 -0.23935 -0.44441
167 10D+2 -0.40935 -0.20467 -0.36175 0.00000 0.36175
168 10D-2 0.00000 0.34127 -0.23935 -0.44441 -0.23935
169 11D 0 0.00000 -0.47013 0.20664 0.41328 0.20664
170 11D+1 0.27113 0.00000 0.40518 0.28125 -0.28125
171 11D-1 -0.27113 -0.27113 -0.28125 0.28125 0.40518
172 11D+2 0.54286 0.27143 0.35792 0.00000 -0.35792
173 11D-2 0.00000 -0.27113 0.28125 0.40518 0.28125
174 12D 0 0.00000 0.22160 -0.19295 -0.38589 -0.19295
175 12D+1 -0.23205 0.00000 -0.48470 -0.28241 0.28241
176 12D-1 0.23205 0.23205 0.28241 -0.28241 -0.48470
177 12D+2 -0.25589 -0.12794 -0.33419 0.00000 0.33419
178 12D-2 0.00000 0.23205 -0.28241 -0.48470 -0.28241
179 13F 0 0.00000 0.19398 -0.08729 -0.17666 -0.08729
180 13F+1 -0.06693 -0.17065 -0.09758 0.00932 0.10818
181 13F-1 0.06693 -0.03587 0.10818 0.00932 -0.09758
182 13F+2 -0.04537 -0.06560 0.05582 0.00000 -0.05582
183 13F-2 0.00000 0.00000 0.00445 -0.00445 0.00445
184 13F+3 0.19352 0.11319 0.03482 -0.10319 -0.13966
185 13F-3 0.19352 0.02778 0.13966 0.10319 -0.03482
186 14F 0 0.00000 -0.14864 0.13183 0.24506 0.13183
187 14F+1 0.09129 0.09075 0.14269 -0.01877 -0.15007
188 14F-1 -0.09129 -0.03872 -0.15007 -0.01877 0.14269
189 14F+2 -0.04898 -0.00034 -0.07837 0.00000 0.07837
190 14F-2 0.00000 0.00000 -0.00181 0.00181 -0.00181
191 14F+3 -0.11730 -0.11772 -0.05623 0.15221 0.19374
192 14F-3 -0.11730 0.02999 -0.19374 -0.15221 0.05623
193 15G 0 0.00000 0.04143 -0.06088 -0.10274 -0.06088
194 15G+1 -0.05886 -0.14471 -0.00143 0.08409 0.09777
195 15G-1 0.05886 -0.09130 0.09777 0.08409 -0.00143
196 15G+2 0.07412 0.03706 0.14634 0.00000 -0.14634
197 15G-2 0.00000 0.04587 0.01935 0.00406 0.01935
198 15G+3 0.07129 0.05470 -0.00380 -0.05247 -0.01627
199 15G-3 0.07129 0.01453 0.01627 0.05247 0.00380
200 15G+4 0.00000 -0.04902 0.05917 0.13442 0.05917
201 15G-4 -0.15471 -0.08026 -0.09721 0.00000 0.09721
202 4 H 1S 0.00000 0.00000 0.03297 0.03297 -0.03297
203 2S 0.00000 0.00000 -0.05160 -0.05160 0.05160
204 3S 0.00000 0.00000 0.80048 0.80048 -0.80048
205 4S 0.00000 0.00000 1.62472 1.62472 -1.62472
206 5S 0.00000 0.00000 -0.10639 -0.10639 0.10639
207 6PX 0.04296 -0.04296 0.01010 0.01010 0.01701
208 6PY 0.04296 0.00000 0.01701 -0.01010 0.01010
209 6PZ 0.00000 -0.04296 -0.01010 0.01701 0.01010
210 7PX -0.00054 0.00054 -0.04085 -0.04085 0.05062
211 7PY -0.00054 0.00000 0.05062 0.04085 -0.04085
212 7PZ 0.00000 0.00054 0.04085 0.05062 -0.04085
213 8PX 0.08204 -0.08204 -0.19659 -0.19659 0.02713
214 8PY 0.08204 0.00000 0.02713 0.19659 -0.19659
215 8PZ 0.00000 -0.08204 0.19659 0.02713 -0.19659
216 9PX -0.05806 0.05806 -0.28196 -0.28196 0.13611
217 9PY -0.05806 0.00000 0.13611 0.28196 -0.28196
218 9PZ 0.00000 0.05806 0.28196 0.13611 -0.28196
219 10D 0 0.00000 0.35450 -0.20885 0.41771 0.20885
220 10D+1 0.34127 0.00000 -0.44441 0.23935 -0.23935
221 10D-1 0.34127 -0.34127 -0.23935 -0.23935 -0.44441
222 10D+2 0.40935 -0.20467 -0.36175 0.00000 -0.36175
223 10D-2 0.00000 -0.34127 0.23935 -0.44441 -0.23935
224 11D 0 0.00000 -0.47013 0.20664 -0.41328 -0.20664
225 11D+1 -0.27113 0.00000 0.40518 -0.28125 0.28125
226 11D-1 -0.27113 0.27113 0.28125 0.28125 0.40518
227 11D+2 -0.54286 0.27143 0.35792 0.00000 0.35792
228 11D-2 0.00000 0.27113 -0.28125 0.40518 0.28125
229 12D 0 0.00000 0.22160 -0.19295 0.38589 0.19295
230 12D+1 0.23205 0.00000 -0.48470 0.28241 -0.28241
231 12D-1 0.23205 -0.23205 -0.28241 -0.28241 -0.48470
232 12D+2 0.25589 -0.12794 -0.33419 0.00000 -0.33419
233 12D-2 0.00000 -0.23205 0.28241 -0.48470 -0.28241
234 13F 0 0.00000 -0.19398 0.08729 -0.17666 -0.08729
235 13F+1 -0.06693 0.17065 0.09758 0.00932 0.10818
236 13F-1 -0.06693 -0.03587 0.10818 -0.00932 0.09758
237 13F+2 -0.04537 0.06560 -0.05582 0.00000 -0.05582
238 13F-2 0.00000 0.00000 0.00445 0.00445 -0.00445
239 13F+3 0.19352 -0.11319 -0.03482 -0.10319 -0.13966
240 13F-3 -0.19352 0.02778 0.13966 -0.10319 0.03482
241 14F 0 0.00000 0.14864 -0.13183 0.24506 0.13183
242 14F+1 0.09129 -0.09075 -0.14269 -0.01877 -0.15007
243 14F-1 0.09129 -0.03872 -0.15007 0.01877 -0.14269
244 14F+2 -0.04898 0.00034 0.07837 0.00000 0.07837
245 14F-2 0.00000 0.00000 -0.00181 -0.00181 0.00181
246 14F+3 -0.11730 0.11772 0.05623 0.15221 0.19374
247 14F-3 0.11730 0.02999 -0.19374 0.15221 -0.05623
248 15G 0 0.00000 0.04143 -0.06088 0.10274 0.06088
249 15G+1 0.05886 -0.14471 -0.00143 -0.08409 -0.09777
250 15G-1 0.05886 0.09130 -0.09777 0.08409 -0.00143
251 15G+2 -0.07412 0.03706 0.14634 0.00000 0.14634
252 15G-2 0.00000 -0.04587 -0.01935 0.00406 0.01935
253 15G+3 -0.07129 0.05470 -0.00380 0.05247 0.01627
254 15G-3 0.07129 -0.01453 -0.01627 0.05247 0.00380
255 15G+4 0.00000 -0.04902 0.05917 -0.13442 -0.05917
256 15G-4 -0.15471 0.08026 0.09721 0.00000 0.09721
257 5 H 1S 0.00000 0.00000 -0.03297 0.03297 0.03297
258 2S 0.00000 0.00000 0.05160 -0.05160 -0.05160
259 3S 0.00000 0.00000 -0.80048 0.80048 0.80048
260 4S 0.00000 0.00000 -1.62472 1.62472 1.62472
261 5S 0.00000 0.00000 0.10639 -0.10639 -0.10639
262 6PX -0.04296 -0.04296 0.01010 -0.01010 0.01701
263 6PY -0.04296 0.00000 0.01701 0.01010 0.01010
264 6PZ 0.00000 0.04296 0.01010 0.01701 -0.01010
265 7PX 0.00054 0.00054 -0.04085 0.04085 0.05062
266 7PY 0.00054 0.00000 0.05062 -0.04085 -0.04085
267 7PZ 0.00000 -0.00054 -0.04085 0.05062 0.04085
268 8PX -0.08204 -0.08204 -0.19659 0.19659 0.02713
269 8PY -0.08204 0.00000 0.02713 -0.19659 -0.19659
270 8PZ 0.00000 0.08204 -0.19659 0.02713 0.19659
271 9PX 0.05806 0.05806 -0.28196 0.28196 0.13611
272 9PY 0.05806 0.00000 0.13611 -0.28196 -0.28196
273 9PZ 0.00000 -0.05806 -0.28196 0.13611 0.28196
274 10D 0 0.00000 -0.35450 0.20885 0.41771 -0.20885
275 10D+1 -0.34127 0.00000 -0.44441 -0.23935 -0.23935
276 10D-1 -0.34127 -0.34127 -0.23935 0.23935 -0.44441
277 10D+2 0.40935 0.20467 0.36175 0.00000 0.36175
278 10D-2 0.00000 0.34127 -0.23935 -0.44441 0.23935
279 11D 0 0.00000 0.47013 -0.20664 -0.41328 0.20664
280 11D+1 0.27113 0.00000 0.40518 0.28125 0.28125
281 11D-1 0.27113 0.27113 0.28125 -0.28125 0.40518
282 11D+2 -0.54286 -0.27143 -0.35792 0.00000 -0.35792
283 11D-2 0.00000 -0.27113 0.28125 0.40518 -0.28125
284 12D 0 0.00000 -0.22160 0.19295 0.38589 -0.19295
285 12D+1 -0.23205 0.00000 -0.48470 -0.28241 -0.28241
286 12D-1 -0.23205 -0.23205 -0.28241 0.28241 -0.48470
287 12D+2 0.25589 0.12794 0.33419 0.00000 0.33419
288 12D-2 0.00000 0.23205 -0.28241 -0.48470 0.28241
289 13F 0 0.00000 0.19398 -0.08729 -0.17666 0.08729
290 13F+1 0.06693 0.17065 0.09758 -0.00932 0.10818
291 13F-1 0.06693 -0.03587 0.10818 0.00932 0.09758
292 13F+2 -0.04537 -0.06560 0.05582 0.00000 0.05582
293 13F-2 0.00000 0.00000 -0.00445 0.00445 0.00445
294 13F+3 -0.19352 -0.11319 -0.03482 0.10319 -0.13966
295 13F-3 0.19352 0.02778 0.13966 0.10319 0.03482
296 14F 0 0.00000 -0.14864 0.13183 0.24506 -0.13183
297 14F+1 -0.09129 -0.09075 -0.14269 0.01877 -0.15007
298 14F-1 -0.09129 -0.03872 -0.15007 -0.01877 -0.14269
299 14F+2 -0.04898 -0.00034 -0.07837 0.00000 -0.07837
300 14F-2 0.00000 0.00000 0.00181 -0.00181 -0.00181
301 14F+3 0.11730 0.11772 0.05623 -0.15221 0.19374
302 14F-3 -0.11730 0.02999 -0.19374 -0.15221 -0.05623
303 15G 0 0.00000 -0.04143 0.06088 0.10274 -0.06088
304 15G+1 -0.05886 -0.14471 -0.00143 0.08409 -0.09777
305 15G-1 -0.05886 0.09130 -0.09777 -0.08409 -0.00143
306 15G+2 -0.07412 -0.03706 -0.14634 0.00000 -0.14634
307 15G-2 0.00000 0.04587 0.01935 0.00406 -0.01935
308 15G+3 0.07129 0.05470 -0.00380 -0.05247 0.01627
309 15G-3 -0.07129 -0.01453 -0.01627 -0.05247 0.00380
310 15G+4 0.00000 0.04902 -0.05917 -0.13442 0.05917
311 15G-4 -0.15471 -0.08026 -0.09721 0.00000 -0.09721
246 247 248 249 250
(T1)--V (T1)--V (T1)--V (E)--V (E)--V
Eigenvalues -- 14.22870 14.22870 14.22870 14.26544 14.26544
1 1 C 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 0.00000 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 -0.22687 -0.02390
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 0.02390 -0.22687
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.73335 0.07726
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 -0.07726 0.73335
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.54995 0.05794
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 -0.05794 0.54995
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 1.41850 0.14945
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 -0.14945 1.41850
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 0.15771 0.00000 0.00000 0.00000 0.00000
44 16F-1 0.00000 0.15771 0.00000 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.19949 0.00000 0.00000
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.12216 0.00000 0.00000 0.00000 0.00000
48 16F-3 0.00000 -0.12216 0.00000 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 -0.33476 0.00000 0.00000 0.00000 0.00000
51 17F-1 0.00000 -0.33476 0.00000 0.00000 0.00000
52 17F+2 0.00000 0.00000 -0.42344 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 -0.25930 0.00000 0.00000 0.00000 0.00000
55 17F-3 0.00000 0.25930 0.00000 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.45094 0.00000 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.45094 0.00000 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.57039 0.00000 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.34929 0.00000 0.00000 0.00000 0.00000
62 18F-3 0.00000 -0.34929 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.16423 0.01730
64 19G+1 0.00000 0.19599 0.00000 0.00000 0.00000
65 19G-1 0.19599 0.00000 0.00000 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.02680 -0.25442
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
68 19G+3 0.00000 -0.07408 0.00000 0.00000 0.00000
69 19G-3 0.07408 0.00000 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 -0.19432 -0.02047
71 19G-4 0.00000 0.00000 0.20953 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 -0.13691 -0.01442
73 20G+1 0.00000 -0.39893 0.00000 0.00000 0.00000
74 20G-1 -0.39893 0.00000 0.00000 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 -0.02235 0.21209
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
77 20G+3 0.00000 0.15078 0.00000 0.00000 0.00000
78 20G-3 -0.15078 0.00000 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 0.16199 0.01707
80 20G-4 0.00000 0.00000 -0.42647 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 -0.18827 0.00000 0.00000 0.00000 0.00000
83 21H-1 0.00000 -0.18827 0.00000 0.00000 0.00000
84 21H+2 0.00000 0.00000 0.28463 0.00000 0.00000
85 21H-2 0.00000 0.00000 0.00000 0.01211 0.00128
86 21H+3 0.08715 0.00000 0.00000 0.00000 0.00000
87 21H-3 0.00000 -0.08715 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 -0.00128 0.01211
90 21H+5 0.19488 0.00000 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.19488 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 0.06047 -0.06047 0.00015 -0.00021
98 6PY 0.06047 0.00000 0.06047 0.00010 0.00023
99 6PZ -0.06047 -0.06047 0.00000 -0.00025 -0.00003
100 7PX 0.00000 -0.04139 0.04139 -0.00664 0.00913
101 7PY -0.04139 0.00000 -0.04139 -0.00459 -0.01031
102 7PZ 0.04139 0.04139 0.00000 0.01122 0.00118
103 8PX 0.00000 -0.06221 0.06221 0.05477 -0.07535
104 8PY -0.06221 0.00000 -0.06221 0.03787 0.08511
105 8PZ 0.06221 0.06221 0.00000 -0.09264 -0.00976
106 9PX 0.00000 0.04238 -0.04238 0.42127 -0.57953
107 9PY 0.04238 0.00000 0.04238 0.29125 0.65460
108 9PZ -0.04238 -0.04238 0.00000 -0.71252 -0.07507
109 10D 0 0.35227 0.35227 0.00000 0.12349 0.01301
110 10D+1 0.20638 0.00000 0.20638 0.16144 0.36285
111 10D-1 0.00000 0.20638 -0.20638 0.23352 -0.32124
112 10D+2 0.20338 -0.20338 0.40677 -0.01301 0.12349
113 10D-2 -0.20638 -0.20638 0.00000 -0.39496 -0.04161
114 11D 0 -0.31687 -0.31687 0.00000 -0.15773 -0.01662
115 11D+1 -0.20610 0.00000 -0.20610 -0.16803 -0.37765
116 11D-1 0.00000 -0.20610 0.20610 -0.24304 0.33434
117 11D+2 -0.18294 0.18294 -0.36589 0.01662 -0.15773
118 11D-2 0.20610 0.20610 0.00000 0.41107 0.04331
119 12D 0 0.09743 0.09743 0.00000 0.47105 0.04963
120 12D+1 -0.17832 0.00000 -0.17832 0.15125 0.33994
121 12D-1 0.00000 -0.17832 0.17832 0.21877 -0.30095
122 12D+2 0.05625 -0.05625 0.11250 -0.04963 0.47105
123 12D-2 0.17832 0.17832 0.00000 -0.37002 -0.03898
124 13F 0 0.00203 0.00203 0.00000 0.16756 0.01765
125 13F+1 -0.21465 -0.17968 -0.18217 0.16548 -0.00727
126 13F-1 -0.17968 -0.21465 0.18217 0.16033 0.04159
127 13F+2 -0.22886 0.22886 -0.27151 -0.01717 0.16300
128 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
129 13F+3 -0.16627 -0.14175 -0.13854 0.00287 0.16676
130 13F-3 0.14175 0.16627 -0.13854 -0.03756 0.16250
131 14F 0 -0.09316 -0.09316 0.00000 -0.18212 -0.01919
132 14F+1 0.25128 0.12382 0.23791 -0.22299 -0.02345
133 14F-1 0.12382 0.25128 -0.23791 -0.22298 -0.02353
134 14F+2 0.22878 -0.22878 0.31784 0.02573 -0.24424
135 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
136 14F+3 0.19464 0.21375 0.06645 -0.03652 -0.20553
137 14F-3 -0.21375 -0.19464 0.06645 0.07855 -0.19341
138 15G 0 0.10283 0.10283 0.00000 -0.16573 -0.01746
139 15G+1 -0.03310 0.12958 0.01486 0.09798 0.03202
140 15G-1 0.12958 -0.03310 -0.01486 0.10250 -0.01090
141 15G+2 -0.09198 0.09198 -0.18395 -0.02705 0.25675
142 15G-2 -0.02580 -0.02580 0.00000 0.19433 0.02047
143 15G+3 -0.01507 -0.04898 -0.03319 0.04789 0.17876
144 15G-3 0.04898 0.01507 -0.03319 -0.08409 0.16485
145 15G+4 -0.12167 -0.12167 0.00000 0.19609 0.02066
146 15G-4 -0.02564 0.02564 0.13853 -0.00857 0.08133
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 0.06047 0.06047 -0.00015 0.00021
153 6PY 0.06047 0.00000 -0.06047 -0.00010 -0.00023
154 6PZ 0.06047 0.06047 0.00000 -0.00025 -0.00003
155 7PX 0.00000 -0.04139 -0.04139 0.00664 -0.00913
156 7PY -0.04139 0.00000 0.04139 0.00459 0.01031
157 7PZ -0.04139 -0.04139 0.00000 0.01122 0.00118
158 8PX 0.00000 -0.06221 -0.06221 -0.05477 0.07535
159 8PY -0.06221 0.00000 0.06221 -0.03787 -0.08511
160 8PZ -0.06221 -0.06221 0.00000 -0.09264 -0.00976
161 9PX 0.00000 0.04238 0.04238 -0.42127 0.57953
162 9PY 0.04238 0.00000 -0.04238 -0.29125 -0.65460
163 9PZ 0.04238 0.04238 0.00000 -0.71252 -0.07507
164 10D 0 -0.35227 -0.35227 0.00000 0.12349 0.01301
165 10D+1 0.20638 0.00000 -0.20638 -0.16144 -0.36285
166 10D-1 0.00000 0.20638 0.20638 -0.23352 0.32124
167 10D+2 -0.20338 0.20338 0.40677 -0.01301 0.12349
168 10D-2 0.20638 0.20638 0.00000 -0.39496 -0.04161
169 11D 0 0.31687 0.31687 0.00000 -0.15773 -0.01662
170 11D+1 -0.20610 0.00000 0.20610 0.16803 0.37765
171 11D-1 0.00000 -0.20610 -0.20610 0.24304 -0.33434
172 11D+2 0.18294 -0.18294 -0.36589 0.01662 -0.15773
173 11D-2 -0.20610 -0.20610 0.00000 0.41107 0.04331
174 12D 0 -0.09743 -0.09743 0.00000 0.47105 0.04963
175 12D+1 -0.17832 0.00000 0.17832 -0.15125 -0.33994
176 12D-1 0.00000 -0.17832 -0.17832 -0.21877 0.30095
177 12D+2 -0.05625 0.05625 0.11250 -0.04963 0.47105
178 12D-2 -0.17832 -0.17832 0.00000 -0.37002 -0.03898
179 13F 0 -0.00203 -0.00203 0.00000 0.16756 0.01765
180 13F+1 -0.21465 -0.17968 0.18217 -0.16548 0.00727
181 13F-1 -0.17968 -0.21465 -0.18217 -0.16033 -0.04159
182 13F+2 0.22886 -0.22886 -0.27151 -0.01717 0.16300
183 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
184 13F+3 -0.16627 -0.14175 0.13854 -0.00287 -0.16676
185 13F-3 0.14175 0.16627 0.13854 0.03756 -0.16250
186 14F 0 0.09316 0.09316 0.00000 -0.18212 -0.01919
187 14F+1 0.25128 0.12382 -0.23791 0.22299 0.02345
188 14F-1 0.12382 0.25128 0.23791 0.22298 0.02353
189 14F+2 -0.22878 0.22878 0.31784 0.02573 -0.24424
190 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
191 14F+3 0.19464 0.21375 -0.06645 0.03652 0.20553
192 14F-3 -0.21375 -0.19464 -0.06645 -0.07855 0.19341
193 15G 0 -0.10283 -0.10283 0.00000 -0.16573 -0.01746
194 15G+1 -0.03310 0.12958 -0.01486 -0.09798 -0.03202
195 15G-1 0.12958 -0.03310 0.01486 -0.10250 0.01090
196 15G+2 0.09198 -0.09198 -0.18395 -0.02705 0.25675
197 15G-2 0.02580 0.02580 0.00000 0.19433 0.02047
198 15G+3 -0.01507 -0.04898 0.03319 -0.04789 -0.17876
199 15G-3 0.04898 0.01507 0.03319 0.08409 -0.16485
200 15G+4 0.12167 0.12167 0.00000 0.19609 0.02066
201 15G-4 0.02564 -0.02564 0.13853 -0.00857 0.08133
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 -0.06047 0.06047 0.00015 -0.00021
208 6PY -0.06047 0.00000 0.06047 -0.00010 -0.00023
209 6PZ 0.06047 -0.06047 0.00000 0.00025 0.00003
210 7PX 0.00000 0.04139 -0.04139 -0.00664 0.00913
211 7PY 0.04139 0.00000 -0.04139 0.00459 0.01031
212 7PZ -0.04139 0.04139 0.00000 -0.01122 -0.00118
213 8PX 0.00000 0.06221 -0.06221 0.05477 -0.07535
214 8PY 0.06221 0.00000 -0.06221 -0.03787 -0.08511
215 8PZ -0.06221 0.06221 0.00000 0.09264 0.00976
216 9PX 0.00000 -0.04238 0.04238 0.42127 -0.57953
217 9PY -0.04238 0.00000 0.04238 -0.29125 -0.65460
218 9PZ 0.04238 -0.04238 0.00000 0.71252 0.07507
219 10D 0 0.35227 -0.35227 0.00000 0.12349 0.01301
220 10D+1 -0.20638 0.00000 0.20638 -0.16144 -0.36285
221 10D-1 0.00000 -0.20638 0.20638 0.23352 -0.32124
222 10D+2 0.20338 0.20338 -0.40677 -0.01301 0.12349
223 10D-2 0.20638 -0.20638 0.00000 0.39496 0.04161
224 11D 0 -0.31687 0.31687 0.00000 -0.15773 -0.01662
225 11D+1 0.20610 0.00000 -0.20610 0.16803 0.37765
226 11D-1 0.00000 0.20610 -0.20610 -0.24304 0.33434
227 11D+2 -0.18294 -0.18294 0.36589 0.01662 -0.15773
228 11D-2 -0.20610 0.20610 0.00000 -0.41107 -0.04331
229 12D 0 0.09743 -0.09743 0.00000 0.47105 0.04963
230 12D+1 0.17832 0.00000 -0.17832 -0.15125 -0.33994
231 12D-1 0.00000 0.17832 -0.17832 0.21877 -0.30095
232 12D+2 0.05625 0.05625 -0.11250 -0.04963 0.47105
233 12D-2 -0.17832 0.17832 0.00000 0.37002 0.03898
234 13F 0 -0.00203 0.00203 0.00000 -0.16756 -0.01765
235 13F+1 -0.21465 0.17968 0.18217 0.16548 -0.00727
236 13F-1 0.17968 -0.21465 0.18217 -0.16033 -0.04159
237 13F+2 0.22886 0.22886 -0.27151 0.01717 -0.16300
238 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
239 13F+3 -0.16627 0.14175 0.13854 0.00287 0.16676
240 13F-3 -0.14175 0.16627 -0.13854 0.03756 -0.16250
241 14F 0 0.09316 -0.09316 0.00000 0.18212 0.01919
242 14F+1 0.25128 -0.12382 -0.23791 -0.22299 -0.02345
243 14F-1 -0.12382 0.25128 -0.23791 0.22298 0.02353
244 14F+2 -0.22878 -0.22878 0.31784 -0.02573 0.24424
245 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
246 14F+3 0.19464 -0.21375 -0.06645 -0.03652 -0.20553
247 14F-3 0.21375 -0.19464 0.06645 -0.07855 0.19341
248 15G 0 0.10283 -0.10283 0.00000 -0.16573 -0.01746
249 15G+1 0.03310 0.12958 0.01486 -0.09798 -0.03202
250 15G-1 0.12958 0.03310 0.01486 0.10250 -0.01090
251 15G+2 -0.09198 -0.09198 0.18395 -0.02705 0.25675
252 15G-2 0.02580 -0.02580 0.00000 -0.19433 -0.02047
253 15G+3 0.01507 -0.04898 -0.03319 -0.04789 -0.17876
254 15G-3 0.04898 -0.01507 0.03319 -0.08409 0.16485
255 15G+4 -0.12167 0.12167 0.00000 0.19609 0.02066
256 15G-4 0.02564 0.02564 0.13853 0.00857 -0.08133
257 5 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
258 2S 0.00000 0.00000 0.00000 0.00000 0.00000
259 3S 0.00000 0.00000 0.00000 0.00000 0.00000
260 4S 0.00000 0.00000 0.00000 0.00000 0.00000
261 5S 0.00000 0.00000 0.00000 0.00000 0.00000
262 6PX 0.00000 -0.06047 -0.06047 -0.00015 0.00021
263 6PY -0.06047 0.00000 -0.06047 0.00010 0.00023
264 6PZ -0.06047 0.06047 0.00000 0.00025 0.00003
265 7PX 0.00000 0.04139 0.04139 0.00664 -0.00913
266 7PY 0.04139 0.00000 0.04139 -0.00459 -0.01031
267 7PZ 0.04139 -0.04139 0.00000 -0.01122 -0.00118
268 8PX 0.00000 0.06221 0.06221 -0.05477 0.07535
269 8PY 0.06221 0.00000 0.06221 0.03787 0.08511
270 8PZ 0.06221 -0.06221 0.00000 0.09264 0.00976
271 9PX 0.00000 -0.04238 -0.04238 -0.42127 0.57953
272 9PY -0.04238 0.00000 -0.04238 0.29125 0.65460
273 9PZ -0.04238 0.04238 0.00000 0.71252 0.07507
274 10D 0 -0.35227 0.35227 0.00000 0.12349 0.01301
275 10D+1 -0.20638 0.00000 -0.20638 0.16144 0.36285
276 10D-1 0.00000 -0.20638 -0.20638 -0.23352 0.32124
277 10D+2 -0.20338 -0.20338 -0.40677 -0.01301 0.12349
278 10D-2 -0.20638 0.20638 0.00000 0.39496 0.04161
279 11D 0 0.31687 -0.31687 0.00000 -0.15773 -0.01662
280 11D+1 0.20610 0.00000 0.20610 -0.16803 -0.37765
281 11D-1 0.00000 0.20610 0.20610 0.24304 -0.33434
282 11D+2 0.18294 0.18294 0.36589 0.01662 -0.15773
283 11D-2 0.20610 -0.20610 0.00000 -0.41107 -0.04331
284 12D 0 -0.09743 0.09743 0.00000 0.47105 0.04963
285 12D+1 0.17832 0.00000 0.17832 0.15125 0.33994
286 12D-1 0.00000 0.17832 0.17832 -0.21877 0.30095
287 12D+2 -0.05625 -0.05625 -0.11250 -0.04963 0.47105
288 12D-2 0.17832 -0.17832 0.00000 0.37002 0.03898
289 13F 0 0.00203 -0.00203 0.00000 -0.16756 -0.01765
290 13F+1 -0.21465 0.17968 -0.18217 -0.16548 0.00727
291 13F-1 0.17968 -0.21465 -0.18217 0.16033 0.04159
292 13F+2 -0.22886 -0.22886 -0.27151 0.01717 -0.16300
293 13F-2 0.00000 0.00000 0.00000 0.00000 0.00000
294 13F+3 -0.16627 0.14175 -0.13854 -0.00287 -0.16676
295 13F-3 -0.14175 0.16627 0.13854 -0.03756 0.16250
296 14F 0 -0.09316 0.09316 0.00000 0.18212 0.01919
297 14F+1 0.25128 -0.12382 0.23791 0.22299 0.02345
298 14F-1 -0.12382 0.25128 0.23791 -0.22298 -0.02353
299 14F+2 0.22878 0.22878 0.31784 -0.02573 0.24424
300 14F-2 0.00000 0.00000 0.00000 0.00000 0.00000
301 14F+3 0.19464 -0.21375 0.06645 0.03652 0.20553
302 14F-3 0.21375 -0.19464 -0.06645 0.07855 -0.19341
303 15G 0 -0.10283 0.10283 0.00000 -0.16573 -0.01746
304 15G+1 0.03310 0.12958 -0.01486 0.09798 0.03202
305 15G-1 0.12958 0.03310 -0.01486 -0.10250 0.01090
306 15G+2 0.09198 0.09198 0.18395 -0.02705 0.25675
307 15G-2 -0.02580 0.02580 0.00000 -0.19433 -0.02047
308 15G+3 0.01507 -0.04898 0.03319 0.04789 0.17876
309 15G-3 0.04898 -0.01507 -0.03319 0.08409 -0.16485
310 15G+4 0.12167 -0.12167 0.00000 0.19609 0.02066
311 15G-4 -0.02564 -0.02564 0.13853 0.00857 -0.08133
251 252 253 254 255
(E)--V (E)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 14.28900 14.28900 14.35428 14.35428 14.35428
1 1 C 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 0.74451 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 0.74451 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.74451
10 8PX 0.00000 0.00000 -2.84581 0.00000 0.00000
11 8PY 0.00000 0.00000 0.00000 -2.84581 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 -2.84581
13 9PX 0.00000 0.00000 4.17626 0.00000 0.00000
14 9PY 0.00000 0.00000 0.00000 4.17626 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 4.17626
16 10PX 0.00000 0.00000 -1.35013 0.00000 0.00000
17 10PY 0.00000 0.00000 0.00000 -1.35013 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 -1.35013
19 11PX 0.00000 0.00000 -0.28392 0.00000 0.00000
20 11PY 0.00000 0.00000 0.00000 -0.28392 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.28392
22 12D 0 -0.22691 0.12873 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.53974 0.00000
24 12D-1 0.00000 0.00000 0.53974 0.00000 0.00000
25 12D+2 -0.12873 -0.22691 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.53974
27 13D 0 -0.01252 0.00711 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 -1.00437 0.00000
29 13D-1 0.00000 0.00000 -1.00437 0.00000 0.00000
30 13D+2 -0.00711 -0.01252 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 -1.00437
32 14D 0 1.51591 -0.86005 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 1.53627 0.00000
34 14D-1 0.00000 0.00000 1.53627 0.00000 0.00000
35 14D+2 0.86005 1.51591 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 1.53627
37 15D 0 0.01815 -0.01030 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 0.00000 -0.20824 0.00000
39 15D-1 0.00000 0.00000 -0.20824 0.00000 0.00000
40 15D+2 0.01030 0.01815 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 0.00000 -0.20824
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.15307
43 16F+1 0.00000 0.00000 -0.09374 0.00000 0.00000
44 16F-1 0.00000 0.00000 0.00000 -0.09374 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 0.12102 0.00000 0.00000
48 16F-3 0.00000 0.00000 0.00000 -0.12102 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.05268
50 17F+1 0.00000 0.00000 -0.03226 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.00000 -0.03226 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 0.04165 0.00000 0.00000
55 17F-3 0.00000 0.00000 0.00000 -0.04165 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 -0.51424
57 18F+1 0.00000 0.00000 0.31491 0.00000 0.00000
58 18F-1 0.00000 0.00000 0.00000 0.31491 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 -0.40654 0.00000 0.00000
62 18F-3 0.00000 0.00000 0.00000 0.40654 0.00000
63 19G 0 0.26287 -0.14914 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 0.05159 0.00000
65 19G-1 0.00000 0.00000 0.05159 0.00000 0.00000
66 19G+2 -0.23104 -0.40723 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00000 -0.14593
68 19G+3 0.00000 0.00000 0.00000 0.13650 0.00000
69 19G-3 0.00000 0.00000 -0.13650 0.00000 0.00000
70 19G+4 -0.31103 0.17646 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 -0.77967 0.44234 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.00000 -0.58744 0.00000
74 20G-1 0.00000 0.00000 -0.58744 0.00000 0.00000
75 20G+2 0.68527 1.20786 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.00000 1.66153
77 20G+3 0.00000 0.00000 0.00000 -1.55422 0.00000
78 20G-3 0.00000 0.00000 1.55422 0.00000 0.00000
79 20G+4 0.92252 -0.52339 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 -0.43859
82 21H+1 0.00000 0.00000 -0.39440 0.00000 0.00000
83 21H-1 0.00000 0.00000 0.00000 -0.39440 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 21H-2 0.34050 -0.19318 0.00000 0.00000 0.00000
86 21H+3 0.00000 0.00000 -0.02349 0.00000 0.00000
87 21H-3 0.00000 0.00000 0.00000 0.02349 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 -0.31783
89 21H-4 0.19318 0.34050 0.00000 0.00000 0.00000
90 21H+5 0.00000 0.00000 -0.37052 0.00000 0.00000
91 21H-5 0.00000 0.00000 0.00000 -0.37052 0.00000
92 2 H 1S 0.00000 0.00000 0.40714 0.40714 0.40714
93 2S 0.00000 0.00000 -1.63666 -1.63666 -1.63666
94 3S 0.00000 0.00000 -0.23363 -0.23363 -0.23363
95 4S 0.00000 0.00000 1.55325 1.55325 1.55325
96 5S 0.00000 0.00000 0.05270 0.05270 0.05270
97 6PX 0.00014 -0.01813 -0.11421 -0.01897 -0.01897
98 6PY 0.01563 0.00918 -0.01897 -0.11421 -0.01897
99 6PZ -0.01577 0.00895 -0.01897 -0.01897 -0.11421
100 7PX 0.00025 -0.03296 0.23034 0.28732 0.28732
101 7PY 0.02842 0.01670 0.28732 0.23034 0.28732
102 7PZ -0.02867 0.01627 0.28732 0.28732 0.23034
103 8PX 0.00517 -0.68643 -0.63889 0.25912 0.25912
104 8PY 0.59188 0.34770 0.25912 -0.63889 0.25912
105 8PZ -0.59705 0.33873 0.25912 0.25912 -0.63889
106 9PX -0.00020 0.02648 -0.36875 -0.55952 -0.55952
107 9PY -0.02284 -0.01342 -0.55952 -0.36875 -0.55952
108 9PZ 0.02304 -0.01307 -0.55952 -0.55952 -0.36875
109 10D 0 -0.49938 0.28332 -0.00536 -0.00536 0.01073
110 10D+1 0.22060 0.12959 0.06973 0.22317 0.06973
111 10D-1 0.00193 -0.25584 0.22317 0.06973 0.06973
112 10D+2 -0.28332 -0.49938 0.00929 -0.00929 0.00000
113 10D-2 -0.22253 0.12625 0.06973 0.06973 0.22317
114 11D 0 0.79481 -0.45093 -0.14470 -0.14470 0.28940
115 11D+1 -0.13571 -0.07972 0.08415 -0.35476 0.08415
116 11D-1 -0.00119 0.15739 -0.35476 0.08415 0.08415
117 11D+2 0.45093 0.79481 0.25063 -0.25063 0.00000
118 11D-2 0.13690 -0.07767 0.08415 0.08415 -0.35476
119 12D 0 0.01080 -0.00613 -0.04896 -0.04896 0.09791
120 12D+1 0.03867 0.02272 0.22343 0.25668 0.22343
121 12D-1 0.00034 -0.04485 0.25668 0.22343 0.22343
122 12D+2 0.00613 0.01080 0.08480 -0.08480 0.00000
123 12D-2 -0.03901 0.02213 0.22343 0.22343 0.25668
124 13F 0 0.00188 -0.00107 0.13927 0.13927 0.05623
125 13F+1 -0.13449 -0.00234 -0.03444 0.02431 -0.19488
126 13F-1 -0.06699 0.11665 0.02431 -0.03444 -0.19488
127 13F+2 -0.08396 -0.14798 -0.13863 0.13863 0.00000
128 13F-2 0.00000 0.00000 -0.13638 -0.13638 -0.13638
129 13F+3 -0.10420 0.00092 0.04446 0.19499 0.02521
130 13F-3 0.05425 -0.08897 -0.19499 -0.04446 -0.02521
131 14F 0 -0.11430 0.06485 -0.07352 -0.07352 0.01202
132 14F+1 0.08152 0.08109 -0.00736 0.02865 0.06139
133 14F-1 -0.02779 -0.11158 0.02865 -0.00736 0.06139
134 14F+2 0.05126 0.09036 0.02071 -0.02071 0.00000
135 14F-2 0.00000 0.00000 -0.01408 -0.01408 -0.01408
136 14F+3 0.06440 -0.10341 0.00951 -0.07080 -0.04544
137 14F-3 -0.12180 0.00223 0.07080 -0.00951 0.04544
138 15G 0 -0.01705 0.00968 0.09769 0.09769 0.02191
139 15G+1 -0.11466 0.16143 0.13865 0.06677 -0.13085
140 15G-1 -0.19739 0.01561 0.06677 0.13865 -0.13085
141 15G+2 0.01499 0.02642 0.06778 -0.06778 0.00000
142 15G-2 -0.04205 0.02386 -0.01103 -0.01103 -0.18884
143 15G+3 -0.00123 -0.08720 -0.04061 0.17665 0.06125
144 15G-3 -0.07422 -0.04579 -0.17665 0.04061 -0.06125
145 15G+4 0.02018 -0.01145 0.03132 0.03132 0.12099
146 15G-4 -0.10406 -0.18342 -0.14406 0.14406 0.00000
147 3 H 1S 0.00000 0.00000 -0.40714 -0.40714 0.40714
148 2S 0.00000 0.00000 1.63666 1.63666 -1.63666
149 3S 0.00000 0.00000 0.23363 0.23363 -0.23363
150 4S 0.00000 0.00000 -1.55325 -1.55325 1.55325
151 5S 0.00000 0.00000 -0.05270 -0.05270 0.05270
152 6PX -0.00014 0.01813 -0.11421 -0.01897 0.01897
153 6PY -0.01563 -0.00918 -0.01897 -0.11421 0.01897
154 6PZ -0.01577 0.00895 0.01897 0.01897 -0.11421
155 7PX -0.00025 0.03296 0.23034 0.28732 -0.28732
156 7PY -0.02842 -0.01670 0.28732 0.23034 -0.28732
157 7PZ -0.02867 0.01627 -0.28732 -0.28732 0.23034
158 8PX -0.00517 0.68643 -0.63889 0.25912 -0.25912
159 8PY -0.59188 -0.34770 0.25912 -0.63889 -0.25912
160 8PZ -0.59705 0.33873 -0.25912 -0.25912 -0.63889
161 9PX 0.00020 -0.02648 -0.36875 -0.55952 0.55952
162 9PY 0.02284 0.01342 -0.55952 -0.36875 0.55952
163 9PZ 0.02304 -0.01307 0.55952 0.55952 -0.36875
164 10D 0 -0.49938 0.28332 0.00536 0.00536 0.01073
165 10D+1 -0.22060 -0.12959 0.06973 0.22317 -0.06973
166 10D-1 -0.00193 0.25584 0.22317 0.06973 -0.06973
167 10D+2 -0.28332 -0.49938 -0.00929 0.00929 0.00000
168 10D-2 -0.22253 0.12625 -0.06973 -0.06973 0.22317
169 11D 0 0.79481 -0.45093 0.14470 0.14470 0.28940
170 11D+1 0.13571 0.07972 0.08415 -0.35476 -0.08415
171 11D-1 0.00119 -0.15739 -0.35476 0.08415 -0.08415
172 11D+2 0.45093 0.79481 -0.25063 0.25063 0.00000
173 11D-2 0.13690 -0.07767 -0.08415 -0.08415 -0.35476
174 12D 0 0.01080 -0.00613 0.04896 0.04896 0.09791
175 12D+1 -0.03867 -0.02272 0.22343 0.25668 -0.22343
176 12D-1 -0.00034 0.04485 0.25668 0.22343 -0.22343
177 12D+2 0.00613 0.01080 -0.08480 0.08480 0.00000
178 12D-2 -0.03901 0.02213 -0.22343 -0.22343 0.25668
179 13F 0 0.00188 -0.00107 -0.13927 -0.13927 0.05623
180 13F+1 0.13449 0.00234 -0.03444 0.02431 0.19488
181 13F-1 0.06699 -0.11665 0.02431 -0.03444 0.19488
182 13F+2 -0.08396 -0.14798 0.13863 -0.13863 0.00000
183 13F-2 0.00000 0.00000 0.13638 0.13638 -0.13638
184 13F+3 0.10420 -0.00092 0.04446 0.19499 -0.02521
185 13F-3 -0.05425 0.08897 -0.19499 -0.04446 0.02521
186 14F 0 -0.11430 0.06485 0.07352 0.07352 0.01202
187 14F+1 -0.08152 -0.08109 -0.00736 0.02865 -0.06139
188 14F-1 0.02779 0.11158 0.02865 -0.00736 -0.06139
189 14F+2 0.05126 0.09036 -0.02071 0.02071 0.00000
190 14F-2 0.00000 0.00000 0.01408 0.01408 -0.01408
191 14F+3 -0.06440 0.10341 0.00951 -0.07080 0.04544
192 14F-3 0.12180 -0.00223 0.07080 -0.00951 -0.04544
193 15G 0 -0.01705 0.00968 -0.09769 -0.09769 0.02191
194 15G+1 0.11466 -0.16143 0.13865 0.06677 0.13085
195 15G-1 0.19739 -0.01561 0.06677 0.13865 0.13085
196 15G+2 0.01499 0.02642 -0.06778 0.06778 0.00000
197 15G-2 -0.04205 0.02386 0.01103 0.01103 -0.18884
198 15G+3 0.00123 0.08720 -0.04061 0.17665 -0.06125
199 15G-3 0.07422 0.04579 -0.17665 0.04061 0.06125
200 15G+4 0.02018 -0.01145 -0.03132 -0.03132 0.12099
201 15G-4 -0.10406 -0.18342 0.14406 -0.14406 0.00000
202 4 H 1S 0.00000 0.00000 0.40714 -0.40714 -0.40714
203 2S 0.00000 0.00000 -1.63666 1.63666 1.63666
204 3S 0.00000 0.00000 -0.23363 0.23363 0.23363
205 4S 0.00000 0.00000 1.55325 -1.55325 -1.55325
206 5S 0.00000 0.00000 0.05270 -0.05270 -0.05270
207 6PX 0.00014 -0.01813 -0.11421 0.01897 0.01897
208 6PY -0.01563 -0.00918 0.01897 -0.11421 -0.01897
209 6PZ 0.01577 -0.00895 0.01897 -0.01897 -0.11421
210 7PX 0.00025 -0.03296 0.23034 -0.28732 -0.28732
211 7PY -0.02842 -0.01670 -0.28732 0.23034 0.28732
212 7PZ 0.02867 -0.01627 -0.28732 0.28732 0.23034
213 8PX 0.00517 -0.68643 -0.63889 -0.25912 -0.25912
214 8PY -0.59188 -0.34770 -0.25912 -0.63889 0.25912
215 8PZ 0.59705 -0.33873 -0.25912 0.25912 -0.63889
216 9PX -0.00020 0.02648 -0.36875 0.55952 0.55952
217 9PY 0.02284 0.01342 0.55952 -0.36875 -0.55952
218 9PZ -0.02304 0.01307 0.55952 -0.55952 -0.36875
219 10D 0 -0.49938 0.28332 -0.00536 0.00536 -0.01073
220 10D+1 -0.22060 -0.12959 -0.06973 0.22317 0.06973
221 10D-1 0.00193 -0.25584 0.22317 -0.06973 -0.06973
222 10D+2 -0.28332 -0.49938 0.00929 0.00929 0.00000
223 10D-2 0.22253 -0.12625 -0.06973 0.06973 0.22317
224 11D 0 0.79481 -0.45093 -0.14470 0.14470 -0.28940
225 11D+1 0.13571 0.07972 -0.08415 -0.35476 0.08415
226 11D-1 -0.00119 0.15739 -0.35476 -0.08415 -0.08415
227 11D+2 0.45093 0.79481 0.25063 0.25063 0.00000
228 11D-2 -0.13690 0.07767 -0.08415 0.08415 -0.35476
229 12D 0 0.01080 -0.00613 -0.04896 0.04896 -0.09791
230 12D+1 -0.03867 -0.02272 -0.22343 0.25668 0.22343
231 12D-1 0.00034 -0.04485 0.25668 -0.22343 -0.22343
232 12D+2 0.00613 0.01080 0.08480 0.08480 0.00000
233 12D-2 0.03901 -0.02213 -0.22343 0.22343 0.25668
234 13F 0 -0.00188 0.00107 -0.13927 0.13927 0.05623
235 13F+1 -0.13449 -0.00234 -0.03444 -0.02431 0.19488
236 13F-1 0.06699 -0.11665 -0.02431 -0.03444 -0.19488
237 13F+2 0.08396 0.14798 0.13863 0.13863 0.00000
238 13F-2 0.00000 0.00000 -0.13638 0.13638 0.13638
239 13F+3 -0.10420 0.00092 0.04446 -0.19499 -0.02521
240 13F-3 -0.05425 0.08897 0.19499 -0.04446 -0.02521
241 14F 0 0.11430 -0.06485 0.07352 -0.07352 0.01202
242 14F+1 0.08152 0.08109 -0.00736 -0.02865 -0.06139
243 14F-1 0.02779 0.11158 -0.02865 -0.00736 0.06139
244 14F+2 -0.05126 -0.09036 -0.02071 -0.02071 0.00000
245 14F-2 0.00000 0.00000 -0.01408 0.01408 0.01408
246 14F+3 0.06440 -0.10341 0.00951 0.07080 0.04544
247 14F-3 0.12180 -0.00223 -0.07080 -0.00951 0.04544
248 15G 0 -0.01705 0.00968 0.09769 -0.09769 -0.02191
249 15G+1 0.11466 -0.16143 -0.13865 0.06677 -0.13085
250 15G-1 -0.19739 0.01561 0.06677 -0.13865 0.13085
251 15G+2 0.01499 0.02642 0.06778 0.06778 0.00000
252 15G-2 0.04205 -0.02386 0.01103 -0.01103 -0.18884
253 15G+3 0.00123 0.08720 0.04061 0.17665 0.06125
254 15G-3 -0.07422 -0.04579 -0.17665 -0.04061 0.06125
255 15G+4 0.02018 -0.01145 0.03132 -0.03132 -0.12099
256 15G-4 0.10406 0.18342 0.14406 0.14406 0.00000
257 5 H 1S 0.00000 0.00000 -0.40714 0.40714 -0.40714
258 2S 0.00000 0.00000 1.63666 -1.63666 1.63666
259 3S 0.00000 0.00000 0.23363 -0.23363 0.23363
260 4S 0.00000 0.00000 -1.55325 1.55325 -1.55325
261 5S 0.00000 0.00000 -0.05270 0.05270 -0.05270
262 6PX -0.00014 0.01813 -0.11421 0.01897 -0.01897
263 6PY 0.01563 0.00918 0.01897 -0.11421 0.01897
264 6PZ 0.01577 -0.00895 -0.01897 0.01897 -0.11421
265 7PX -0.00025 0.03296 0.23034 -0.28732 0.28732
266 7PY 0.02842 0.01670 -0.28732 0.23034 -0.28732
267 7PZ 0.02867 -0.01627 0.28732 -0.28732 0.23034
268 8PX -0.00517 0.68643 -0.63889 -0.25912 0.25912
269 8PY 0.59188 0.34770 -0.25912 -0.63889 -0.25912
270 8PZ 0.59705 -0.33873 0.25912 -0.25912 -0.63889
271 9PX 0.00020 -0.02648 -0.36875 0.55952 -0.55952
272 9PY -0.02284 -0.01342 0.55952 -0.36875 0.55952
273 9PZ -0.02304 0.01307 -0.55952 0.55952 -0.36875
274 10D 0 -0.49938 0.28332 0.00536 -0.00536 -0.01073
275 10D+1 0.22060 0.12959 -0.06973 0.22317 -0.06973
276 10D-1 -0.00193 0.25584 0.22317 -0.06973 0.06973
277 10D+2 -0.28332 -0.49938 -0.00929 -0.00929 0.00000
278 10D-2 0.22253 -0.12625 0.06973 -0.06973 0.22317
279 11D 0 0.79481 -0.45093 0.14470 -0.14470 -0.28940
280 11D+1 -0.13571 -0.07972 -0.08415 -0.35476 -0.08415
281 11D-1 0.00119 -0.15739 -0.35476 -0.08415 0.08415
282 11D+2 0.45093 0.79481 -0.25063 -0.25063 0.00000
283 11D-2 -0.13690 0.07767 0.08415 -0.08415 -0.35476
284 12D 0 0.01080 -0.00613 0.04896 -0.04896 -0.09791
285 12D+1 0.03867 0.02272 -0.22343 0.25668 -0.22343
286 12D-1 -0.00034 0.04485 0.25668 -0.22343 0.22343
287 12D+2 0.00613 0.01080 -0.08480 -0.08480 0.00000
288 12D-2 0.03901 -0.02213 0.22343 -0.22343 0.25668
289 13F 0 -0.00188 0.00107 0.13927 -0.13927 0.05623
290 13F+1 0.13449 0.00234 -0.03444 -0.02431 -0.19488
291 13F-1 -0.06699 0.11665 -0.02431 -0.03444 0.19488
292 13F+2 0.08396 0.14798 -0.13863 -0.13863 0.00000
293 13F-2 0.00000 0.00000 0.13638 -0.13638 0.13638
294 13F+3 0.10420 -0.00092 0.04446 -0.19499 0.02521
295 13F-3 0.05425 -0.08897 0.19499 -0.04446 0.02521
296 14F 0 0.11430 -0.06485 -0.07352 0.07352 0.01202
297 14F+1 -0.08152 -0.08109 -0.00736 -0.02865 0.06139
298 14F-1 -0.02779 -0.11158 -0.02865 -0.00736 -0.06139
299 14F+2 -0.05126 -0.09036 0.02071 0.02071 0.00000
300 14F-2 0.00000 0.00000 0.01408 -0.01408 0.01408
301 14F+3 -0.06440 0.10341 0.00951 0.07080 -0.04544
302 14F-3 -0.12180 0.00223 -0.07080 -0.00951 -0.04544
303 15G 0 -0.01705 0.00968 -0.09769 0.09769 -0.02191
304 15G+1 -0.11466 0.16143 -0.13865 0.06677 0.13085
305 15G-1 0.19739 -0.01561 0.06677 -0.13865 -0.13085
306 15G+2 0.01499 0.02642 -0.06778 -0.06778 0.00000
307 15G-2 0.04205 -0.02386 -0.01103 0.01103 -0.18884
308 15G+3 -0.00123 -0.08720 0.04061 0.17665 -0.06125
309 15G-3 0.07422 0.04579 -0.17665 -0.04061 -0.06125
310 15G+4 0.02018 -0.01145 -0.03132 0.03132 -0.12099
311 15G-4 0.10406 0.18342 -0.14406 -0.14406 0.00000
256 257 258 259 260
(A1)--V (T1)--V (T1)--V (T1)--V (T2)--V
Eigenvalues -- 14.35899 14.47305 14.47305 14.47305 14.57177
1 1 C 1S 0.11164 0.00000 0.00000 0.00000 0.00000
2 2S -0.22763 0.00000 0.00000 0.00000 0.00000
3 3S -0.77030 0.00000 0.00000 0.00000 0.00000
4 4S -5.71091 0.00000 0.00000 0.00000 0.00000
5 5S 8.04619 0.00000 0.00000 0.00000 0.00000
6 6S -1.51541 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 0.00000 -0.10064
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 0.31985
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 2.35419
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 2.20654
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 0.02494
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 0.00636
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 -0.40054
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 3.84742
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 0.70576
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 -0.22786 0.00000 0.00000 0.00000
44 16F-1 0.00000 0.00000 -0.22786 0.00000 -0.27583
45 16F+2 0.00000 0.00000 0.00000 -0.28822 0.00000
46 16F-2 -0.61385 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00000 -0.17650 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.00000 0.17650 0.00000 -0.35609
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.59964 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.59964 0.00000 0.42819
52 17F+2 0.00000 0.00000 0.00000 0.75850 0.00000
53 17F-2 1.57357 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.00000 0.46448 0.00000 0.00000 0.00000
55 17F-3 0.00000 0.00000 -0.46448 0.00000 0.55279
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.25647 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.00000 0.25647 0.00000 0.60249
59 18F+2 0.00000 0.00000 0.00000 0.32441 0.00000
60 18F-2 1.80855 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.00000 0.19866 0.00000 0.00000 0.00000
62 18F-3 0.00000 0.00000 -0.19866 0.00000 0.77781
63 19G 0 0.09920 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.07781 0.00000 -0.01611
65 19G-1 0.00000 0.07781 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 -0.02941 0.00000 -0.04262
69 19G-3 0.00000 0.02941 0.00000 0.00000 0.00000
70 19G+4 0.08384 0.00000 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.08318 0.00000
72 20G 0 -0.49900 0.00000 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 1.05738 0.00000 0.21205
74 20G-1 0.00000 1.05738 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 -0.39965 0.00000 0.56104
78 20G-3 0.00000 0.39965 0.00000 0.00000 0.00000
79 20G+4 -0.42173 0.00000 0.00000 0.00000 0.00000
80 20G-4 0.00000 0.00000 0.00000 1.13039 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.00000 -0.13585 0.00000 0.00000 0.00000
83 21H-1 0.00000 0.00000 -0.13585 0.00000 -0.05475
84 21H+2 0.00000 0.00000 0.00000 0.20539 0.00000
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.00000 0.06289 0.00000 0.00000 0.00000
87 21H-3 0.00000 0.00000 -0.06289 0.00000 0.25010
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 0.14062 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.00000 0.14062 0.00000 0.05895
92 2 H 1S 0.55084 0.00000 0.00000 0.00000 0.17181
93 2S -1.37887 0.00000 0.00000 0.00000 -0.21242
94 3S -2.31179 0.00000 0.00000 0.00000 -2.50876
95 4S 0.74513 0.00000 0.00000 0.00000 -0.76741
96 5S 0.15131 0.00000 0.00000 0.00000 0.02197
97 6PX 0.05147 0.00000 0.05444 -0.05444 -0.01187
98 6PY 0.05147 0.05444 0.00000 0.05444 -0.01500
99 6PZ 0.05147 -0.05444 -0.05444 0.00000 -0.01187
100 7PX 0.16729 0.00000 -0.00625 0.00625 0.02975
101 7PY 0.16729 -0.00625 0.00000 -0.00625 0.02120
102 7PZ 0.16729 0.00625 0.00625 0.00000 0.02975
103 8PX 0.36814 0.00000 0.47781 -0.47781 0.28499
104 8PY 0.36814 0.47781 0.00000 0.47781 1.35496
105 8PZ 0.36814 -0.47781 -0.47781 0.00000 0.28499
106 9PX -0.48654 0.00000 0.01893 -0.01893 0.19884
107 9PY -0.48654 0.01893 0.00000 0.01893 -0.00960
108 9PZ -0.48654 -0.01893 -0.01893 0.00000 0.19884
109 10D 0 0.00000 0.12264 0.12264 0.00000 -0.20749
110 10D+1 0.28201 -0.23201 0.00000 -0.23201 0.03181
111 10D-1 0.28201 0.00000 -0.23201 0.23201 0.13887
112 10D+2 0.00000 0.07081 -0.07081 0.14162 -0.35939
113 10D-2 0.28201 0.23201 0.23201 0.00000 0.13887
114 11D 0 0.00000 0.08245 0.08245 0.00000 0.34192
115 11D+1 -0.39804 0.34623 0.00000 0.34623 0.04325
116 11D-1 -0.39804 0.00000 0.34623 -0.34623 -0.26664
117 11D+2 0.00000 0.04760 -0.04760 0.09520 0.59223
118 11D-2 -0.39804 -0.34623 -0.34623 0.00000 -0.26664
119 12D 0 0.00000 0.04783 0.04783 0.00000 -0.06459
120 12D+1 0.55967 0.10812 0.00000 0.10812 -0.07627
121 12D-1 0.55967 0.00000 0.10812 -0.10812 -0.01568
122 12D+2 0.00000 0.02762 -0.02762 0.05523 -0.11188
123 12D-2 0.55967 -0.10812 -0.10812 0.00000 -0.01568
124 13F 0 -0.00273 -0.19644 -0.19644 0.00000 -0.03114
125 13F+1 0.00167 -0.01659 -0.09631 0.14428 -0.11338
126 13F-1 0.00167 -0.09631 -0.01659 -0.14428 -0.00409
127 13F+2 0.00000 0.03034 -0.03034 -0.02098 -0.16753
128 13F-2 0.10359 0.00000 0.00000 0.00000 -0.16853
129 13F+3 -0.00216 -0.01285 0.17388 -0.13672 -0.12721
130 13F-3 0.00216 -0.17388 0.01285 -0.13672 -0.00528
131 14F 0 0.09035 0.20339 0.20339 0.00000 0.00776
132 14F+1 -0.05533 -0.03174 -0.01101 -0.26011 0.12014
133 14F-1 -0.05533 -0.01101 -0.03174 0.26011 -0.06228
134 14F+2 0.00000 -0.17147 0.17147 -0.04015 0.15798
135 14F-2 -0.26135 0.00000 0.00000 0.00000 0.16926
136 14F+3 0.07143 -0.02459 -0.26580 0.05579 0.10287
137 14F-3 -0.07143 0.26580 0.02459 0.05579 -0.08041
138 15G 0 -0.10599 -0.04545 -0.04545 0.00000 0.01952
139 15G+1 -0.05209 -0.27506 0.06904 0.29027 -0.06743
140 15G-1 -0.05209 0.06904 -0.27506 -0.29027 0.04245
141 15G+2 0.00000 0.04065 -0.04065 0.08129 -0.21577
142 15G-2 0.14734 0.02150 0.02150 0.00000 -0.15743
143 15G+3 -0.13783 0.12695 -0.02610 -0.08672 -0.17841
144 15G-3 0.13783 0.02610 -0.12695 -0.08672 -0.15226
145 15G+4 -0.08958 0.05377 0.05377 0.00000 -0.14661
146 15G-4 0.00000 -0.30218 0.30218 0.07381 -0.01412
147 3 H 1S 0.55084 0.00000 0.00000 0.00000 -0.17181
148 2S -1.37887 0.00000 0.00000 0.00000 0.21242
149 3S -2.31179 0.00000 0.00000 0.00000 2.50876
150 4S 0.74513 0.00000 0.00000 0.00000 0.76741
151 5S 0.15131 0.00000 0.00000 0.00000 -0.02197
152 6PX -0.05147 0.00000 0.05444 0.05444 -0.01187
153 6PY -0.05147 0.05444 0.00000 -0.05444 -0.01500
154 6PZ 0.05147 0.05444 0.05444 0.00000 0.01187
155 7PX -0.16729 0.00000 -0.00625 -0.00625 0.02975
156 7PY -0.16729 -0.00625 0.00000 0.00625 0.02120
157 7PZ 0.16729 -0.00625 -0.00625 0.00000 -0.02975
158 8PX -0.36814 0.00000 0.47781 0.47781 0.28499
159 8PY -0.36814 0.47781 0.00000 -0.47781 1.35496
160 8PZ 0.36814 0.47781 0.47781 0.00000 -0.28499
161 9PX 0.48654 0.00000 0.01893 0.01893 0.19884
162 9PY 0.48654 0.01893 0.00000 -0.01893 -0.00960
163 9PZ -0.48654 0.01893 0.01893 0.00000 -0.19884
164 10D 0 0.00000 -0.12264 -0.12264 0.00000 0.20749
165 10D+1 -0.28201 -0.23201 0.00000 0.23201 0.03181
166 10D-1 -0.28201 0.00000 -0.23201 -0.23201 0.13887
167 10D+2 0.00000 -0.07081 0.07081 0.14162 0.35939
168 10D-2 0.28201 -0.23201 -0.23201 0.00000 -0.13887
169 11D 0 0.00000 -0.08245 -0.08245 0.00000 -0.34192
170 11D+1 0.39804 0.34623 0.00000 -0.34623 0.04325
171 11D-1 0.39804 0.00000 0.34623 0.34623 -0.26664
172 11D+2 0.00000 -0.04760 0.04760 0.09520 -0.59223
173 11D-2 -0.39804 0.34623 0.34623 0.00000 0.26664
174 12D 0 0.00000 -0.04783 -0.04783 0.00000 0.06459
175 12D+1 -0.55967 0.10812 0.00000 -0.10812 -0.07627
176 12D-1 -0.55967 0.00000 0.10812 0.10812 -0.01568
177 12D+2 0.00000 -0.02762 0.02762 0.05523 0.11188
178 12D-2 0.55967 0.10812 0.10812 0.00000 0.01568
179 13F 0 -0.00273 0.19644 0.19644 0.00000 0.03114
180 13F+1 -0.00167 -0.01659 -0.09631 -0.14428 -0.11338
181 13F-1 -0.00167 -0.09631 -0.01659 0.14428 -0.00409
182 13F+2 0.00000 -0.03034 0.03034 -0.02098 0.16753
183 13F-2 0.10359 0.00000 0.00000 0.00000 0.16853
184 13F+3 0.00216 -0.01285 0.17388 0.13672 -0.12721
185 13F-3 -0.00216 -0.17388 0.01285 0.13672 -0.00528
186 14F 0 0.09035 -0.20339 -0.20339 0.00000 -0.00776
187 14F+1 0.05533 -0.03174 -0.01101 0.26011 0.12014
188 14F-1 0.05533 -0.01101 -0.03174 -0.26011 -0.06228
189 14F+2 0.00000 0.17147 -0.17147 -0.04015 -0.15798
190 14F-2 -0.26135 0.00000 0.00000 0.00000 -0.16926
191 14F+3 -0.07143 -0.02459 -0.26580 -0.05579 0.10287
192 14F-3 0.07143 0.26580 0.02459 -0.05579 -0.08041
193 15G 0 -0.10599 0.04545 0.04545 0.00000 -0.01952
194 15G+1 0.05209 -0.27506 0.06904 -0.29027 -0.06743
195 15G-1 0.05209 0.06904 -0.27506 0.29027 0.04245
196 15G+2 0.00000 -0.04065 0.04065 0.08129 0.21577
197 15G-2 0.14734 -0.02150 -0.02150 0.00000 0.15743
198 15G+3 0.13783 0.12695 -0.02610 0.08672 -0.17841
199 15G-3 -0.13783 0.02610 -0.12695 0.08672 -0.15226
200 15G+4 -0.08958 -0.05377 -0.05377 0.00000 0.14661
201 15G-4 0.00000 0.30218 -0.30218 0.07381 0.01412
202 4 H 1S 0.55084 0.00000 0.00000 0.00000 -0.17181
203 2S -1.37887 0.00000 0.00000 0.00000 0.21242
204 3S -2.31179 0.00000 0.00000 0.00000 2.50876
205 4S 0.74513 0.00000 0.00000 0.00000 0.76741
206 5S 0.15131 0.00000 0.00000 0.00000 -0.02197
207 6PX 0.05147 0.00000 -0.05444 0.05444 0.01187
208 6PY -0.05147 -0.05444 0.00000 0.05444 -0.01500
209 6PZ -0.05147 0.05444 -0.05444 0.00000 -0.01187
210 7PX 0.16729 0.00000 0.00625 -0.00625 -0.02975
211 7PY -0.16729 0.00625 0.00000 -0.00625 0.02120
212 7PZ -0.16729 -0.00625 0.00625 0.00000 0.02975
213 8PX 0.36814 0.00000 -0.47781 0.47781 -0.28499
214 8PY -0.36814 -0.47781 0.00000 0.47781 1.35496
215 8PZ -0.36814 0.47781 -0.47781 0.00000 0.28499
216 9PX -0.48654 0.00000 -0.01893 0.01893 -0.19884
217 9PY 0.48654 -0.01893 0.00000 0.01893 -0.00960
218 9PZ 0.48654 0.01893 -0.01893 0.00000 0.19884
219 10D 0 0.00000 0.12264 -0.12264 0.00000 0.20749
220 10D+1 -0.28201 0.23201 0.00000 -0.23201 0.03181
221 10D-1 0.28201 0.00000 0.23201 -0.23201 -0.13887
222 10D+2 0.00000 0.07081 0.07081 -0.14162 0.35939
223 10D-2 -0.28201 -0.23201 0.23201 0.00000 0.13887
224 11D 0 0.00000 0.08245 -0.08245 0.00000 -0.34192
225 11D+1 0.39804 -0.34623 0.00000 0.34623 0.04325
226 11D-1 -0.39804 0.00000 -0.34623 0.34623 0.26664
227 11D+2 0.00000 0.04760 0.04760 -0.09520 -0.59223
228 11D-2 0.39804 0.34623 -0.34623 0.00000 -0.26664
229 12D 0 0.00000 0.04783 -0.04783 0.00000 0.06459
230 12D+1 -0.55967 -0.10812 0.00000 0.10812 -0.07627
231 12D-1 0.55967 0.00000 -0.10812 0.10812 0.01568
232 12D+2 0.00000 0.02762 0.02762 -0.05523 0.11188
233 12D-2 -0.55967 0.10812 -0.10812 0.00000 -0.01568
234 13F 0 0.00273 0.19644 -0.19644 0.00000 -0.03114
235 13F+1 0.00167 -0.01659 0.09631 -0.14428 0.11338
236 13F-1 -0.00167 0.09631 -0.01659 -0.14428 -0.00409
237 13F+2 0.00000 -0.03034 -0.03034 -0.02098 -0.16753
238 13F-2 0.10359 0.00000 0.00000 0.00000 0.16853
239 13F+3 -0.00216 -0.01285 -0.17388 0.13672 0.12721
240 13F-3 -0.00216 0.17388 0.01285 -0.13672 -0.00528
241 14F 0 -0.09035 -0.20339 0.20339 0.00000 0.00776
242 14F+1 -0.05533 -0.03174 0.01101 0.26011 -0.12014
243 14F-1 0.05533 0.01101 -0.03174 0.26011 -0.06228
244 14F+2 0.00000 0.17147 0.17147 -0.04015 0.15798
245 14F-2 -0.26135 0.00000 0.00000 0.00000 -0.16926
246 14F+3 0.07143 -0.02459 0.26580 -0.05579 -0.10287
247 14F-3 0.07143 -0.26580 0.02459 0.05579 -0.08041
248 15G 0 -0.10599 -0.04545 0.04545 0.00000 -0.01952
249 15G+1 0.05209 0.27506 0.06904 0.29027 -0.06743
250 15G-1 -0.05209 0.06904 0.27506 0.29027 -0.04245
251 15G+2 0.00000 0.04065 0.04065 -0.08129 0.21577
252 15G-2 -0.14734 -0.02150 0.02150 0.00000 -0.15743
253 15G+3 0.13783 -0.12695 -0.02610 -0.08672 -0.17841
254 15G-3 0.13783 0.02610 0.12695 0.08672 0.15226
255 15G+4 -0.08958 0.05377 -0.05377 0.00000 0.14661
256 15G-4 0.00000 0.30218 0.30218 0.07381 -0.01412
257 5 H 1S 0.55084 0.00000 0.00000 0.00000 0.17181
258 2S -1.37887 0.00000 0.00000 0.00000 -0.21242
259 3S -2.31179 0.00000 0.00000 0.00000 -2.50876
260 4S 0.74513 0.00000 0.00000 0.00000 -0.76741
261 5S 0.15131 0.00000 0.00000 0.00000 0.02197
262 6PX -0.05147 0.00000 -0.05444 -0.05444 0.01187
263 6PY 0.05147 -0.05444 0.00000 -0.05444 -0.01500
264 6PZ -0.05147 -0.05444 0.05444 0.00000 0.01187
265 7PX -0.16729 0.00000 0.00625 0.00625 -0.02975
266 7PY 0.16729 0.00625 0.00000 0.00625 0.02120
267 7PZ -0.16729 0.00625 -0.00625 0.00000 -0.02975
268 8PX -0.36814 0.00000 -0.47781 -0.47781 -0.28499
269 8PY 0.36814 -0.47781 0.00000 -0.47781 1.35496
270 8PZ -0.36814 -0.47781 0.47781 0.00000 -0.28499
271 9PX 0.48654 0.00000 -0.01893 -0.01893 -0.19884
272 9PY -0.48654 -0.01893 0.00000 -0.01893 -0.00960
273 9PZ 0.48654 -0.01893 0.01893 0.00000 -0.19884
274 10D 0 0.00000 -0.12264 0.12264 0.00000 -0.20749
275 10D+1 0.28201 0.23201 0.00000 0.23201 0.03181
276 10D-1 -0.28201 0.00000 0.23201 0.23201 -0.13887
277 10D+2 0.00000 -0.07081 -0.07081 -0.14162 -0.35939
278 10D-2 -0.28201 0.23201 -0.23201 0.00000 -0.13887
279 11D 0 0.00000 -0.08245 0.08245 0.00000 0.34192
280 11D+1 -0.39804 -0.34623 0.00000 -0.34623 0.04325
281 11D-1 0.39804 0.00000 -0.34623 -0.34623 0.26664
282 11D+2 0.00000 -0.04760 -0.04760 -0.09520 0.59223
283 11D-2 0.39804 -0.34623 0.34623 0.00000 0.26664
284 12D 0 0.00000 -0.04783 0.04783 0.00000 -0.06459
285 12D+1 0.55967 -0.10812 0.00000 -0.10812 -0.07627
286 12D-1 -0.55967 0.00000 -0.10812 -0.10812 0.01568
287 12D+2 0.00000 -0.02762 -0.02762 -0.05523 -0.11188
288 12D-2 -0.55967 -0.10812 0.10812 0.00000 0.01568
289 13F 0 0.00273 -0.19644 0.19644 0.00000 0.03114
290 13F+1 -0.00167 -0.01659 0.09631 0.14428 0.11338
291 13F-1 0.00167 0.09631 -0.01659 0.14428 -0.00409
292 13F+2 0.00000 0.03034 0.03034 -0.02098 0.16753
293 13F-2 0.10359 0.00000 0.00000 0.00000 -0.16853
294 13F+3 0.00216 -0.01285 -0.17388 -0.13672 0.12721
295 13F-3 0.00216 0.17388 0.01285 0.13672 -0.00528
296 14F 0 -0.09035 0.20339 -0.20339 0.00000 -0.00776
297 14F+1 0.05533 -0.03174 0.01101 -0.26011 -0.12014
298 14F-1 -0.05533 0.01101 -0.03174 -0.26011 -0.06228
299 14F+2 0.00000 -0.17147 -0.17147 -0.04015 -0.15798
300 14F-2 -0.26135 0.00000 0.00000 0.00000 0.16926
301 14F+3 -0.07143 -0.02459 0.26580 0.05579 -0.10287
302 14F-3 -0.07143 -0.26580 0.02459 -0.05579 -0.08041
303 15G 0 -0.10599 0.04545 -0.04545 0.00000 0.01952
304 15G+1 -0.05209 0.27506 0.06904 -0.29027 -0.06743
305 15G-1 0.05209 0.06904 0.27506 -0.29027 -0.04245
306 15G+2 0.00000 -0.04065 -0.04065 -0.08129 -0.21577
307 15G-2 -0.14734 0.02150 -0.02150 0.00000 0.15743
308 15G+3 -0.13783 -0.12695 -0.02610 0.08672 -0.17841
309 15G-3 -0.13783 0.02610 0.12695 -0.08672 0.15226
310 15G+4 -0.08958 -0.05377 0.05377 0.00000 -0.14661
311 15G-4 0.00000 -0.30218 -0.30218 0.07381 0.01412
261 262 263 264 265
(T2)--V (T2)--V (T1)--V (T1)--V (T1)--V
Eigenvalues -- 14.57177 14.57177 14.78492 14.78492 14.78492
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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 -0.10064 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
9 7PZ -0.10064 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 0.31985 0.00000 0.00000 0.00000
11 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
12 8PZ 0.31985 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 2.35419 0.00000 0.00000 0.00000
14 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
15 9PZ 2.35419 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 2.20654 0.00000 0.00000 0.00000
17 10PY 0.00000 0.00000 0.00000 0.00000 0.00000
18 10PZ 2.20654 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.02494 0.00000 0.00000 0.00000
20 11PY 0.00000 0.00000 0.00000 0.00000 0.00000
21 11PZ 0.02494 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 0.00636 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00636 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 -0.40054 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 -0.40054 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 3.84742 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 3.84742 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 0.70576 0.00000 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.70576 0.00000 0.00000 0.00000 0.00000
42 16F 0 0.45043 0.00000 0.00000 0.00000 0.00000
43 16F+1 0.00000 -0.27583 -0.73982 0.00000 0.00000
44 16F-1 0.00000 0.00000 0.00000 -0.73982 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 -0.93581
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.35609 -0.57307 0.00000 0.00000
48 16F-3 0.00000 0.00000 0.00000 0.57307 0.00000
49 17F 0 -0.69923 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.42819 2.03085 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.00000 2.03085 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 2.56885
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.00000 -0.55279 1.57309 0.00000 0.00000
55 17F-3 0.00000 0.00000 0.00000 -1.57309 0.00000
56 18F 0 -0.98386 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.60249 1.41871 0.00000 0.00000
58 18F-1 0.00000 0.00000 0.00000 1.41871 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 1.79455
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.00000 -0.77781 1.09893 0.00000 0.00000
62 18F-3 0.00000 0.00000 0.00000 -1.09893 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 0.00000 -0.10615 0.00000
65 19G-1 0.00000 -0.01611 -0.10615 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.04556 0.00000 0.00000 0.00000 0.00000
68 19G+3 0.00000 0.00000 0.00000 0.04012 0.00000
69 19G-3 0.00000 0.04262 -0.04012 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 -0.11348
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 0.00000 1.17212 0.00000
74 20G-1 0.00000 0.21205 1.17212 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 -0.59978 0.00000 0.00000 0.00000 0.00000
77 20G+3 0.00000 0.00000 0.00000 -0.44302 0.00000
78 20G-3 0.00000 -0.56104 0.44302 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 1.25305
81 21H 0 0.14564 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.00000 -0.05475 0.07738 0.00000 0.00000
83 21H-1 0.00000 0.00000 0.00000 0.07738 0.00000
84 21H+2 0.00000 0.00000 0.00000 0.00000 -0.11698
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.00000 -0.25010 -0.03582 0.00000 0.00000
87 21H-3 0.00000 0.00000 0.00000 0.03582 0.00000
88 21H+4 -0.21867 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 0.05895 -0.08009 0.00000 0.00000
91 21H-5 0.00000 0.00000 0.00000 -0.08009 0.00000
92 2 H 1S 0.17181 0.17181 0.00000 0.00000 0.00000
93 2S -0.21242 -0.21242 0.00000 0.00000 0.00000
94 3S -2.50876 -2.50876 0.00000 0.00000 0.00000
95 4S -0.76741 -0.76741 0.00000 0.00000 0.00000
96 5S 0.02197 0.02197 0.00000 0.00000 0.00000
97 6PX -0.01187 -0.01500 0.00000 0.08152 -0.08152
98 6PY -0.01187 -0.01187 0.08152 0.00000 0.08152
99 6PZ -0.01500 -0.01187 -0.08152 -0.08152 0.00000
100 7PX 0.02975 0.02120 0.00000 -0.07889 0.07889
101 7PY 0.02975 0.02975 -0.07889 0.00000 -0.07889
102 7PZ 0.02120 0.02975 0.07889 0.07889 0.00000
103 8PX 0.28499 1.35496 0.00000 1.28320 -1.28320
104 8PY 0.28499 0.28499 1.28320 0.00000 1.28320
105 8PZ 1.35496 0.28499 -1.28320 -1.28320 0.00000
106 9PX 0.19884 -0.00960 0.00000 0.03193 -0.03193
107 9PY 0.19884 0.19884 0.03193 0.00000 0.03193
108 9PZ -0.00960 0.19884 -0.03193 -0.03193 0.00000
109 10D 0 0.41498 -0.20749 -0.29737 -0.29737 0.00000
110 10D+1 0.13887 0.13887 -0.31901 0.00000 -0.31901
111 10D-1 0.13887 0.03181 0.00000 -0.31901 0.31901
112 10D+2 0.00000 0.35939 -0.17168 0.17168 -0.34337
113 10D-2 0.03181 0.13887 0.31901 0.31901 0.00000
114 11D 0 -0.68385 0.34192 0.69336 0.69336 0.00000
115 11D+1 -0.26664 -0.26664 0.67089 0.00000 0.67089
116 11D-1 -0.26664 0.04325 0.00000 0.67089 -0.67089
117 11D+2 0.00000 -0.59223 0.40031 -0.40031 0.80062
118 11D-2 0.04325 -0.26664 -0.67089 -0.67089 0.00000
119 12D 0 0.12919 -0.06459 0.22132 0.22132 0.00000
120 12D+1 -0.01568 -0.01568 -0.19972 0.00000 -0.19972
121 12D-1 -0.01568 -0.07627 0.00000 -0.19972 0.19972
122 12D+2 0.00000 0.11188 0.12778 -0.12778 0.25556
123 12D-2 -0.07627 -0.01568 0.19972 0.19972 0.00000
124 13F 0 0.00668 -0.03114 0.07258 0.07258 0.00000
125 13F+1 0.15151 -0.00409 -0.19355 -0.09224 -0.18113
126 13F-1 0.15151 -0.11338 -0.09224 -0.19355 0.18113
127 13F+2 0.00000 0.16753 -0.17289 0.17289 -0.24482
128 13F-2 -0.16853 -0.16853 0.00000 0.00000 0.00000
129 13F+3 0.07797 0.00528 -0.14992 -0.16325 -0.04850
130 13F-3 -0.07797 0.12721 0.16325 0.14992 -0.04850
131 14F 0 0.10171 0.00776 -0.14627 -0.14627 0.00000
132 14F+1 -0.12964 -0.06228 0.04185 -0.02721 0.15193
133 14F-1 -0.12964 0.12014 -0.02721 0.04185 -0.15193
134 14F+2 0.00000 -0.15798 0.07888 -0.07888 0.05294
135 14F-2 0.16926 0.16926 0.00000 0.00000 0.00000
136 14F+3 -0.09061 0.08041 0.03242 0.16394 -0.06733
137 14F-3 0.09061 -0.10287 -0.16394 -0.03242 -0.06733
138 15G 0 -0.22172 0.01952 0.12665 0.12665 0.00000
139 15G+1 0.06887 0.04245 -0.04941 -0.11712 -0.02840
140 15G-1 0.06887 -0.06743 -0.11712 -0.04941 0.02840
141 15G+2 0.00000 0.21577 -0.11328 0.11328 -0.22656
142 15G-2 0.19073 -0.15743 -0.11003 -0.11003 0.00000
143 15G+3 0.14227 0.15226 -0.09895 0.04427 -0.10690
144 15G-3 -0.14227 0.17841 -0.04427 0.09895 -0.10690
145 15G+4 0.13883 -0.14661 -0.14985 -0.14985 0.00000
146 15G-4 0.00000 0.01412 -0.01123 0.01123 -0.12521
147 3 H 1S 0.17181 -0.17181 0.00000 0.00000 0.00000
148 2S -0.21242 0.21242 0.00000 0.00000 0.00000
149 3S -2.50876 2.50876 0.00000 0.00000 0.00000
150 4S -0.76741 0.76741 0.00000 0.00000 0.00000
151 5S 0.02197 -0.02197 0.00000 0.00000 0.00000
152 6PX 0.01187 -0.01500 0.00000 0.08152 0.08152
153 6PY 0.01187 -0.01187 0.08152 0.00000 -0.08152
154 6PZ -0.01500 0.01187 0.08152 0.08152 0.00000
155 7PX -0.02975 0.02120 0.00000 -0.07889 -0.07889
156 7PY -0.02975 0.02975 -0.07889 0.00000 0.07889
157 7PZ 0.02120 -0.02975 -0.07889 -0.07889 0.00000
158 8PX -0.28499 1.35496 0.00000 1.28320 1.28320
159 8PY -0.28499 0.28499 1.28320 0.00000 -1.28320
160 8PZ 1.35496 -0.28499 1.28320 1.28320 0.00000
161 9PX -0.19884 -0.00960 0.00000 0.03193 0.03193
162 9PY -0.19884 0.19884 0.03193 0.00000 -0.03193
163 9PZ -0.00960 -0.19884 0.03193 0.03193 0.00000
164 10D 0 0.41498 0.20749 0.29737 0.29737 0.00000
165 10D+1 -0.13887 0.13887 -0.31901 0.00000 0.31901
166 10D-1 -0.13887 0.03181 0.00000 -0.31901 -0.31901
167 10D+2 0.00000 -0.35939 0.17168 -0.17168 -0.34337
168 10D-2 0.03181 -0.13887 -0.31901 -0.31901 0.00000
169 11D 0 -0.68385 -0.34192 -0.69336 -0.69336 0.00000
170 11D+1 0.26664 -0.26664 0.67089 0.00000 -0.67089
171 11D-1 0.26664 0.04325 0.00000 0.67089 0.67089
172 11D+2 0.00000 0.59223 -0.40031 0.40031 0.80062
173 11D-2 0.04325 0.26664 0.67089 0.67089 0.00000
174 12D 0 0.12919 0.06459 -0.22132 -0.22132 0.00000
175 12D+1 0.01568 -0.01568 -0.19972 0.00000 0.19972
176 12D-1 0.01568 -0.07627 0.00000 -0.19972 -0.19972
177 12D+2 0.00000 -0.11188 -0.12778 0.12778 0.25556
178 12D-2 -0.07627 0.01568 -0.19972 -0.19972 0.00000
179 13F 0 0.00668 0.03114 -0.07258 -0.07258 0.00000
180 13F+1 -0.15151 -0.00409 -0.19355 -0.09224 0.18113
181 13F-1 -0.15151 -0.11338 -0.09224 -0.19355 -0.18113
182 13F+2 0.00000 -0.16753 0.17289 -0.17289 -0.24482
183 13F-2 -0.16853 0.16853 0.00000 0.00000 0.00000
184 13F+3 -0.07797 0.00528 -0.14992 -0.16325 0.04850
185 13F-3 0.07797 0.12721 0.16325 0.14992 0.04850
186 14F 0 0.10171 -0.00776 0.14627 0.14627 0.00000
187 14F+1 0.12964 -0.06228 0.04185 -0.02721 -0.15193
188 14F-1 0.12964 0.12014 -0.02721 0.04185 0.15193
189 14F+2 0.00000 0.15798 -0.07888 0.07888 0.05294
190 14F-2 0.16926 -0.16926 0.00000 0.00000 0.00000
191 14F+3 0.09061 0.08041 0.03242 0.16394 0.06733
192 14F-3 -0.09061 -0.10287 -0.16394 -0.03242 0.06733
193 15G 0 -0.22172 -0.01952 -0.12665 -0.12665 0.00000
194 15G+1 -0.06887 0.04245 -0.04941 -0.11712 0.02840
195 15G-1 -0.06887 -0.06743 -0.11712 -0.04941 -0.02840
196 15G+2 0.00000 -0.21577 0.11328 -0.11328 -0.22656
197 15G-2 0.19073 0.15743 0.11003 0.11003 0.00000
198 15G+3 -0.14227 0.15226 -0.09895 0.04427 0.10690
199 15G-3 0.14227 0.17841 -0.04427 0.09895 0.10690
200 15G+4 0.13883 0.14661 0.14985 0.14985 0.00000
201 15G-4 0.00000 -0.01412 0.01123 -0.01123 -0.12521
202 4 H 1S -0.17181 0.17181 0.00000 0.00000 0.00000
203 2S 0.21242 -0.21242 0.00000 0.00000 0.00000
204 3S 2.50876 -2.50876 0.00000 0.00000 0.00000
205 4S 0.76741 -0.76741 0.00000 0.00000 0.00000
206 5S -0.02197 0.02197 0.00000 0.00000 0.00000
207 6PX 0.01187 -0.01500 0.00000 -0.08152 0.08152
208 6PY -0.01187 0.01187 -0.08152 0.00000 0.08152
209 6PZ -0.01500 0.01187 0.08152 -0.08152 0.00000
210 7PX -0.02975 0.02120 0.00000 0.07889 -0.07889
211 7PY 0.02975 -0.02975 0.07889 0.00000 -0.07889
212 7PZ 0.02120 -0.02975 -0.07889 0.07889 0.00000
213 8PX -0.28499 1.35496 0.00000 -1.28320 1.28320
214 8PY 0.28499 -0.28499 -1.28320 0.00000 1.28320
215 8PZ 1.35496 -0.28499 1.28320 -1.28320 0.00000
216 9PX -0.19884 -0.00960 0.00000 -0.03193 0.03193
217 9PY 0.19884 -0.19884 -0.03193 0.00000 0.03193
218 9PZ -0.00960 -0.19884 0.03193 -0.03193 0.00000
219 10D 0 -0.41498 -0.20749 -0.29737 0.29737 0.00000
220 10D+1 0.13887 -0.13887 0.31901 0.00000 -0.31901
221 10D-1 -0.13887 0.03181 0.00000 0.31901 -0.31901
222 10D+2 0.00000 0.35939 -0.17168 -0.17168 0.34337
223 10D-2 0.03181 -0.13887 -0.31901 0.31901 0.00000
224 11D 0 0.68385 0.34192 0.69336 -0.69336 0.00000
225 11D+1 -0.26664 0.26664 -0.67089 0.00000 0.67089
226 11D-1 0.26664 0.04325 0.00000 -0.67089 0.67089
227 11D+2 0.00000 -0.59223 0.40031 0.40031 -0.80062
228 11D-2 0.04325 0.26664 0.67089 -0.67089 0.00000
229 12D 0 -0.12919 -0.06459 0.22132 -0.22132 0.00000
230 12D+1 -0.01568 0.01568 0.19972 0.00000 -0.19972
231 12D-1 0.01568 -0.07627 0.00000 0.19972 -0.19972
232 12D+2 0.00000 0.11188 0.12778 0.12778 -0.25556
233 12D-2 -0.07627 0.01568 -0.19972 0.19972 0.00000
234 13F 0 0.00668 0.03114 -0.07258 0.07258 0.00000
235 13F+1 -0.15151 -0.00409 -0.19355 0.09224 0.18113
236 13F-1 0.15151 0.11338 0.09224 -0.19355 0.18113
237 13F+2 0.00000 -0.16753 0.17289 0.17289 -0.24482
238 13F-2 0.16853 -0.16853 0.00000 0.00000 0.00000
239 13F+3 -0.07797 0.00528 -0.14992 0.16325 0.04850
240 13F-3 -0.07797 -0.12721 -0.16325 0.14992 -0.04850
241 14F 0 0.10171 -0.00776 0.14627 -0.14627 0.00000
242 14F+1 0.12964 -0.06228 0.04185 0.02721 -0.15193
243 14F-1 -0.12964 -0.12014 0.02721 0.04185 -0.15193
244 14F+2 0.00000 0.15798 -0.07888 -0.07888 0.05294
245 14F-2 -0.16926 0.16926 0.00000 0.00000 0.00000
246 14F+3 0.09061 0.08041 0.03242 -0.16394 0.06733
247 14F-3 0.09061 0.10287 0.16394 -0.03242 -0.06733
248 15G 0 0.22172 0.01952 0.12665 -0.12665 0.00000
249 15G+1 0.06887 -0.04245 0.04941 -0.11712 -0.02840
250 15G-1 -0.06887 -0.06743 -0.11712 0.04941 -0.02840
251 15G+2 0.00000 0.21577 -0.11328 -0.11328 0.22656
252 15G-2 0.19073 0.15743 0.11003 -0.11003 0.00000
253 15G+3 0.14227 -0.15226 0.09895 0.04427 -0.10690
254 15G-3 0.14227 0.17841 -0.04427 -0.09895 0.10690
255 15G+4 -0.13883 -0.14661 -0.14985 0.14985 0.00000
256 15G-4 0.00000 -0.01412 0.01123 0.01123 -0.12521
257 5 H 1S -0.17181 -0.17181 0.00000 0.00000 0.00000
258 2S 0.21242 0.21242 0.00000 0.00000 0.00000
259 3S 2.50876 2.50876 0.00000 0.00000 0.00000
260 4S 0.76741 0.76741 0.00000 0.00000 0.00000
261 5S -0.02197 -0.02197 0.00000 0.00000 0.00000
262 6PX -0.01187 -0.01500 0.00000 -0.08152 -0.08152
263 6PY 0.01187 0.01187 -0.08152 0.00000 -0.08152
264 6PZ -0.01500 -0.01187 -0.08152 0.08152 0.00000
265 7PX 0.02975 0.02120 0.00000 0.07889 0.07889
266 7PY -0.02975 -0.02975 0.07889 0.00000 0.07889
267 7PZ 0.02120 0.02975 0.07889 -0.07889 0.00000
268 8PX 0.28499 1.35496 0.00000 -1.28320 -1.28320
269 8PY -0.28499 -0.28499 -1.28320 0.00000 -1.28320
270 8PZ 1.35496 0.28499 -1.28320 1.28320 0.00000
271 9PX 0.19884 -0.00960 0.00000 -0.03193 -0.03193
272 9PY -0.19884 -0.19884 -0.03193 0.00000 -0.03193
273 9PZ -0.00960 0.19884 -0.03193 0.03193 0.00000
274 10D 0 -0.41498 0.20749 0.29737 -0.29737 0.00000
275 10D+1 -0.13887 -0.13887 0.31901 0.00000 0.31901
276 10D-1 0.13887 0.03181 0.00000 0.31901 0.31901
277 10D+2 0.00000 -0.35939 0.17168 0.17168 0.34337
278 10D-2 0.03181 0.13887 0.31901 -0.31901 0.00000
279 11D 0 0.68385 -0.34192 -0.69336 0.69336 0.00000
280 11D+1 0.26664 0.26664 -0.67089 0.00000 -0.67089
281 11D-1 -0.26664 0.04325 0.00000 -0.67089 -0.67089
282 11D+2 0.00000 0.59223 -0.40031 -0.40031 -0.80062
283 11D-2 0.04325 -0.26664 -0.67089 0.67089 0.00000
284 12D 0 -0.12919 0.06459 -0.22132 0.22132 0.00000
285 12D+1 0.01568 0.01568 0.19972 0.00000 0.19972
286 12D-1 -0.01568 -0.07627 0.00000 0.19972 0.19972
287 12D+2 0.00000 -0.11188 -0.12778 -0.12778 -0.25556
288 12D-2 -0.07627 -0.01568 0.19972 -0.19972 0.00000
289 13F 0 0.00668 -0.03114 0.07258 -0.07258 0.00000
290 13F+1 0.15151 -0.00409 -0.19355 0.09224 -0.18113
291 13F-1 -0.15151 0.11338 0.09224 -0.19355 -0.18113
292 13F+2 0.00000 0.16753 -0.17289 -0.17289 -0.24482
293 13F-2 0.16853 0.16853 0.00000 0.00000 0.00000
294 13F+3 0.07797 0.00528 -0.14992 0.16325 -0.04850
295 13F-3 0.07797 -0.12721 -0.16325 0.14992 0.04850
296 14F 0 0.10171 0.00776 -0.14627 0.14627 0.00000
297 14F+1 -0.12964 -0.06228 0.04185 0.02721 0.15193
298 14F-1 0.12964 -0.12014 0.02721 0.04185 0.15193
299 14F+2 0.00000 -0.15798 0.07888 0.07888 0.05294
300 14F-2 -0.16926 -0.16926 0.00000 0.00000 0.00000
301 14F+3 -0.09061 0.08041 0.03242 -0.16394 -0.06733
302 14F-3 -0.09061 0.10287 0.16394 -0.03242 0.06733
303 15G 0 0.22172 -0.01952 -0.12665 0.12665 0.00000
304 15G+1 -0.06887 -0.04245 0.04941 -0.11712 0.02840
305 15G-1 0.06887 -0.06743 -0.11712 0.04941 0.02840
306 15G+2 0.00000 -0.21577 0.11328 0.11328 0.22656
307 15G-2 0.19073 -0.15743 -0.11003 0.11003 0.00000
308 15G+3 -0.14227 -0.15226 0.09895 0.04427 0.10690
309 15G-3 -0.14227 0.17841 -0.04427 -0.09895 -0.10690
310 15G+4 -0.13883 0.14661 0.14985 -0.14985 0.00000
311 15G-4 0.00000 0.01412 -0.01123 -0.01123 -0.12521
266 267 268 269 270
(T2)--V (T2)--V (T2)--V (E)--V (E)--V
Eigenvalues -- 14.88528 14.88528 14.88528 15.10171 15.10171
1 1 C 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 -0.03155 0.00000 0.00000
8 7PY 0.00000 -0.03155 0.00000 0.00000 0.00000
9 7PZ -0.03155 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 -1.01153 0.00000 0.00000
11 8PY 0.00000 -1.01153 0.00000 0.00000 0.00000
12 8PZ -1.01153 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 4.96071 0.00000 0.00000
14 9PY 0.00000 4.96071 0.00000 0.00000 0.00000
15 9PZ 4.96071 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 2.92545 0.00000 0.00000
17 10PY 0.00000 2.92545 0.00000 0.00000 0.00000
18 10PZ 2.92545 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 -0.03796 0.00000 0.00000
20 11PY 0.00000 -0.03796 0.00000 0.00000 0.00000
21 11PZ -0.03796 0.00000 0.00000 0.00000 0.00000
22 12D 0 0.00000 0.00000 0.00000 -0.37649 -0.12618
23 12D+1 0.00000 -0.23050 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 -0.23050 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.12618 -0.37649
26 12D-2 -0.23050 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.06265 0.02100
28 13D+1 0.00000 0.46094 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.46094 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 -0.02100 0.06265
31 13D-2 0.46094 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 1.33400 0.44709
33 14D+1 0.00000 1.60373 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 1.60373 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 -0.44709 1.33400
36 14D-2 1.60373 0.00000 0.00000 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.59435 0.19919
38 15D+1 0.00000 0.38030 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.38030 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 -0.19919 0.59435
41 15D-2 0.38030 0.00000 0.00000 0.00000 0.00000
42 16F 0 -0.19409 0.00000 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.11886 0.00000 0.00000
44 16F-1 0.00000 0.11886 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 -0.15344 0.00000 0.00000
48 16F-3 0.00000 0.15344 0.00000 0.00000 0.00000
49 17F 0 0.69599 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 -0.42620 0.00000 0.00000
51 17F-1 0.00000 -0.42620 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 0.55023 0.00000 0.00000
55 17F-3 0.00000 -0.55023 0.00000 0.00000 0.00000
56 18F 0 1.07106 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 -0.65589 0.00000 0.00000
58 18F-1 0.00000 -0.65589 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 0.84675 0.00000 0.00000
62 18F-3 0.00000 -0.84675 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 -0.06214 -0.02083
64 19G+1 0.00000 -0.08254 0.00000 0.00000 0.00000
65 19G-1 0.00000 0.00000 -0.08254 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 -0.03226 0.09627
67 19G-2 0.23346 0.00000 0.00000 0.00000 0.00000
68 19G+3 0.00000 -0.21838 0.00000 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.21838 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 0.07353 0.02464
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 0.14799 0.04960
73 20G+1 0.00000 0.03221 0.00000 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.03221 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.07684 -0.22926
76 20G-2 -0.09111 0.00000 0.00000 0.00000 0.00000
77 20G+3 0.00000 0.08522 0.00000 0.00000 0.00000
78 20G-3 0.00000 0.00000 -0.08522 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 -0.17510 -0.05869
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 -0.39184 0.00000 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 0.03528 0.00000 0.00000
83 21H-1 0.00000 0.03528 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 0.83524 0.27993
86 21H+3 0.00000 0.00000 0.51733 0.00000 0.00000
87 21H-3 0.00000 -0.51733 0.00000 0.00000 0.00000
88 21H+4 0.39276 0.00000 0.00000 0.00000 0.00000
89 21H-4 0.00000 0.00000 0.00000 -0.27993 0.83524
90 21H+5 0.00000 0.00000 -0.19727 0.00000 0.00000
91 21H-5 0.00000 -0.19727 0.00000 0.00000 0.00000
92 2 H 1S -0.18438 -0.18438 -0.18438 0.00000 0.00000
93 2S 0.93539 0.93539 0.93539 0.00000 0.00000
94 3S -2.72010 -2.72010 -2.72010 0.00000 0.00000
95 4S -1.50098 -1.50098 -1.50098 0.00000 0.00000
96 5S 0.07749 0.07749 0.07749 0.00000 0.00000
97 6PX 0.02449 0.02449 -0.06652 0.12299 -0.10871
98 6PY 0.02449 -0.06652 0.02449 0.03265 0.16087
99 6PZ -0.06652 0.02449 0.02449 -0.15564 -0.05216
100 7PX -0.16723 -0.16723 -0.12439 -0.00302 0.00267
101 7PY -0.16723 -0.12439 -0.16723 -0.00080 -0.00394
102 7PZ -0.12439 -0.16723 -0.16723 0.00382 0.00128
103 8PX 1.05535 1.05535 0.39345 0.24822 -0.21939
104 8PY 1.05535 0.39345 1.05535 0.06589 0.32466
105 8PZ 0.39345 1.05535 1.05535 -0.31411 -0.10527
106 9PX 0.51180 0.51180 0.22350 0.16941 -0.14973
107 9PY 0.51180 0.22350 0.51180 0.04497 0.22158
108 9PZ 0.22350 0.51180 0.51180 -0.21438 -0.07185
109 10D 0 0.24084 -0.12042 -0.12042 0.48741 0.16335
110 10D+1 0.03514 0.14390 0.03514 0.02514 0.12388
111 10D-1 0.03514 0.03514 0.14390 0.09471 -0.08371
112 10D+2 0.00000 -0.20858 0.20858 -0.16335 0.48741
113 10D-2 0.14390 0.03514 0.03514 -0.11985 -0.04017
114 11D 0 0.03405 -0.01703 -0.01703 -0.20808 -0.06974
115 11D+1 -0.07615 -0.36149 -0.07615 0.02312 0.11394
116 11D-1 -0.07615 -0.07615 -0.36149 0.08711 -0.07699
117 11D+2 0.00000 -0.02949 0.02949 0.06974 -0.20808
118 11D-2 -0.36149 -0.07615 -0.07615 -0.11023 -0.03694
119 12D 0 -0.17941 0.08971 0.08971 0.05471 0.01834
120 12D+1 0.12830 -0.35559 0.12830 0.03458 0.17041
121 12D-1 0.12830 0.12830 -0.35559 0.13029 -0.11516
122 12D+2 0.00000 0.15538 -0.15538 -0.01834 0.05471
123 12D-2 -0.35559 0.12830 0.12830 -0.16487 -0.05526
124 13F 0 -0.35192 0.08863 0.08863 -0.13718 -0.04598
125 13F+1 -0.17460 0.06606 0.21551 -0.21597 -0.11057
126 13F-1 -0.17460 0.21551 0.06606 -0.23899 -0.04190
127 13F+2 0.00000 0.15220 -0.15220 0.09079 -0.27091
128 13F-2 0.18685 0.18685 0.18685 0.00000 0.00000
129 13F+3 -0.02314 0.16327 -0.27822 -0.03017 -0.20685
130 13F-3 0.02314 0.27822 -0.16327 0.14872 -0.14689
131 14F 0 0.45955 -0.07292 -0.07292 0.22068 0.07396
132 14F+1 0.04925 0.04006 -0.28141 0.14090 -0.05580
133 14F-1 0.04925 -0.28141 0.04006 0.07882 0.12944
134 14F+2 0.00000 -0.00581 0.00581 -0.02070 0.06177
135 14F-2 -0.21651 -0.21651 -0.21651 0.00000 0.00000
136 14F+3 -0.05409 -0.06120 0.36331 -0.11145 0.15175
137 14F-3 0.05409 -0.36331 0.06120 -0.00250 0.18826
138 15G 0 -0.24737 -0.16154 -0.16154 -0.10387 -0.03481
139 15G+1 -0.15421 -0.03554 0.07990 -0.09720 -0.01041
140 15G-1 -0.15421 0.07990 -0.03554 -0.08384 -0.05027
141 15G+2 0.00000 -0.07677 0.07677 -0.05393 0.16091
142 15G-2 0.10053 0.10510 0.10510 -0.07920 -0.02654
143 15G+3 -0.05407 -0.09404 -0.14256 0.01898 -0.08358
144 15G-3 0.05407 0.14256 0.09404 0.03522 -0.07813
145 15G+4 -0.09300 -0.19456 -0.19456 0.12290 0.04119
146 15G-4 0.00000 0.12514 -0.12514 0.03166 -0.09446
147 3 H 1S -0.18438 0.18438 0.18438 0.00000 0.00000
148 2S 0.93539 -0.93539 -0.93539 0.00000 0.00000
149 3S -2.72010 2.72010 2.72010 0.00000 0.00000
150 4S -1.50098 1.50098 1.50098 0.00000 0.00000
151 5S 0.07749 -0.07749 -0.07749 0.00000 0.00000
152 6PX -0.02449 0.02449 -0.06652 -0.12299 0.10871
153 6PY -0.02449 -0.06652 0.02449 -0.03265 -0.16087
154 6PZ -0.06652 -0.02449 -0.02449 -0.15564 -0.05216
155 7PX 0.16723 -0.16723 -0.12439 0.00302 -0.00267
156 7PY 0.16723 -0.12439 -0.16723 0.00080 0.00394
157 7PZ -0.12439 0.16723 0.16723 0.00382 0.00128
158 8PX -1.05535 1.05535 0.39345 -0.24822 0.21939
159 8PY -1.05535 0.39345 1.05535 -0.06589 -0.32466
160 8PZ 0.39345 -1.05535 -1.05535 -0.31411 -0.10527
161 9PX -0.51180 0.51180 0.22350 -0.16941 0.14973
162 9PY -0.51180 0.22350 0.51180 -0.04497 -0.22158
163 9PZ 0.22350 -0.51180 -0.51180 -0.21438 -0.07185
164 10D 0 0.24084 0.12042 0.12042 0.48741 0.16335
165 10D+1 -0.03514 0.14390 0.03514 -0.02514 -0.12388
166 10D-1 -0.03514 0.03514 0.14390 -0.09471 0.08371
167 10D+2 0.00000 0.20858 -0.20858 -0.16335 0.48741
168 10D-2 0.14390 -0.03514 -0.03514 -0.11985 -0.04017
169 11D 0 0.03405 0.01703 0.01703 -0.20808 -0.06974
170 11D+1 0.07615 -0.36149 -0.07615 -0.02312 -0.11394
171 11D-1 0.07615 -0.07615 -0.36149 -0.08711 0.07699
172 11D+2 0.00000 0.02949 -0.02949 0.06974 -0.20808
173 11D-2 -0.36149 0.07615 0.07615 -0.11023 -0.03694
174 12D 0 -0.17941 -0.08971 -0.08971 0.05471 0.01834
175 12D+1 -0.12830 -0.35559 0.12830 -0.03458 -0.17041
176 12D-1 -0.12830 0.12830 -0.35559 -0.13029 0.11516
177 12D+2 0.00000 -0.15538 0.15538 -0.01834 0.05471
178 12D-2 -0.35559 -0.12830 -0.12830 -0.16487 -0.05526
179 13F 0 -0.35192 -0.08863 -0.08863 -0.13718 -0.04598
180 13F+1 0.17460 0.06606 0.21551 0.21597 0.11057
181 13F-1 0.17460 0.21551 0.06606 0.23899 0.04190
182 13F+2 0.00000 -0.15220 0.15220 0.09079 -0.27091
183 13F-2 0.18685 -0.18685 -0.18685 0.00000 0.00000
184 13F+3 0.02314 0.16327 -0.27822 0.03017 0.20685
185 13F-3 -0.02314 0.27822 -0.16327 -0.14872 0.14689
186 14F 0 0.45955 0.07292 0.07292 0.22068 0.07396
187 14F+1 -0.04925 0.04006 -0.28141 -0.14090 0.05580
188 14F-1 -0.04925 -0.28141 0.04006 -0.07882 -0.12944
189 14F+2 0.00000 0.00581 -0.00581 -0.02070 0.06177
190 14F-2 -0.21651 0.21651 0.21651 0.00000 0.00000
191 14F+3 0.05409 -0.06120 0.36331 0.11145 -0.15175
192 14F-3 -0.05409 -0.36331 0.06120 0.00250 -0.18826
193 15G 0 -0.24737 0.16154 0.16154 -0.10387 -0.03481
194 15G+1 0.15421 -0.03554 0.07990 0.09720 0.01041
195 15G-1 0.15421 0.07990 -0.03554 0.08384 0.05027
196 15G+2 0.00000 0.07677 -0.07677 -0.05393 0.16091
197 15G-2 0.10053 -0.10510 -0.10510 -0.07920 -0.02654
198 15G+3 0.05407 -0.09404 -0.14256 -0.01898 0.08358
199 15G-3 -0.05407 0.14256 0.09404 -0.03522 0.07813
200 15G+4 -0.09300 0.19456 0.19456 0.12290 0.04119
201 15G-4 0.00000 -0.12514 0.12514 0.03166 -0.09446
202 4 H 1S 0.18438 0.18438 -0.18438 0.00000 0.00000
203 2S -0.93539 -0.93539 0.93539 0.00000 0.00000
204 3S 2.72010 2.72010 -2.72010 0.00000 0.00000
205 4S 1.50098 1.50098 -1.50098 0.00000 0.00000
206 5S -0.07749 -0.07749 0.07749 0.00000 0.00000
207 6PX -0.02449 -0.02449 -0.06652 0.12299 -0.10871
208 6PY 0.02449 -0.06652 -0.02449 -0.03265 -0.16087
209 6PZ -0.06652 0.02449 -0.02449 0.15564 0.05216
210 7PX 0.16723 0.16723 -0.12439 -0.00302 0.00267
211 7PY -0.16723 -0.12439 0.16723 0.00080 0.00394
212 7PZ -0.12439 -0.16723 0.16723 -0.00382 -0.00128
213 8PX -1.05535 -1.05535 0.39345 0.24822 -0.21939
214 8PY 1.05535 0.39345 -1.05535 -0.06589 -0.32466
215 8PZ 0.39345 1.05535 -1.05535 0.31411 0.10527
216 9PX -0.51180 -0.51180 0.22350 0.16941 -0.14973
217 9PY 0.51180 0.22350 -0.51180 -0.04497 -0.22158
218 9PZ 0.22350 0.51180 -0.51180 0.21438 0.07185
219 10D 0 -0.24084 0.12042 -0.12042 0.48741 0.16335
220 10D+1 0.03514 0.14390 -0.03514 -0.02514 -0.12388
221 10D-1 -0.03514 -0.03514 0.14390 0.09471 -0.08371
222 10D+2 0.00000 0.20858 0.20858 -0.16335 0.48741
223 10D-2 0.14390 0.03514 -0.03514 0.11985 0.04017
224 11D 0 -0.03405 0.01703 -0.01703 -0.20808 -0.06974
225 11D+1 -0.07615 -0.36149 0.07615 -0.02312 -0.11394
226 11D-1 0.07615 0.07615 -0.36149 0.08711 -0.07699
227 11D+2 0.00000 0.02949 0.02949 0.06974 -0.20808
228 11D-2 -0.36149 -0.07615 0.07615 0.11023 0.03694
229 12D 0 0.17941 -0.08971 0.08971 0.05471 0.01834
230 12D+1 0.12830 -0.35559 -0.12830 -0.03458 -0.17041
231 12D-1 -0.12830 -0.12830 -0.35559 0.13029 -0.11516
232 12D+2 0.00000 -0.15538 -0.15538 -0.01834 0.05471
233 12D-2 -0.35559 0.12830 -0.12830 0.16487 0.05526
234 13F 0 -0.35192 0.08863 -0.08863 0.13718 0.04598
235 13F+1 0.17460 -0.06606 0.21551 -0.21597 -0.11057
236 13F-1 -0.17460 0.21551 -0.06606 0.23899 0.04190
237 13F+2 0.00000 0.15220 0.15220 -0.09079 0.27091
238 13F-2 -0.18685 -0.18685 0.18685 0.00000 0.00000
239 13F+3 0.02314 -0.16327 -0.27822 -0.03017 -0.20685
240 13F-3 0.02314 0.27822 0.16327 -0.14872 0.14689
241 14F 0 0.45955 -0.07292 0.07292 -0.22068 -0.07396
242 14F+1 -0.04925 -0.04006 -0.28141 0.14090 -0.05580
243 14F-1 0.04925 -0.28141 -0.04006 -0.07882 -0.12944
244 14F+2 0.00000 -0.00581 -0.00581 0.02070 -0.06177
245 14F-2 0.21651 0.21651 -0.21651 0.00000 0.00000
246 14F+3 0.05409 0.06120 0.36331 -0.11145 0.15175
247 14F-3 0.05409 -0.36331 -0.06120 0.00250 -0.18826
248 15G 0 0.24737 0.16154 -0.16154 -0.10387 -0.03481
249 15G+1 -0.15421 -0.03554 -0.07990 0.09720 0.01041
250 15G-1 0.15421 -0.07990 -0.03554 -0.08384 -0.05027
251 15G+2 0.00000 0.07677 0.07677 -0.05393 0.16091
252 15G-2 0.10053 0.10510 -0.10510 0.07920 0.02654
253 15G+3 -0.05407 -0.09404 0.14256 -0.01898 0.08358
254 15G-3 -0.05407 -0.14256 0.09404 0.03522 -0.07813
255 15G+4 0.09300 0.19456 -0.19456 0.12290 0.04119
256 15G-4 0.00000 0.12514 0.12514 -0.03166 0.09446
257 5 H 1S 0.18438 -0.18438 0.18438 0.00000 0.00000
258 2S -0.93539 0.93539 -0.93539 0.00000 0.00000
259 3S 2.72010 -2.72010 2.72010 0.00000 0.00000
260 4S 1.50098 -1.50098 1.50098 0.00000 0.00000
261 5S -0.07749 0.07749 -0.07749 0.00000 0.00000
262 6PX 0.02449 -0.02449 -0.06652 -0.12299 0.10871
263 6PY -0.02449 -0.06652 -0.02449 0.03265 0.16087
264 6PZ -0.06652 -0.02449 0.02449 0.15564 0.05216
265 7PX -0.16723 0.16723 -0.12439 0.00302 -0.00267
266 7PY 0.16723 -0.12439 0.16723 -0.00080 -0.00394
267 7PZ -0.12439 0.16723 -0.16723 -0.00382 -0.00128
268 8PX 1.05535 -1.05535 0.39345 -0.24822 0.21939
269 8PY -1.05535 0.39345 -1.05535 0.06589 0.32466
270 8PZ 0.39345 -1.05535 1.05535 0.31411 0.10527
271 9PX 0.51180 -0.51180 0.22350 -0.16941 0.14973
272 9PY -0.51180 0.22350 -0.51180 0.04497 0.22158
273 9PZ 0.22350 -0.51180 0.51180 0.21438 0.07185
274 10D 0 -0.24084 -0.12042 0.12042 0.48741 0.16335
275 10D+1 -0.03514 0.14390 -0.03514 0.02514 0.12388
276 10D-1 0.03514 -0.03514 0.14390 -0.09471 0.08371
277 10D+2 0.00000 -0.20858 -0.20858 -0.16335 0.48741
278 10D-2 0.14390 -0.03514 0.03514 0.11985 0.04017
279 11D 0 -0.03405 -0.01703 0.01703 -0.20808 -0.06974
280 11D+1 0.07615 -0.36149 0.07615 0.02312 0.11394
281 11D-1 -0.07615 0.07615 -0.36149 -0.08711 0.07699
282 11D+2 0.00000 -0.02949 -0.02949 0.06974 -0.20808
283 11D-2 -0.36149 0.07615 -0.07615 0.11023 0.03694
284 12D 0 0.17941 0.08971 -0.08971 0.05471 0.01834
285 12D+1 -0.12830 -0.35559 -0.12830 0.03458 0.17041
286 12D-1 0.12830 -0.12830 -0.35559 -0.13029 0.11516
287 12D+2 0.00000 0.15538 0.15538 -0.01834 0.05471
288 12D-2 -0.35559 -0.12830 0.12830 0.16487 0.05526
289 13F 0 -0.35192 -0.08863 0.08863 0.13718 0.04598
290 13F+1 -0.17460 -0.06606 0.21551 0.21597 0.11057
291 13F-1 0.17460 0.21551 -0.06606 -0.23899 -0.04190
292 13F+2 0.00000 -0.15220 -0.15220 -0.09079 0.27091
293 13F-2 -0.18685 0.18685 -0.18685 0.00000 0.00000
294 13F+3 -0.02314 -0.16327 -0.27822 0.03017 0.20685
295 13F-3 -0.02314 0.27822 0.16327 0.14872 -0.14689
296 14F 0 0.45955 0.07292 -0.07292 -0.22068 -0.07396
297 14F+1 0.04925 -0.04006 -0.28141 -0.14090 0.05580
298 14F-1 -0.04925 -0.28141 -0.04006 0.07882 0.12944
299 14F+2 0.00000 0.00581 0.00581 0.02070 -0.06177
300 14F-2 0.21651 -0.21651 0.21651 0.00000 0.00000
301 14F+3 -0.05409 0.06120 0.36331 0.11145 -0.15175
302 14F-3 -0.05409 -0.36331 -0.06120 -0.00250 0.18826
303 15G 0 0.24737 -0.16154 0.16154 -0.10387 -0.03481
304 15G+1 0.15421 -0.03554 -0.07990 -0.09720 -0.01041
305 15G-1 -0.15421 -0.07990 -0.03554 0.08384 0.05027
306 15G+2 0.00000 -0.07677 -0.07677 -0.05393 0.16091
307 15G-2 0.10053 -0.10510 0.10510 0.07920 0.02654
308 15G+3 0.05407 -0.09404 0.14256 0.01898 -0.08358
309 15G-3 0.05407 -0.14256 0.09404 -0.03522 0.07813
310 15G+4 0.09300 -0.19456 0.19456 0.12290 0.04119
311 15G-4 0.00000 -0.12514 -0.12514 -0.03166 0.09446
271 272 273 274 275
(A1)--V (T2)--V (T2)--V (T2)--V (A1)--V
Eigenvalues -- 15.53930 15.63466 15.63466 15.63466 15.67923
1 1 C 1S 0.05504 0.00000 0.00000 0.00000 -0.01936
2 2S -0.45081 0.00000 0.00000 0.00000 -0.15869
3 3S -1.83625 0.00000 0.00000 0.00000 -1.93763
4 4S -5.07030 0.00000 0.00000 0.00000 8.79531
5 5S 24.40977 0.00000 0.00000 0.00000 -2.11431
6 6S 2.26218 0.00000 0.00000 0.00000 1.79454
7 7PX 0.00000 0.00000 0.00000 0.16104 0.00000
8 7PY 0.00000 0.00000 0.16104 0.00000 0.00000
9 7PZ 0.00000 0.16104 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 -3.13567 0.00000
11 8PY 0.00000 0.00000 -3.13567 0.00000 0.00000
12 8PZ 0.00000 -3.13567 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 24.33261 0.00000
14 9PY 0.00000 0.00000 24.33261 0.00000 0.00000
15 9PZ 0.00000 24.33261 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 8.20107 0.00000
17 10PY 0.00000 0.00000 8.20107 0.00000 0.00000
18 10PZ 0.00000 8.20107 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 0.22859 0.00000
20 11PY 0.00000 0.00000 0.22859 0.00000 0.00000
21 11PZ 0.00000 0.22859 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 -0.28520 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 -0.28520 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 -0.28520 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 0.34009 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.34009 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.34009 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 11.10847 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 11.10847 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 11.10847 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 2.85154 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 2.85154 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 2.85154 0.00000 0.00000 0.00000
42 16F 0 0.00000 0.52823 0.00000 0.00000 0.00000
43 16F+1 0.00000 0.00000 0.00000 -0.32347 0.00000
44 16F-1 0.00000 0.00000 -0.32347 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-2 0.35031 0.00000 0.00000 0.00000 0.17123
47 16F+3 0.00000 0.00000 0.00000 0.41760 0.00000
48 16F-3 0.00000 0.00000 -0.41760 0.00000 0.00000
49 17F 0 0.00000 -2.45447 0.00000 0.00000 0.00000
50 17F+1 0.00000 0.00000 0.00000 1.50305 0.00000
51 17F-1 0.00000 0.00000 1.50305 0.00000 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
53 17F-2 0.78949 0.00000 0.00000 0.00000 0.98033
54 17F+3 0.00000 0.00000 0.00000 -1.94043 0.00000
55 17F-3 0.00000 0.00000 1.94043 0.00000 0.00000
56 18F 0 0.00000 -1.85907 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.00000 0.00000 1.13845 0.00000
58 18F-1 0.00000 0.00000 1.13845 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
60 18F-2 1.81861 0.00000 0.00000 0.00000 -0.60360
61 18F+3 0.00000 0.00000 0.00000 -1.46973 0.00000
62 18F-3 0.00000 0.00000 1.46973 0.00000 0.00000
63 19G 0 -0.40663 0.00000 0.00000 0.00000 -0.21878
64 19G+1 0.00000 0.00000 0.02841 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.02841 0.00000
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 -0.08035 0.00000 0.00000 0.00000
68 19G+3 0.00000 0.00000 0.07516 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 -0.07516 0.00000
70 19G+4 -0.34366 0.00000 0.00000 0.00000 -0.18490
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.46349 0.00000 0.00000 0.00000 -0.58866
73 20G+1 0.00000 0.00000 -0.47251 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.00000 -0.47251 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 1.33647 0.00000 0.00000 0.00000
77 20G+3 0.00000 0.00000 -1.25015 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.00000 1.25015 0.00000
79 20G+4 0.39172 0.00000 0.00000 0.00000 -0.49750
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 -0.01984 0.00000 0.00000 0.00000
82 21H+1 0.00000 0.00000 0.00000 0.26325 0.00000
83 21H-1 0.00000 0.00000 0.26325 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 0.38930 0.00000
87 21H-3 0.00000 0.00000 -0.38930 0.00000 0.00000
88 21H+4 0.00000 0.47634 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 0.08023 0.00000
91 21H-5 0.00000 0.00000 0.08023 0.00000 0.00000
92 2 H 1S 0.00949 0.39596 0.39596 0.39596 0.51241
93 2S 0.70483 0.00958 0.00958 0.00958 -1.21221
94 3S -5.86102 -13.04053 -13.04053 -13.04053 1.03580
95 4S -2.29892 -4.54201 -4.54201 -4.54201 -1.28989
96 5S 0.00454 0.00909 0.00909 0.00909 -0.01552
97 6PX 0.16117 -0.02836 -0.02836 0.10635 0.23576
98 6PY 0.16117 -0.02836 0.10635 -0.02836 0.23576
99 6PZ 0.16117 0.10635 -0.02836 -0.02836 0.23576
100 7PX -0.18240 -0.16895 -0.16895 -0.24691 -0.10892
101 7PY -0.18240 -0.16895 -0.24691 -0.16895 -0.10892
102 7PZ -0.18240 -0.24691 -0.16895 -0.16895 -0.10892
103 8PX 1.28787 4.13413 4.13413 3.61558 0.45867
104 8PY 1.28787 4.13413 3.61558 4.13413 0.45867
105 8PZ 1.28787 3.61558 4.13413 4.13413 0.45867
106 9PX 0.56001 1.34322 1.34322 1.20409 0.32572
107 9PY 0.56001 1.34322 1.20409 1.34322 0.32572
108 9PZ 0.56001 1.20409 1.34322 1.34322 0.32572
109 10D 0 0.00000 -0.25899 0.12950 0.12950 0.00000
110 10D+1 -0.20788 0.32023 0.38617 0.32023 -0.03042
111 10D-1 -0.20788 0.32023 0.32023 0.38617 -0.03042
112 10D+2 0.00000 0.00000 0.22429 -0.22429 0.00000
113 10D-2 -0.20788 0.38617 0.32023 0.32023 -0.03042
114 11D 0 0.00000 0.43169 -0.21584 -0.21584 0.00000
115 11D+1 -0.05689 -0.77526 -0.81201 -0.77526 -0.15442
116 11D-1 -0.05689 -0.77526 -0.77526 -0.81201 -0.15442
117 11D+2 0.00000 0.00000 -0.37385 0.37385 0.00000
118 11D-2 -0.05689 -0.81201 -0.77526 -0.77526 -0.15442
119 12D 0 0.00000 0.25608 -0.12804 -0.12804 0.00000
120 12D+1 0.13072 -0.49327 -0.65235 -0.49327 -0.47419
121 12D-1 0.13072 -0.49327 -0.49327 -0.65235 -0.47419
122 12D+2 0.00000 0.00000 -0.22177 0.22177 0.00000
123 12D-2 0.13072 -0.65235 -0.49327 -0.49327 -0.47419
124 13F 0 -0.15496 -0.07649 0.00950 0.00950 -0.00598
125 13F+1 0.09490 0.06160 -0.07323 0.04684 0.00366
126 13F-1 0.09490 0.06160 0.04684 -0.07323 0.00366
127 13F+2 0.00000 0.00000 -0.08527 0.08527 0.00000
128 13F-2 0.41977 0.01803 0.01803 0.01803 -0.05610
129 13F+3 -0.12251 0.05973 -0.04471 -0.06047 -0.00473
130 13F-3 0.12251 -0.05973 0.06047 0.04471 0.00473
131 14F 0 0.13783 -0.15563 0.10185 0.10185 -0.14379
132 14F+1 -0.08440 -0.14020 0.01546 0.09530 0.08805
133 14F-1 -0.08440 -0.14020 0.09530 0.01546 0.08805
134 14F+2 0.00000 0.00000 0.09844 -0.09844 0.00000
135 14F-2 -0.57398 0.02077 0.02077 0.02077 0.54207
136 14F+3 0.10897 0.02023 0.14080 -0.12303 -0.11367
137 14F-3 -0.10897 -0.02023 0.12303 -0.14080 0.11367
138 15G 0 0.01081 -0.04555 -0.18765 -0.18765 0.00327
139 15G+1 -0.04648 0.08811 -0.02313 -0.19049 0.08619
140 15G-1 -0.04648 0.08811 -0.19049 -0.02313 0.08619
141 15G+2 0.00000 0.00000 0.12710 -0.12710 0.00000
142 15G-2 0.13146 0.06543 0.14478 0.14478 -0.24379
143 15G+3 -0.12297 -0.18808 -0.06120 -0.08278 0.22805
144 15G-3 0.12297 0.18808 0.08278 0.06120 -0.22805
145 15G+4 0.00914 -0.23065 -0.06252 -0.06252 0.00277
146 15G-4 0.00000 0.00000 -0.14892 0.14892 0.00000
147 3 H 1S 0.00949 0.39596 -0.39596 -0.39596 0.51241
148 2S 0.70483 0.00958 -0.00958 -0.00958 -1.21221
149 3S -5.86102 -13.04053 13.04053 13.04053 1.03580
150 4S -2.29892 -4.54201 4.54201 4.54201 -1.28989
151 5S 0.00454 0.00909 -0.00909 -0.00909 -0.01552
152 6PX -0.16117 0.02836 -0.02836 0.10635 -0.23576
153 6PY -0.16117 0.02836 0.10635 -0.02836 -0.23576
154 6PZ 0.16117 0.10635 0.02836 0.02836 0.23576
155 7PX 0.18240 0.16895 -0.16895 -0.24691 0.10892
156 7PY 0.18240 0.16895 -0.24691 -0.16895 0.10892
157 7PZ -0.18240 -0.24691 0.16895 0.16895 -0.10892
158 8PX -1.28787 -4.13413 4.13413 3.61558 -0.45867
159 8PY -1.28787 -4.13413 3.61558 4.13413 -0.45867
160 8PZ 1.28787 3.61558 -4.13413 -4.13413 0.45867
161 9PX -0.56001 -1.34322 1.34322 1.20409 -0.32572
162 9PY -0.56001 -1.34322 1.20409 1.34322 -0.32572
163 9PZ 0.56001 1.20409 -1.34322 -1.34322 0.32572
164 10D 0 0.00000 -0.25899 -0.12950 -0.12950 0.00000
165 10D+1 0.20788 -0.32023 0.38617 0.32023 0.03042
166 10D-1 0.20788 -0.32023 0.32023 0.38617 0.03042
167 10D+2 0.00000 0.00000 -0.22429 0.22429 0.00000
168 10D-2 -0.20788 0.38617 -0.32023 -0.32023 -0.03042
169 11D 0 0.00000 0.43169 0.21584 0.21584 0.00000
170 11D+1 0.05689 0.77526 -0.81201 -0.77526 0.15442
171 11D-1 0.05689 0.77526 -0.77526 -0.81201 0.15442
172 11D+2 0.00000 0.00000 0.37385 -0.37385 0.00000
173 11D-2 -0.05689 -0.81201 0.77526 0.77526 -0.15442
174 12D 0 0.00000 0.25608 0.12804 0.12804 0.00000
175 12D+1 -0.13072 0.49327 -0.65235 -0.49327 0.47419
176 12D-1 -0.13072 0.49327 -0.49327 -0.65235 0.47419
177 12D+2 0.00000 0.00000 0.22177 -0.22177 0.00000
178 12D-2 0.13072 -0.65235 0.49327 0.49327 -0.47419
179 13F 0 -0.15496 -0.07649 -0.00950 -0.00950 -0.00598
180 13F+1 -0.09490 -0.06160 -0.07323 0.04684 -0.00366
181 13F-1 -0.09490 -0.06160 0.04684 -0.07323 -0.00366
182 13F+2 0.00000 0.00000 0.08527 -0.08527 0.00000
183 13F-2 0.41977 0.01803 -0.01803 -0.01803 -0.05610
184 13F+3 0.12251 -0.05973 -0.04471 -0.06047 0.00473
185 13F-3 -0.12251 0.05973 0.06047 0.04471 -0.00473
186 14F 0 0.13783 -0.15563 -0.10185 -0.10185 -0.14379
187 14F+1 0.08440 0.14020 0.01546 0.09530 -0.08805
188 14F-1 0.08440 0.14020 0.09530 0.01546 -0.08805
189 14F+2 0.00000 0.00000 -0.09844 0.09844 0.00000
190 14F-2 -0.57398 0.02077 -0.02077 -0.02077 0.54207
191 14F+3 -0.10897 -0.02023 0.14080 -0.12303 0.11367
192 14F-3 0.10897 0.02023 0.12303 -0.14080 -0.11367
193 15G 0 0.01081 -0.04555 0.18765 0.18765 0.00327
194 15G+1 0.04648 -0.08811 -0.02313 -0.19049 -0.08619
195 15G-1 0.04648 -0.08811 -0.19049 -0.02313 -0.08619
196 15G+2 0.00000 0.00000 -0.12710 0.12710 0.00000
197 15G-2 0.13146 0.06543 -0.14478 -0.14478 -0.24379
198 15G+3 0.12297 0.18808 -0.06120 -0.08278 -0.22805
199 15G-3 -0.12297 -0.18808 0.08278 0.06120 0.22805
200 15G+4 0.00914 -0.23065 0.06252 0.06252 0.00277
201 15G-4 0.00000 0.00000 0.14892 -0.14892 0.00000
202 4 H 1S 0.00949 -0.39596 -0.39596 0.39596 0.51241
203 2S 0.70483 -0.00958 -0.00958 0.00958 -1.21221
204 3S -5.86102 13.04053 13.04053 -13.04053 1.03580
205 4S -2.29892 4.54201 4.54201 -4.54201 -1.28989
206 5S 0.00454 -0.00909 -0.00909 0.00909 -0.01552
207 6PX 0.16117 0.02836 0.02836 0.10635 0.23576
208 6PY -0.16117 -0.02836 0.10635 0.02836 -0.23576
209 6PZ -0.16117 0.10635 -0.02836 0.02836 -0.23576
210 7PX -0.18240 0.16895 0.16895 -0.24691 -0.10892
211 7PY 0.18240 -0.16895 -0.24691 0.16895 0.10892
212 7PZ 0.18240 -0.24691 -0.16895 0.16895 0.10892
213 8PX 1.28787 -4.13413 -4.13413 3.61558 0.45867
214 8PY -1.28787 4.13413 3.61558 -4.13413 -0.45867
215 8PZ -1.28787 3.61558 4.13413 -4.13413 -0.45867
216 9PX 0.56001 -1.34322 -1.34322 1.20409 0.32572
217 9PY -0.56001 1.34322 1.20409 -1.34322 -0.32572
218 9PZ -0.56001 1.20409 1.34322 -1.34322 -0.32572
219 10D 0 0.00000 0.25899 -0.12950 0.12950 0.00000
220 10D+1 0.20788 0.32023 0.38617 -0.32023 0.03042
221 10D-1 -0.20788 -0.32023 -0.32023 0.38617 -0.03042
222 10D+2 0.00000 0.00000 -0.22429 -0.22429 0.00000
223 10D-2 0.20788 0.38617 0.32023 -0.32023 0.03042
224 11D 0 0.00000 -0.43169 0.21584 -0.21584 0.00000
225 11D+1 0.05689 -0.77526 -0.81201 0.77526 0.15442
226 11D-1 -0.05689 0.77526 0.77526 -0.81201 -0.15442
227 11D+2 0.00000 0.00000 0.37385 0.37385 0.00000
228 11D-2 0.05689 -0.81201 -0.77526 0.77526 0.15442
229 12D 0 0.00000 -0.25608 0.12804 -0.12804 0.00000
230 12D+1 -0.13072 -0.49327 -0.65235 0.49327 0.47419
231 12D-1 0.13072 0.49327 0.49327 -0.65235 -0.47419
232 12D+2 0.00000 0.00000 0.22177 0.22177 0.00000
233 12D-2 -0.13072 -0.65235 -0.49327 0.49327 0.47419
234 13F 0 0.15496 -0.07649 0.00950 -0.00950 0.00598
235 13F+1 0.09490 -0.06160 0.07323 0.04684 0.00366
236 13F-1 -0.09490 0.06160 0.04684 0.07323 -0.00366
237 13F+2 0.00000 0.00000 -0.08527 -0.08527 0.00000
238 13F-2 0.41977 -0.01803 -0.01803 0.01803 -0.05610
239 13F+3 -0.12251 -0.05973 0.04471 -0.06047 -0.00473
240 13F-3 -0.12251 -0.05973 0.06047 -0.04471 -0.00473
241 14F 0 -0.13783 -0.15563 0.10185 -0.10185 0.14379
242 14F+1 -0.08440 0.14020 -0.01546 0.09530 0.08805
243 14F-1 0.08440 -0.14020 0.09530 -0.01546 -0.08805
244 14F+2 0.00000 0.00000 0.09844 0.09844 0.00000
245 14F-2 -0.57398 -0.02077 -0.02077 0.02077 0.54207
246 14F+3 0.10897 -0.02023 -0.14080 -0.12303 -0.11367
247 14F-3 0.10897 -0.02023 0.12303 0.14080 -0.11367
248 15G 0 0.01081 0.04555 0.18765 -0.18765 0.00327
249 15G+1 0.04648 0.08811 -0.02313 0.19049 -0.08619
250 15G-1 -0.04648 -0.08811 0.19049 -0.02313 0.08619
251 15G+2 0.00000 0.00000 -0.12710 -0.12710 0.00000
252 15G-2 -0.13146 0.06543 0.14478 -0.14478 0.24379
253 15G+3 0.12297 -0.18808 -0.06120 0.08278 -0.22805
254 15G-3 0.12297 -0.18808 -0.08278 0.06120 -0.22805
255 15G+4 0.00914 0.23065 0.06252 -0.06252 0.00277
256 15G-4 0.00000 0.00000 -0.14892 -0.14892 0.00000
257 5 H 1S 0.00949 -0.39596 0.39596 -0.39596 0.51241
258 2S 0.70483 -0.00958 0.00958 -0.00958 -1.21221
259 3S -5.86102 13.04053 -13.04053 13.04053 1.03580
260 4S -2.29892 4.54201 -4.54201 4.54201 -1.28989
261 5S 0.00454 -0.00909 0.00909 -0.00909 -0.01552
262 6PX -0.16117 -0.02836 0.02836 0.10635 -0.23576
263 6PY 0.16117 0.02836 0.10635 0.02836 0.23576
264 6PZ -0.16117 0.10635 0.02836 -0.02836 -0.23576
265 7PX 0.18240 -0.16895 0.16895 -0.24691 0.10892
266 7PY -0.18240 0.16895 -0.24691 0.16895 -0.10892
267 7PZ 0.18240 -0.24691 0.16895 -0.16895 0.10892
268 8PX -1.28787 4.13413 -4.13413 3.61558 -0.45867
269 8PY 1.28787 -4.13413 3.61558 -4.13413 0.45867
270 8PZ -1.28787 3.61558 -4.13413 4.13413 -0.45867
271 9PX -0.56001 1.34322 -1.34322 1.20409 -0.32572
272 9PY 0.56001 -1.34322 1.20409 -1.34322 0.32572
273 9PZ -0.56001 1.20409 -1.34322 1.34322 -0.32572
274 10D 0 0.00000 0.25899 0.12950 -0.12950 0.00000
275 10D+1 -0.20788 -0.32023 0.38617 -0.32023 -0.03042
276 10D-1 0.20788 0.32023 -0.32023 0.38617 0.03042
277 10D+2 0.00000 0.00000 0.22429 0.22429 0.00000
278 10D-2 0.20788 0.38617 -0.32023 0.32023 0.03042
279 11D 0 0.00000 -0.43169 -0.21584 0.21584 0.00000
280 11D+1 -0.05689 0.77526 -0.81201 0.77526 -0.15442
281 11D-1 0.05689 -0.77526 0.77526 -0.81201 0.15442
282 11D+2 0.00000 0.00000 -0.37385 -0.37385 0.00000
283 11D-2 0.05689 -0.81201 0.77526 -0.77526 0.15442
284 12D 0 0.00000 -0.25608 -0.12804 0.12804 0.00000
285 12D+1 0.13072 0.49327 -0.65235 0.49327 -0.47419
286 12D-1 -0.13072 -0.49327 0.49327 -0.65235 0.47419
287 12D+2 0.00000 0.00000 -0.22177 -0.22177 0.00000
288 12D-2 -0.13072 -0.65235 0.49327 -0.49327 0.47419
289 13F 0 0.15496 -0.07649 -0.00950 0.00950 0.00598
290 13F+1 -0.09490 0.06160 0.07323 0.04684 -0.00366
291 13F-1 0.09490 -0.06160 0.04684 0.07323 0.00366
292 13F+2 0.00000 0.00000 0.08527 0.08527 0.00000
293 13F-2 0.41977 -0.01803 0.01803 -0.01803 -0.05610
294 13F+3 0.12251 0.05973 0.04471 -0.06047 0.00473
295 13F-3 0.12251 0.05973 0.06047 -0.04471 0.00473
296 14F 0 -0.13783 -0.15563 -0.10185 0.10185 0.14379
297 14F+1 0.08440 -0.14020 -0.01546 0.09530 -0.08805
298 14F-1 -0.08440 0.14020 0.09530 -0.01546 0.08805
299 14F+2 0.00000 0.00000 -0.09844 -0.09844 0.00000
300 14F-2 -0.57398 -0.02077 0.02077 -0.02077 0.54207
301 14F+3 -0.10897 0.02023 -0.14080 -0.12303 0.11367
302 14F-3 -0.10897 0.02023 0.12303 0.14080 0.11367
303 15G 0 0.01081 0.04555 -0.18765 0.18765 0.00327
304 15G+1 -0.04648 -0.08811 -0.02313 0.19049 0.08619
305 15G-1 0.04648 0.08811 0.19049 -0.02313 -0.08619
306 15G+2 0.00000 0.00000 0.12710 0.12710 0.00000
307 15G-2 -0.13146 0.06543 -0.14478 0.14478 0.24379
308 15G+3 -0.12297 0.18808 -0.06120 0.08278 0.22805
309 15G-3 -0.12297 0.18808 -0.08278 0.06120 0.22805
310 15G+4 0.00914 0.23065 -0.06252 0.06252 0.00277
311 15G-4 0.00000 0.00000 0.14892 0.14892 0.00000
276 277 278 279 280
(T2)--V (T2)--V (T2)--V (E)--V (E)--V
Eigenvalues -- 15.79632 15.79632 15.79632 15.94636 15.94636
1 1 C 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 0.11314 0.00000 0.00000 0.00000
8 7PY -0.11314 0.00000 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.11314 0.00000 0.00000
10 8PX 0.00000 -0.40412 0.00000 0.00000 0.00000
11 8PY 0.40412 0.00000 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 -0.40412 0.00000 0.00000
13 9PX 0.00000 -0.07388 0.00000 0.00000 0.00000
14 9PY 0.07388 0.00000 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 -0.07388 0.00000 0.00000
16 10PX 0.00000 0.64928 0.00000 0.00000 0.00000
17 10PY -0.64928 0.00000 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.64928 0.00000 0.00000
19 11PX 0.00000 0.20868 0.00000 0.00000 0.00000
20 11PY -0.20868 0.00000 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.20868 0.00000 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.18318 0.00681
23 12D+1 0.12919 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 -0.12919 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 -0.00681 0.18318
26 12D-2 0.00000 0.00000 -0.12919 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 -0.38843 -0.01444
28 13D+1 0.14428 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 -0.14428 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.01444 -0.38843
31 13D-2 0.00000 0.00000 -0.14428 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.67076 0.02494
33 14D+1 -0.02555 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.02555 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 -0.02494 0.67076
36 14D-2 0.00000 0.00000 0.02555 0.00000 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.35874 0.01334
38 15D+1 -0.20205 0.00000 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.20205 0.00000 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.00000 -0.01334 0.35874
41 15D-2 0.00000 0.00000 0.20205 0.00000 0.00000
42 16F 0 0.00000 0.00000 -0.14509 0.00000 0.00000
43 16F+1 0.00000 0.08885 0.00000 0.00000 0.00000
44 16F-1 -0.08885 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 -0.11470 0.00000 0.00000 0.00000
48 16F-3 -0.11470 0.00000 0.00000 0.00000 0.00000
49 17F 0 0.00000 0.00000 1.01857 0.00000 0.00000
50 17F+1 0.00000 -0.62375 0.00000 0.00000 0.00000
51 17F-1 0.62375 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 0.80525 0.00000 0.00000 0.00000
55 17F-3 0.80525 0.00000 0.00000 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.31192 0.00000 0.00000
57 18F+1 0.00000 -0.19101 0.00000 0.00000 0.00000
58 18F-1 0.19101 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 0.24660 0.00000 0.00000 0.00000
62 18F-3 0.24660 0.00000 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 -0.25312 -0.00941
64 19G+1 -0.12149 0.00000 0.00000 0.00000 0.00000
65 19G-1 0.00000 0.12149 0.00000 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.00000 -0.01458 0.39214
67 19G-2 0.00000 0.00000 -0.34362 0.00000 0.00000
68 19G+3 -0.32142 0.00000 0.00000 0.00000 0.00000
69 19G-3 0.00000 -0.32142 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 0.00000 0.29950 0.01113
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 -1.00507 -0.03737
73 20G+1 -0.03786 0.00000 0.00000 0.00000 0.00000
74 20G-1 0.00000 0.03786 0.00000 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.00000 -0.05789 1.55705
76 20G-2 0.00000 0.00000 -0.10709 0.00000 0.00000
77 20G+3 -0.10017 0.00000 0.00000 0.00000 0.00000
78 20G-3 0.00000 -0.10017 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 0.00000 1.18922 0.04421
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.44687 0.00000 0.00000
82 21H+1 0.00000 0.03070 0.00000 0.00000 0.00000
83 21H-1 -0.03070 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 0.11373 0.00423
86 21H+3 0.00000 -0.49147 0.00000 0.00000 0.00000
87 21H-3 -0.49147 0.00000 0.00000 0.00000 0.00000
88 21H+4 0.00000 0.00000 -0.32408 0.00000 0.00000
89 21H-4 0.00000 0.00000 0.00000 -0.00423 0.11373
90 21H+5 0.00000 0.24945 0.00000 0.00000 0.00000
91 21H-5 -0.24945 0.00000 0.00000 0.00000 0.00000
92 2 H 1S 0.18213 -0.18213 -0.18213 0.00000 0.00000
93 2S -0.34274 0.34274 0.34274 0.00000 0.00000
94 3S -0.08762 0.08762 0.08762 0.00000 0.00000
95 4S 0.41387 -0.41387 -0.41387 0.00000 0.00000
96 5S 0.11519 -0.11519 -0.11519 0.00000 0.00000
97 6PX 0.22218 0.13287 -0.22218 0.12845 -0.20453
98 6PY -0.13287 -0.22218 -0.22218 0.11290 0.21350
99 6PZ 0.22218 -0.22218 0.13287 -0.24135 -0.00897
100 7PX -0.13324 -0.02505 0.13324 -0.08629 0.13741
101 7PY 0.02505 0.13324 0.13324 -0.07585 -0.14344
102 7PZ -0.13324 0.13324 -0.02505 0.16215 0.00603
103 8PX 0.18778 -0.25346 -0.18778 0.24406 -0.38863
104 8PY 0.25346 -0.18778 -0.18778 0.21453 0.40568
105 8PZ 0.18778 -0.18778 -0.25346 -0.45859 -0.01705
106 9PX -0.14674 0.04030 0.14674 0.08223 -0.13094
107 9PY -0.04030 0.14674 0.14674 0.07228 0.13668
108 9PZ -0.14674 0.14674 0.04030 -0.15451 -0.00574
109 10D 0 -0.11673 0.11673 -0.23346 -0.08666 -0.00322
110 10D+1 -0.36396 -0.16794 -0.16794 0.19259 0.36418
111 10D-1 0.16794 0.36396 -0.16794 0.21909 -0.34887
112 10D+2 -0.20218 -0.20218 0.00000 0.00322 -0.08666
113 10D-2 0.16794 -0.16794 0.36396 -0.41168 -0.01531
114 11D 0 0.04175 -0.04175 0.08350 0.38932 0.01447
115 11D+1 0.31934 0.24643 0.24643 -0.23531 -0.44498
116 11D-1 -0.24643 -0.31934 0.24643 -0.26771 0.42628
117 11D+2 0.07231 0.07231 0.00000 -0.01447 0.38932
118 11D-2 -0.24643 0.24643 -0.31934 0.50302 0.01870
119 12D 0 -0.04769 0.04769 -0.09538 0.33348 0.01240
120 12D+1 0.03541 0.10091 0.10091 0.00204 0.00385
121 12D-1 -0.10091 -0.03541 0.10091 0.00232 -0.00369
122 12D+2 -0.08260 -0.08260 0.00000 -0.01240 0.33348
123 12D-2 -0.10091 0.10091 -0.03541 -0.00436 -0.00016
124 13F 0 0.04429 -0.04429 0.08181 -0.03747 -0.00139
125 13F+1 0.05277 -0.05010 0.10701 -0.03644 0.00423
126 13F-1 0.05010 -0.05277 0.10701 -0.03603 -0.00693
127 13F+2 0.10106 0.10106 0.00000 0.00134 -0.03617
128 13F-2 0.03453 -0.03453 -0.03453 0.00000 0.00000
129 13F+3 0.09690 0.06468 0.02687 -0.00300 -0.03689
130 13F-3 0.06468 0.09690 -0.02687 0.00573 -0.03657
131 14F 0 0.07220 -0.07220 0.18029 -0.38748 -0.01441
132 14F+1 -0.17399 -0.11040 -0.08557 -0.02343 0.26567
133 14F-1 0.11040 0.17399 -0.08557 -0.00364 -0.26668
134 14F+2 -0.16416 -0.16416 0.00000 -0.00571 0.15352
135 14F-2 0.11819 -0.11819 -0.11819 0.00000 0.00000
136 14F+3 -0.04345 0.14253 -0.15760 0.24270 -0.20956
137 14F-3 0.14253 -0.04345 0.15760 -0.22647 -0.22701
138 15G 0 -0.15411 0.15411 -0.07758 0.24497 0.00911
139 15G+1 0.04210 0.10545 -0.18017 0.16611 -0.09486
140 15G-1 -0.10545 -0.04210 -0.18017 0.15861 0.10694
141 15G+2 0.20723 0.20723 0.00000 0.01411 -0.37951
142 15G-2 -0.10567 0.10567 0.11907 -0.01754 -0.00065
143 15G+3 0.11138 -0.15282 -0.04486 -0.07156 0.01926
144 15G-3 -0.15282 0.11138 0.04486 0.06993 0.02452
145 15G+4 0.02641 -0.02641 0.24773 -0.28985 -0.01078
146 15G-4 -0.15267 -0.15267 0.00000 -0.00759 0.20425
147 3 H 1S -0.18213 0.18213 -0.18213 0.00000 0.00000
148 2S 0.34274 -0.34274 0.34274 0.00000 0.00000
149 3S 0.08762 -0.08762 0.08762 0.00000 0.00000
150 4S -0.41387 0.41387 -0.41387 0.00000 0.00000
151 5S -0.11519 0.11519 -0.11519 0.00000 0.00000
152 6PX 0.22218 0.13287 0.22218 -0.12845 0.20453
153 6PY -0.13287 -0.22218 0.22218 -0.11290 -0.21350
154 6PZ -0.22218 0.22218 0.13287 -0.24135 -0.00897
155 7PX -0.13324 -0.02505 -0.13324 0.08629 -0.13741
156 7PY 0.02505 0.13324 -0.13324 0.07585 0.14344
157 7PZ 0.13324 -0.13324 -0.02505 0.16215 0.00603
158 8PX 0.18778 -0.25346 0.18778 -0.24406 0.38863
159 8PY 0.25346 -0.18778 0.18778 -0.21453 -0.40568
160 8PZ -0.18778 0.18778 -0.25346 -0.45859 -0.01705
161 9PX -0.14674 0.04030 -0.14674 -0.08223 0.13094
162 9PY -0.04030 0.14674 -0.14674 -0.07228 -0.13668
163 9PZ 0.14674 -0.14674 0.04030 -0.15451 -0.00574
164 10D 0 0.11673 -0.11673 -0.23346 -0.08666 -0.00322
165 10D+1 -0.36396 -0.16794 0.16794 -0.19259 -0.36418
166 10D-1 0.16794 0.36396 0.16794 -0.21909 0.34887
167 10D+2 0.20218 0.20218 0.00000 0.00322 -0.08666
168 10D-2 -0.16794 0.16794 0.36396 -0.41168 -0.01531
169 11D 0 -0.04175 0.04175 0.08350 0.38932 0.01447
170 11D+1 0.31934 0.24643 -0.24643 0.23531 0.44498
171 11D-1 -0.24643 -0.31934 -0.24643 0.26771 -0.42628
172 11D+2 -0.07231 -0.07231 0.00000 -0.01447 0.38932
173 11D-2 0.24643 -0.24643 -0.31934 0.50302 0.01870
174 12D 0 0.04769 -0.04769 -0.09538 0.33348 0.01240
175 12D+1 0.03541 0.10091 -0.10091 -0.00204 -0.00385
176 12D-1 -0.10091 -0.03541 -0.10091 -0.00232 0.00369
177 12D+2 0.08260 0.08260 0.00000 -0.01240 0.33348
178 12D-2 0.10091 -0.10091 -0.03541 -0.00436 -0.00016
179 13F 0 -0.04429 0.04429 0.08181 -0.03747 -0.00139
180 13F+1 0.05277 -0.05010 -0.10701 0.03644 -0.00423
181 13F-1 0.05010 -0.05277 -0.10701 0.03603 0.00693
182 13F+2 -0.10106 -0.10106 0.00000 0.00134 -0.03617
183 13F-2 -0.03453 0.03453 -0.03453 0.00000 0.00000
184 13F+3 0.09690 0.06468 -0.02687 0.00300 0.03689
185 13F-3 0.06468 0.09690 0.02687 -0.00573 0.03657
186 14F 0 -0.07220 0.07220 0.18029 -0.38748 -0.01441
187 14F+1 -0.17399 -0.11040 0.08557 0.02343 -0.26567
188 14F-1 0.11040 0.17399 0.08557 0.00364 0.26668
189 14F+2 0.16416 0.16416 0.00000 -0.00571 0.15352
190 14F-2 -0.11819 0.11819 -0.11819 0.00000 0.00000
191 14F+3 -0.04345 0.14253 0.15760 -0.24270 0.20956
192 14F-3 0.14253 -0.04345 -0.15760 0.22647 0.22701
193 15G 0 0.15411 -0.15411 -0.07758 0.24497 0.00911
194 15G+1 0.04210 0.10545 0.18017 -0.16611 0.09486
195 15G-1 -0.10545 -0.04210 0.18017 -0.15861 -0.10694
196 15G+2 -0.20723 -0.20723 0.00000 0.01411 -0.37951
197 15G-2 0.10567 -0.10567 0.11907 -0.01754 -0.00065
198 15G+3 0.11138 -0.15282 0.04486 0.07156 -0.01926
199 15G-3 -0.15282 0.11138 -0.04486 -0.06993 -0.02452
200 15G+4 -0.02641 0.02641 0.24773 -0.28985 -0.01078
201 15G-4 0.15267 0.15267 0.00000 -0.00759 0.20425
202 4 H 1S -0.18213 -0.18213 0.18213 0.00000 0.00000
203 2S 0.34274 0.34274 -0.34274 0.00000 0.00000
204 3S 0.08762 0.08762 -0.08762 0.00000 0.00000
205 4S -0.41387 -0.41387 0.41387 0.00000 0.00000
206 5S -0.11519 -0.11519 0.11519 0.00000 0.00000
207 6PX -0.22218 0.13287 0.22218 0.12845 -0.20453
208 6PY -0.13287 0.22218 -0.22218 -0.11290 -0.21350
209 6PZ 0.22218 0.22218 0.13287 0.24135 0.00897
210 7PX 0.13324 -0.02505 -0.13324 -0.08629 0.13741
211 7PY 0.02505 -0.13324 0.13324 0.07585 0.14344
212 7PZ -0.13324 -0.13324 -0.02505 -0.16215 -0.00603
213 8PX -0.18778 -0.25346 0.18778 0.24406 -0.38863
214 8PY 0.25346 0.18778 -0.18778 -0.21453 -0.40568
215 8PZ 0.18778 0.18778 -0.25346 0.45859 0.01705
216 9PX 0.14674 0.04030 -0.14674 0.08223 -0.13094
217 9PY -0.04030 -0.14674 0.14674 -0.07228 -0.13668
218 9PZ -0.14674 -0.14674 0.04030 0.15451 0.00574
219 10D 0 0.11673 0.11673 0.23346 -0.08666 -0.00322
220 10D+1 -0.36396 0.16794 -0.16794 -0.19259 -0.36418
221 10D-1 -0.16794 0.36396 0.16794 0.21909 -0.34887
222 10D+2 0.20218 -0.20218 0.00000 0.00322 -0.08666
223 10D-2 0.16794 0.16794 0.36396 0.41168 0.01531
224 11D 0 -0.04175 -0.04175 -0.08350 0.38932 0.01447
225 11D+1 0.31934 -0.24643 0.24643 0.23531 0.44498
226 11D-1 0.24643 -0.31934 -0.24643 -0.26771 0.42628
227 11D+2 -0.07231 0.07231 0.00000 -0.01447 0.38932
228 11D-2 -0.24643 -0.24643 -0.31934 -0.50302 -0.01870
229 12D 0 0.04769 0.04769 0.09538 0.33348 0.01240
230 12D+1 0.03541 -0.10091 0.10091 -0.00204 -0.00385
231 12D-1 0.10091 -0.03541 -0.10091 0.00232 -0.00369
232 12D+2 0.08260 -0.08260 0.00000 -0.01240 0.33348
233 12D-2 -0.10091 -0.10091 -0.03541 0.00436 0.00016
234 13F 0 0.04429 0.04429 0.08181 0.03747 0.00139
235 13F+1 -0.05277 -0.05010 -0.10701 -0.03644 0.00423
236 13F-1 0.05010 0.05277 0.10701 0.03603 0.00693
237 13F+2 0.10106 -0.10106 0.00000 -0.00134 0.03617
238 13F-2 -0.03453 -0.03453 0.03453 0.00000 0.00000
239 13F+3 -0.09690 0.06468 -0.02687 -0.00300 -0.03689
240 13F-3 0.06468 -0.09690 -0.02687 -0.00573 0.03657
241 14F 0 0.07220 0.07220 0.18029 0.38748 0.01441
242 14F+1 0.17399 -0.11040 0.08557 -0.02343 0.26567
243 14F-1 0.11040 -0.17399 -0.08557 0.00364 0.26668
244 14F+2 -0.16416 0.16416 0.00000 0.00571 -0.15352
245 14F-2 -0.11819 -0.11819 0.11819 0.00000 0.00000
246 14F+3 0.04345 0.14253 0.15760 0.24270 -0.20956
247 14F-3 0.14253 0.04345 0.15760 0.22647 0.22701
248 15G 0 0.15411 0.15411 0.07758 0.24497 0.00911
249 15G+1 0.04210 -0.10545 -0.18017 -0.16611 0.09486
250 15G-1 0.10545 -0.04210 0.18017 0.15861 0.10694
251 15G+2 -0.20723 0.20723 0.00000 0.01411 -0.37951
252 15G-2 -0.10567 -0.10567 0.11907 0.01754 0.00065
253 15G+3 0.11138 0.15282 -0.04486 0.07156 -0.01926
254 15G-3 0.15282 0.11138 -0.04486 0.06993 0.02452
255 15G+4 -0.02641 -0.02641 -0.24773 -0.28985 -0.01078
256 15G-4 -0.15267 0.15267 0.00000 0.00759 -0.20425
257 5 H 1S 0.18213 0.18213 0.18213 0.00000 0.00000
258 2S -0.34274 -0.34274 -0.34274 0.00000 0.00000
259 3S -0.08762 -0.08762 -0.08762 0.00000 0.00000
260 4S 0.41387 0.41387 0.41387 0.00000 0.00000
261 5S 0.11519 0.11519 0.11519 0.00000 0.00000
262 6PX -0.22218 0.13287 -0.22218 -0.12845 0.20453
263 6PY -0.13287 0.22218 0.22218 0.11290 0.21350
264 6PZ -0.22218 -0.22218 0.13287 0.24135 0.00897
265 7PX 0.13324 -0.02505 0.13324 0.08629 -0.13741
266 7PY 0.02505 -0.13324 -0.13324 -0.07585 -0.14344
267 7PZ 0.13324 0.13324 -0.02505 -0.16215 -0.00603
268 8PX -0.18778 -0.25346 -0.18778 -0.24406 0.38863
269 8PY 0.25346 0.18778 0.18778 0.21453 0.40568
270 8PZ -0.18778 -0.18778 -0.25346 0.45859 0.01705
271 9PX 0.14674 0.04030 0.14674 -0.08223 0.13094
272 9PY -0.04030 -0.14674 -0.14674 0.07228 0.13668
273 9PZ 0.14674 0.14674 0.04030 0.15451 0.00574
274 10D 0 -0.11673 -0.11673 0.23346 -0.08666 -0.00322
275 10D+1 -0.36396 0.16794 0.16794 0.19259 0.36418
276 10D-1 -0.16794 0.36396 -0.16794 -0.21909 0.34887
277 10D+2 -0.20218 0.20218 0.00000 0.00322 -0.08666
278 10D-2 -0.16794 -0.16794 0.36396 0.41168 0.01531
279 11D 0 0.04175 0.04175 -0.08350 0.38932 0.01447
280 11D+1 0.31934 -0.24643 -0.24643 -0.23531 -0.44498
281 11D-1 0.24643 -0.31934 0.24643 0.26771 -0.42628
282 11D+2 0.07231 -0.07231 0.00000 -0.01447 0.38932
283 11D-2 0.24643 0.24643 -0.31934 -0.50302 -0.01870
284 12D 0 -0.04769 -0.04769 0.09538 0.33348 0.01240
285 12D+1 0.03541 -0.10091 -0.10091 0.00204 0.00385
286 12D-1 0.10091 -0.03541 0.10091 -0.00232 0.00369
287 12D+2 -0.08260 0.08260 0.00000 -0.01240 0.33348
288 12D-2 0.10091 0.10091 -0.03541 0.00436 0.00016
289 13F 0 -0.04429 -0.04429 0.08181 0.03747 0.00139
290 13F+1 -0.05277 -0.05010 0.10701 0.03644 -0.00423
291 13F-1 0.05010 0.05277 -0.10701 -0.03603 -0.00693
292 13F+2 -0.10106 0.10106 0.00000 -0.00134 0.03617
293 13F-2 0.03453 0.03453 0.03453 0.00000 0.00000
294 13F+3 -0.09690 0.06468 0.02687 0.00300 0.03689
295 13F-3 0.06468 -0.09690 0.02687 0.00573 -0.03657
296 14F 0 -0.07220 -0.07220 0.18029 0.38748 0.01441
297 14F+1 0.17399 -0.11040 -0.08557 0.02343 -0.26567
298 14F-1 0.11040 -0.17399 0.08557 -0.00364 -0.26668
299 14F+2 0.16416 -0.16416 0.00000 0.00571 -0.15352
300 14F-2 0.11819 0.11819 0.11819 0.00000 0.00000
301 14F+3 0.04345 0.14253 -0.15760 -0.24270 0.20956
302 14F-3 0.14253 0.04345 -0.15760 -0.22647 -0.22701
303 15G 0 -0.15411 -0.15411 0.07758 0.24497 0.00911
304 15G+1 0.04210 -0.10545 0.18017 0.16611 -0.09486
305 15G-1 0.10545 -0.04210 -0.18017 -0.15861 -0.10694
306 15G+2 0.20723 -0.20723 0.00000 0.01411 -0.37951
307 15G-2 0.10567 0.10567 0.11907 0.01754 0.00065
308 15G+3 0.11138 0.15282 0.04486 -0.07156 0.01926
309 15G-3 0.15282 0.11138 0.04486 -0.06993 -0.02452
310 15G+4 0.02641 0.02641 -0.24773 -0.28985 -0.01078
311 15G-4 0.15267 -0.15267 0.00000 0.00759 -0.20425
281 282 283 284 285
(T1)--V (T1)--V (T1)--V (T2)--V (T2)--V
Eigenvalues -- 16.61415 16.61415 16.61415 16.91564 16.91564
1 1 C 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 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 -0.12249 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.12249
10 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
11 8PY 0.00000 0.00000 0.00000 -1.62906 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 -1.62906
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
14 9PY 0.00000 0.00000 0.00000 19.32994 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 19.32994
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
17 10PY 0.00000 0.00000 0.00000 4.96099 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 4.96099
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
20 11PY 0.00000 0.00000 0.00000 -0.06248 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.06248
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 -0.99357 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 -0.99357
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 1.95384 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 1.95384
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 10.63227 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 10.63227
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 0.00000 1.65652 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 1.65652
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.01566
43 16F+1 -0.02094 0.00000 0.00000 0.00000 0.00000
44 16F-1 0.00000 -0.02094 0.00000 -0.00959 0.00000
45 16F+2 0.00000 0.00000 -0.02649 0.00000 0.00000
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 -0.01622 0.00000 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.01622 0.00000 -0.01238 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 -1.84792
50 17F+1 0.85883 0.00000 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.85883 0.00000 1.13161 0.00000
52 17F+2 0.00000 0.00000 1.08635 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 0.66525 0.00000 0.00000 0.00000 0.00000
55 17F-3 0.00000 -0.66525 0.00000 1.46091 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 -1.25431
57 18F+1 -0.38206 0.00000 0.00000 0.00000 0.00000
58 18F-1 0.00000 -0.38206 0.00000 0.76810 0.00000
59 18F+2 0.00000 0.00000 -0.48327 0.00000 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 -0.29594 0.00000 0.00000 0.00000 0.00000
62 18F-3 0.00000 0.29594 0.00000 0.99162 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 -0.21036 0.00000 -0.08246 0.00000
65 19G-1 -0.21036 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 0.23322
68 19G+3 0.00000 0.07951 0.00000 -0.21816 0.00000
69 19G-3 -0.07951 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 -0.22488 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.00000 0.00000 0.00000
73 20G+1 0.00000 -0.61078 0.00000 -0.39186 0.00000
74 20G-1 -0.61078 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 1.10836
77 20G+3 0.00000 0.23085 0.00000 -1.03677 0.00000
78 20G-3 -0.23085 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 -0.65295 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 0.02753
82 21H+1 -0.78839 0.00000 0.00000 0.00000 0.00000
83 21H-1 0.00000 -0.78839 0.00000 -0.49208 0.00000
84 21H+2 0.00000 0.00000 1.19193 0.00000 0.00000
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 0.36495 0.00000 0.00000 0.00000 0.00000
87 21H-3 0.00000 -0.36495 0.00000 0.71627 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 -0.88231
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.81606 0.00000 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.81606 0.00000 -0.15507 0.00000
92 2 H 1S 0.00000 0.00000 0.00000 0.45064 0.45064
93 2S 0.00000 0.00000 0.00000 -0.70784 -0.70784
94 3S 0.00000 0.00000 0.00000 -10.39945 -10.39945
95 4S 0.00000 0.00000 0.00000 -3.28780 -3.28780
96 5S 0.00000 0.00000 0.00000 0.15374 0.15374
97 6PX 0.00000 -0.13703 0.13703 0.31005 0.31005
98 6PY -0.13703 0.00000 -0.13703 0.33485 0.31005
99 6PZ 0.13703 0.13703 0.00000 0.31005 0.33485
100 7PX 0.00000 0.10207 -0.10207 -0.23094 -0.23094
101 7PY 0.10207 0.00000 0.10207 -0.27010 -0.23094
102 7PZ -0.10207 -0.10207 0.00000 -0.23094 -0.27010
103 8PX 0.00000 -0.02481 0.02481 3.50074 3.50074
104 8PY -0.02481 0.00000 -0.02481 3.62449 3.50074
105 8PZ 0.02481 0.02481 0.00000 3.50074 3.62449
106 9PX 0.00000 -0.05056 0.05056 1.02019 1.02019
107 9PY -0.05056 0.00000 -0.05056 1.19977 1.02019
108 9PZ 0.05056 0.05056 0.00000 1.02019 1.19977
109 10D 0 -0.28887 -0.28887 0.00000 -0.01904 0.03807
110 10D+1 0.03214 0.00000 0.03214 0.07295 -0.06473
111 10D-1 0.00000 0.03214 -0.03214 -0.06473 -0.06473
112 10D+2 -0.16678 0.16678 -0.33356 -0.03297 0.00000
113 10D-2 -0.03214 -0.03214 0.00000 -0.06473 0.07295
114 11D 0 0.55016 0.55016 0.00000 0.08616 -0.17231
115 11D+1 -0.20515 0.00000 -0.20515 -0.70493 -0.50307
116 11D-1 0.00000 -0.20515 0.20515 -0.50307 -0.50307
117 11D+2 0.31763 -0.31763 0.63527 0.14922 0.00000
118 11D-2 0.20515 0.20515 0.00000 -0.50307 -0.70493
119 12D 0 0.02162 0.02162 0.00000 0.05756 -0.11511
120 12D+1 0.00419 0.00000 0.00419 -0.69016 -0.67779
121 12D-1 0.00000 0.00419 -0.00419 -0.67779 -0.67779
122 12D+2 0.01248 -0.01248 0.02497 0.09969 0.00000
123 12D-2 -0.00419 -0.00419 0.00000 -0.67779 -0.69016
124 13F 0 -0.20324 -0.20324 0.00000 -0.14459 -0.04636
125 13F+1 0.13099 -0.10355 0.14537 0.05328 0.12380
126 13F-1 -0.10355 0.13099 -0.14537 0.02839 0.12380
127 13F+2 0.02645 -0.02645 0.16569 -0.04460 0.00000
128 13F-2 0.00000 0.00000 0.00000 0.20117 0.20117
129 13F+3 0.10146 0.17687 -0.14448 -0.14162 -0.08700
130 13F-3 -0.17687 -0.10146 -0.14448 0.03665 0.08700
131 14F 0 -0.25658 -0.25658 0.00000 -0.17193 0.09073
132 14F+1 -0.03593 -0.18315 0.13110 0.11495 0.09563
133 14F-1 -0.18315 -0.03593 -0.13110 -0.05556 0.09563
134 14F+2 -0.03292 0.03292 -0.04545 0.01222 0.00000
135 14F-2 0.00000 0.00000 0.00000 0.11184 0.11184
136 14F+3 -0.02783 0.18269 -0.22301 -0.12844 -0.14341
137 14F-3 -0.18269 0.02783 -0.22301 -0.07173 0.14341
138 15G 0 0.21431 0.21431 0.00000 0.11996 0.05025
139 15G+1 0.04992 0.36847 -0.05294 0.02508 -0.12834
140 15G-1 0.36847 0.04992 0.05294 0.13664 -0.12834
141 15G+2 -0.19168 0.19168 -0.38336 -0.06235 0.00000
142 15G-2 -0.00427 -0.00427 0.00000 -0.01175 -0.07093
143 15G+3 -0.02344 -0.13927 0.01544 0.06635 0.06106
144 15G-3 0.13927 0.02344 0.01544 0.03909 -0.06106
145 15G+4 -0.25357 -0.25357 0.00000 0.05425 0.13673
146 15G-4 0.05498 -0.05498 0.39391 0.14164 0.00000
147 3 H 1S 0.00000 0.00000 0.00000 -0.45064 0.45064
148 2S 0.00000 0.00000 0.00000 0.70784 -0.70784
149 3S 0.00000 0.00000 0.00000 10.39945 -10.39945
150 4S 0.00000 0.00000 0.00000 3.28780 -3.28780
151 5S 0.00000 0.00000 0.00000 -0.15374 0.15374
152 6PX 0.00000 -0.13703 -0.13703 0.31005 -0.31005
153 6PY -0.13703 0.00000 0.13703 0.33485 -0.31005
154 6PZ -0.13703 -0.13703 0.00000 -0.31005 0.33485
155 7PX 0.00000 0.10207 0.10207 -0.23094 0.23094
156 7PY 0.10207 0.00000 -0.10207 -0.27010 0.23094
157 7PZ 0.10207 0.10207 0.00000 0.23094 -0.27010
158 8PX 0.00000 -0.02481 -0.02481 3.50074 -3.50074
159 8PY -0.02481 0.00000 0.02481 3.62449 -3.50074
160 8PZ -0.02481 -0.02481 0.00000 -3.50074 3.62449
161 9PX 0.00000 -0.05056 -0.05056 1.02019 -1.02019
162 9PY -0.05056 0.00000 0.05056 1.19977 -1.02019
163 9PZ -0.05056 -0.05056 0.00000 -1.02019 1.19977
164 10D 0 0.28887 0.28887 0.00000 0.01904 0.03807
165 10D+1 0.03214 0.00000 -0.03214 0.07295 0.06473
166 10D-1 0.00000 0.03214 0.03214 -0.06473 0.06473
167 10D+2 0.16678 -0.16678 -0.33356 0.03297 0.00000
168 10D-2 0.03214 0.03214 0.00000 0.06473 0.07295
169 11D 0 -0.55016 -0.55016 0.00000 -0.08616 -0.17231
170 11D+1 -0.20515 0.00000 0.20515 -0.70493 0.50307
171 11D-1 0.00000 -0.20515 -0.20515 -0.50307 0.50307
172 11D+2 -0.31763 0.31763 0.63527 -0.14922 0.00000
173 11D-2 -0.20515 -0.20515 0.00000 0.50307 -0.70493
174 12D 0 -0.02162 -0.02162 0.00000 -0.05756 -0.11511
175 12D+1 0.00419 0.00000 -0.00419 -0.69016 0.67779
176 12D-1 0.00000 0.00419 0.00419 -0.67779 0.67779
177 12D+2 -0.01248 0.01248 0.02497 -0.09969 0.00000
178 12D-2 0.00419 0.00419 0.00000 0.67779 -0.69016
179 13F 0 0.20324 0.20324 0.00000 0.14459 -0.04636
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182 13F+2 -0.02645 0.02645 0.16569 0.04460 0.00000
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186 14F 0 0.25658 0.25658 0.00000 0.17193 0.09073
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188 14F-1 -0.18315 -0.03593 0.13110 -0.05556 -0.09563
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190 14F-2 0.00000 0.00000 0.00000 -0.11184 0.11184
191 14F+3 -0.02783 0.18269 0.22301 -0.12844 0.14341
192 14F-3 -0.18269 0.02783 0.22301 -0.07173 -0.14341
193 15G 0 -0.21431 -0.21431 0.00000 -0.11996 0.05025
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196 15G+2 0.19168 -0.19168 -0.38336 0.06235 0.00000
197 15G-2 0.00427 0.00427 0.00000 0.01175 -0.07093
198 15G+3 -0.02344 -0.13927 -0.01544 0.06635 -0.06106
199 15G-3 0.13927 0.02344 -0.01544 0.03909 0.06106
200 15G+4 0.25357 0.25357 0.00000 -0.05425 0.13673
201 15G-4 -0.05498 0.05498 0.39391 -0.14164 0.00000
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204 3S 0.00000 0.00000 0.00000 10.39945 10.39945
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236 13F-1 0.10355 0.13099 -0.14537 0.02839 0.12380
237 13F+2 -0.02645 -0.02645 0.16569 -0.04460 0.00000
238 13F-2 0.00000 0.00000 0.00000 -0.20117 -0.20117
239 13F+3 0.10146 -0.17687 0.14448 0.14162 0.08700
240 13F-3 0.17687 -0.10146 -0.14448 0.03665 0.08700
241 14F 0 0.25658 -0.25658 0.00000 -0.17193 0.09073
242 14F+1 -0.03593 0.18315 -0.13110 -0.11495 -0.09563
243 14F-1 0.18315 -0.03593 -0.13110 -0.05556 0.09563
244 14F+2 0.03292 0.03292 -0.04545 0.01222 0.00000
245 14F-2 0.00000 0.00000 0.00000 -0.11184 -0.11184
246 14F+3 -0.02783 -0.18269 0.22301 0.12844 0.14341
247 14F-3 0.18269 0.02783 -0.22301 -0.07173 0.14341
248 15G 0 0.21431 -0.21431 0.00000 -0.11996 -0.05025
249 15G+1 -0.04992 0.36847 -0.05294 0.02508 -0.12834
250 15G-1 0.36847 -0.04992 -0.05294 -0.13664 0.12834
251 15G+2 -0.19168 -0.19168 0.38336 0.06235 0.00000
252 15G-2 0.00427 -0.00427 0.00000 -0.01175 -0.07093
253 15G+3 0.02344 -0.13927 0.01544 0.06635 0.06106
254 15G-3 0.13927 -0.02344 -0.01544 -0.03909 0.06106
255 15G+4 -0.25357 0.25357 0.00000 -0.05425 -0.13673
256 15G-4 -0.05498 -0.05498 0.39391 0.14164 0.00000
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258 2S 0.00000 0.00000 0.00000 -0.70784 0.70784
259 3S 0.00000 0.00000 0.00000 -10.39945 10.39945
260 4S 0.00000 0.00000 0.00000 -3.28780 3.28780
261 5S 0.00000 0.00000 0.00000 0.15374 -0.15374
262 6PX 0.00000 0.13703 0.13703 -0.31005 0.31005
263 6PY 0.13703 0.00000 0.13703 0.33485 -0.31005
264 6PZ 0.13703 -0.13703 0.00000 -0.31005 0.33485
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266 7PY -0.10207 0.00000 -0.10207 -0.27010 0.23094
267 7PZ -0.10207 0.10207 0.00000 0.23094 -0.27010
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269 8PY 0.02481 0.00000 0.02481 3.62449 -3.50074
270 8PZ 0.02481 -0.02481 0.00000 -3.50074 3.62449
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273 9PZ 0.05056 -0.05056 0.00000 -1.02019 1.19977
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278 10D-2 -0.03214 0.03214 0.00000 0.06473 0.07295
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283 11D-2 0.20515 -0.20515 0.00000 0.50307 -0.70493
284 12D 0 -0.02162 0.02162 0.00000 0.05756 0.11511
285 12D+1 -0.00419 0.00000 -0.00419 -0.69016 0.67779
286 12D-1 0.00000 -0.00419 -0.00419 0.67779 -0.67779
287 12D+2 -0.01248 -0.01248 -0.02497 0.09969 0.00000
288 12D-2 -0.00419 0.00419 0.00000 0.67779 -0.69016
289 13F 0 -0.20324 0.20324 0.00000 0.14459 -0.04636
290 13F+1 0.13099 0.10355 0.14537 -0.05328 0.12380
291 13F-1 0.10355 0.13099 0.14537 0.02839 -0.12380
292 13F+2 0.02645 0.02645 0.16569 0.04460 0.00000
293 13F-2 0.00000 0.00000 0.00000 0.20117 -0.20117
294 13F+3 0.10146 -0.17687 -0.14448 0.14162 -0.08700
295 13F-3 0.17687 -0.10146 0.14448 0.03665 -0.08700
296 14F 0 -0.25658 0.25658 0.00000 0.17193 0.09073
297 14F+1 -0.03593 0.18315 0.13110 -0.11495 0.09563
298 14F-1 0.18315 -0.03593 0.13110 -0.05556 -0.09563
299 14F+2 -0.03292 -0.03292 -0.04545 -0.01222 0.00000
300 14F-2 0.00000 0.00000 0.00000 0.11184 -0.11184
301 14F+3 -0.02783 -0.18269 -0.22301 0.12844 -0.14341
302 14F-3 0.18269 0.02783 0.22301 -0.07173 -0.14341
303 15G 0 -0.21431 0.21431 0.00000 0.11996 -0.05025
304 15G+1 -0.04992 0.36847 0.05294 0.02508 0.12834
305 15G-1 0.36847 -0.04992 0.05294 -0.13664 -0.12834
306 15G+2 0.19168 0.19168 0.38336 -0.06235 0.00000
307 15G-2 -0.00427 0.00427 0.00000 0.01175 -0.07093
308 15G+3 0.02344 -0.13927 -0.01544 0.06635 -0.06106
309 15G-3 0.13927 -0.02344 0.01544 -0.03909 -0.06106
310 15G+4 0.25357 -0.25357 0.00000 0.05425 -0.13673
311 15G-4 0.05498 0.05498 0.39391 -0.14164 0.00000
286 287 288 289 290
(T2)--V (T1)--V (T1)--V (T1)--V (T2)--V
Eigenvalues -- 16.91564 17.44018 17.44018 17.44018 17.89366
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13 9PX 19.32994 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 17.42661
16 10PX 4.96099 0.00000 0.00000 0.00000 0.00000
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29 13D-1 1.95384 0.00000 0.00000 0.00000 0.00000
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36 14D-2 0.00000 0.00000 0.00000 0.00000 -1.24503
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38 15D+1 0.00000 0.00000 0.00000 0.00000 0.00000
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46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 0.01238 0.11768 0.00000 0.00000 0.00000
48 16F-3 0.00000 0.00000 0.00000 -0.11768 0.00000
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50 17F+1 1.13161 2.39740 0.00000 0.00000 0.00000
51 17F-1 0.00000 0.00000 0.00000 2.39740 0.00000
52 17F+2 0.00000 0.00000 3.03250 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 -1.46091 1.85702 0.00000 0.00000 0.00000
55 17F-3 0.00000 0.00000 0.00000 -1.85702 0.00000
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57 18F+1 0.76810 1.29590 0.00000 0.00000 0.00000
58 18F-1 0.00000 0.00000 0.00000 1.29590 0.00000
59 18F+2 0.00000 0.00000 1.63920 0.00000 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 -0.99162 1.00380 0.00000 0.00000 0.00000
62 18F-3 0.00000 0.00000 0.00000 -1.00380 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
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65 19G-1 -0.08246 0.63083 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 0.74565
68 19G+3 0.00000 0.00000 0.00000 -0.23843 0.00000
69 19G-3 0.21816 0.23843 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 0.67439 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 0.47754 0.00000
74 20G-1 -0.39186 0.47754 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 1.99448
77 20G+3 0.00000 0.00000 0.00000 -0.18049 0.00000
78 20G-3 1.03677 0.18049 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 0.51052 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 -0.39492
82 21H+1 -0.49208 -0.03838 0.00000 0.00000 0.00000
83 21H-1 0.00000 0.00000 0.00000 -0.03838 0.00000
84 21H+2 0.00000 0.00000 0.05802 0.00000 0.00000
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 -0.71627 0.01776 0.00000 0.00000 0.00000
87 21H-3 0.00000 0.00000 0.00000 -0.01776 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 -0.05978
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 -0.15507 0.03972 0.00000 0.00000 0.00000
91 21H-5 0.00000 0.00000 0.00000 0.03972 0.00000
92 2 H 1S 0.45064 0.00000 0.00000 0.00000 0.06527
93 2S -0.70784 0.00000 0.00000 0.00000 -0.04707
94 3S -10.39945 0.00000 0.00000 0.00000 -3.89051
95 4S -3.28780 0.00000 0.00000 0.00000 -2.24745
96 5S 0.15374 0.00000 0.00000 0.00000 0.09883
97 6PX 0.33485 0.00000 -0.45164 0.45164 0.28129
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99 6PZ 0.31005 -0.45164 0.00000 -0.45164 -0.51134
100 7PX -0.27010 0.00000 0.75656 -0.75656 -0.52471
101 7PY -0.23094 -0.75656 -0.75656 0.00000 -0.52471
102 7PZ -0.23094 0.75656 0.00000 0.75656 1.00049
103 8PX 3.62449 0.00000 -1.90011 1.90011 2.96930
104 8PY 3.50074 1.90011 1.90011 0.00000 2.96930
105 8PZ 3.50074 -1.90011 0.00000 -1.90011 -2.08200
106 9PX 1.19977 0.00000 -0.46552 0.46552 1.09469
107 9PY 1.02019 0.46552 0.46552 0.00000 1.09469
108 9PZ 1.02019 -0.46552 0.00000 -0.46552 -0.28365
109 10D 0 -0.01904 -0.30848 0.00000 -0.30848 -0.51190
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115 11D+1 -0.50307 0.42249 0.42249 0.00000 0.19711
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117 11D+2 -0.14922 0.46250 0.92499 -0.46250 0.00000
118 11D-2 -0.50307 -0.42249 0.00000 -0.42249 -1.01909
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120 12D+1 -0.67779 0.46939 0.46939 0.00000 0.36081
121 12D-1 -0.69016 0.00000 -0.46939 0.46939 0.36081
122 12D+2 -0.09969 0.56038 1.12075 -0.56038 0.00000
123 12D-2 -0.67779 -0.46939 0.00000 -0.46939 -1.30388
124 13F 0 -0.14459 -0.04950 0.00000 -0.04950 -0.10162
125 13F+1 0.02839 -0.06247 -0.03274 -0.09336 -0.05762
126 13F-1 0.05328 -0.09336 0.03274 -0.06247 -0.05762
127 13F+2 0.04460 -0.07975 -0.07901 0.07975 0.00000
128 13F-2 0.20117 0.00000 0.00000 0.00000 0.08427
129 13F+3 -0.03665 -0.04839 -0.08797 -0.00970 -0.06115
130 13F-3 0.14162 0.00970 -0.08797 0.04839 0.06115
131 14F 0 -0.17193 -0.27909 0.00000 -0.27909 -0.23994
132 14F+1 -0.05556 -0.52206 -0.03389 -0.37570 -0.63087
133 14F-1 0.11495 -0.37570 0.03389 -0.52206 -0.63087
134 14F+2 -0.01222 -0.25904 -0.66036 0.25904 0.00000
135 14F-2 0.11184 0.00000 0.00000 0.00000 -0.08175
136 14F+3 0.07173 -0.40439 -0.37927 0.06201 -0.36740
137 14F-3 0.12844 -0.06201 -0.37927 0.40439 0.36740
138 15G 0 0.11996 -0.09842 0.00000 -0.09842 -0.08693
139 15G+1 0.13664 0.20921 -0.05093 0.22310 0.17970
140 15G-1 0.02508 0.22310 0.05093 0.20921 0.17970
141 15G+2 0.06235 0.08803 0.17605 -0.08803 0.00000
142 15G-2 -0.01175 0.22385 0.00000 0.22385 0.22561
143 15G+3 -0.03909 0.16023 0.25855 -0.08432 0.04487
144 15G-3 -0.06635 0.08432 0.25855 -0.16023 -0.04487
145 15G+4 0.05425 0.11645 0.00000 0.11645 0.21050
146 15G-4 -0.14164 0.13905 0.23850 -0.13905 0.00000
147 3 H 1S -0.45064 0.00000 0.00000 0.00000 0.06527
148 2S 0.70784 0.00000 0.00000 0.00000 -0.04707
149 3S 10.39945 0.00000 0.00000 0.00000 -3.89051
150 4S 3.28780 0.00000 0.00000 0.00000 -2.24745
151 5S -0.15374 0.00000 0.00000 0.00000 0.09883
152 6PX 0.33485 0.00000 0.45164 0.45164 -0.28129
153 6PY 0.31005 0.45164 -0.45164 0.00000 -0.28129
154 6PZ -0.31005 0.45164 0.00000 0.45164 -0.51134
155 7PX -0.27010 0.00000 -0.75656 -0.75656 0.52471
156 7PY -0.23094 -0.75656 0.75656 0.00000 0.52471
157 7PZ 0.23094 -0.75656 0.00000 -0.75656 1.00049
158 8PX 3.62449 0.00000 1.90011 1.90011 -2.96930
159 8PY 3.50074 1.90011 -1.90011 0.00000 -2.96930
160 8PZ -3.50074 1.90011 0.00000 1.90011 -2.08200
161 9PX 1.19977 0.00000 0.46552 0.46552 -1.09469
162 9PY 1.02019 0.46552 -0.46552 0.00000 -1.09469
163 9PZ -1.02019 0.46552 0.00000 0.46552 -0.28365
164 10D 0 0.01904 0.30848 0.00000 0.30848 -0.51190
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166 10D-1 0.07295 0.00000 -0.15913 -0.15913 0.14175
167 10D+2 -0.03297 0.17810 -0.35620 -0.17810 0.00000
168 10D-2 0.06473 -0.15913 0.00000 -0.15913 0.34316
169 11D 0 -0.08616 -0.80107 0.00000 -0.80107 1.33330
170 11D+1 -0.50307 0.42249 -0.42249 0.00000 -0.19711
171 11D-1 -0.70493 0.00000 0.42249 0.42249 -0.19711
172 11D+2 0.14922 -0.46250 0.92499 0.46250 0.00000
173 11D-2 0.50307 0.42249 0.00000 0.42249 -1.01909
174 12D 0 -0.05756 -0.97060 0.00000 -0.97060 1.40317
175 12D+1 -0.67779 0.46939 -0.46939 0.00000 -0.36081
176 12D-1 -0.69016 0.00000 0.46939 0.46939 -0.36081
177 12D+2 0.09969 -0.56038 1.12075 0.56038 0.00000
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179 13F 0 0.14459 0.04950 0.00000 0.04950 -0.10162
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181 13F-1 0.05328 -0.09336 -0.03274 -0.06247 0.05762
182 13F+2 -0.04460 0.07975 -0.07901 -0.07975 0.00000
183 13F-2 -0.20117 0.00000 0.00000 0.00000 0.08427
184 13F+3 -0.03665 -0.04839 0.08797 -0.00970 0.06115
185 13F-3 0.14162 0.00970 0.08797 0.04839 -0.06115
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190 14F-2 -0.11184 0.00000 0.00000 0.00000 -0.08175
191 14F+3 0.07173 -0.40439 0.37927 0.06201 0.36740
192 14F-3 0.12844 -0.06201 0.37927 0.40439 -0.36740
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196 15G+2 -0.06235 -0.08803 0.17605 0.08803 0.00000
197 15G-2 0.01175 -0.22385 0.00000 -0.22385 0.22561
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199 15G-3 -0.06635 0.08432 -0.25855 -0.16023 0.04487
200 15G+4 -0.05425 -0.11645 0.00000 -0.11645 0.21050
201 15G-4 0.14164 -0.13905 0.23850 0.13905 0.00000
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237 13F+2 -0.04460 0.07975 -0.07901 0.07975 0.00000
238 13F-2 0.20117 0.00000 0.00000 0.00000 -0.08427
239 13F+3 -0.03665 -0.04839 0.08797 0.00970 0.06115
240 13F-3 -0.14162 -0.00970 -0.08797 0.04839 0.06115
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243 14F-1 -0.11495 0.37570 0.03389 -0.52206 -0.63087
244 14F+2 0.01222 0.25904 -0.66036 0.25904 0.00000
245 14F-2 0.11184 0.00000 0.00000 0.00000 0.08175
246 14F+3 0.07173 -0.40439 0.37927 -0.06201 0.36740
247 14F-3 -0.12844 0.06201 -0.37927 0.40439 0.36740
248 15G 0 0.11996 -0.09842 0.00000 0.09842 0.08693
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250 15G-1 0.02508 0.22310 -0.05093 -0.20921 -0.17970
251 15G+2 0.06235 0.08803 -0.17605 0.08803 0.00000
252 15G-2 0.01175 -0.22385 0.00000 0.22385 0.22561
253 15G+3 0.03909 -0.16023 0.25855 -0.08432 0.04487
254 15G-3 -0.06635 0.08432 -0.25855 0.16023 0.04487
255 15G+4 0.05425 0.11645 0.00000 -0.11645 -0.21050
256 15G-4 0.14164 -0.13905 0.23850 -0.13905 0.00000
257 5 H 1S -0.45064 0.00000 0.00000 0.00000 -0.06527
258 2S 0.70784 0.00000 0.00000 0.00000 0.04707
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260 4S 3.28780 0.00000 0.00000 0.00000 2.24745
261 5S -0.15374 0.00000 0.00000 0.00000 -0.09883
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265 7PX -0.27010 0.00000 0.75656 0.75656 -0.52471
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267 7PZ -0.23094 0.75656 0.00000 -0.75656 1.00049
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270 8PZ 3.50074 -1.90011 0.00000 1.90011 -2.08200
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284 12D 0 -0.05756 -0.97060 0.00000 0.97060 -1.40317
285 12D+1 0.67779 -0.46939 -0.46939 0.00000 -0.36081
286 12D-1 -0.69016 0.00000 -0.46939 -0.46939 0.36081
287 12D+2 0.09969 -0.56038 -1.12075 -0.56038 0.00000
288 12D-2 -0.67779 -0.46939 0.00000 0.46939 -1.30388
289 13F 0 -0.14459 -0.04950 0.00000 0.04950 -0.10162
290 13F+1 0.02839 -0.06247 -0.03274 0.09336 -0.05762
291 13F-1 -0.05328 0.09336 -0.03274 -0.06247 0.05762
292 13F+2 0.04460 -0.07975 -0.07901 -0.07975 0.00000
293 13F-2 -0.20117 0.00000 0.00000 0.00000 -0.08427
294 13F+3 -0.03665 -0.04839 -0.08797 0.00970 -0.06115
295 13F-3 -0.14162 -0.00970 0.08797 0.04839 -0.06115
296 14F 0 -0.17193 -0.27909 0.00000 0.27909 -0.23994
297 14F+1 -0.05556 -0.52206 -0.03389 0.37570 -0.63087
298 14F-1 -0.11495 0.37570 -0.03389 -0.52206 0.63087
299 14F+2 -0.01222 -0.25904 -0.66036 -0.25904 0.00000
300 14F-2 -0.11184 0.00000 0.00000 0.00000 0.08175
301 14F+3 0.07173 -0.40439 -0.37927 -0.06201 -0.36740
302 14F-3 -0.12844 0.06201 0.37927 0.40439 -0.36740
303 15G 0 -0.11996 0.09842 0.00000 -0.09842 0.08693
304 15G+1 -0.13664 -0.20921 0.05093 0.22310 -0.17970
305 15G-1 0.02508 0.22310 0.05093 -0.20921 0.17970
306 15G+2 -0.06235 -0.08803 -0.17605 -0.08803 0.00000
307 15G-2 -0.01175 0.22385 0.00000 -0.22385 0.22561
308 15G+3 0.03909 -0.16023 -0.25855 -0.08432 -0.04487
309 15G-3 -0.06635 0.08432 0.25855 0.16023 -0.04487
310 15G+4 -0.05425 -0.11645 0.00000 0.11645 -0.21050
311 15G-4 -0.14164 0.13905 0.23850 0.13905 0.00000
291 292 293 294 295
(T2)--V (T2)--V (E)--V (E)--V (T2)--V
Eigenvalues -- 17.89366 17.89366 17.98079 17.98079 18.37787
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12 8PZ 0.00000 0.00000 0.00000 0.00000 1.03628
13 9PX 17.42661 0.00000 0.00000 0.00000 0.00000
14 9PY 0.00000 17.42661 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 10.36737
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26 12D-2 0.00000 0.00000 0.00000 0.00000 0.50284
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29 13D-1 -0.64829 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00000 1.69357 1.52598 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.05656
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33 14D+1 0.00000 -1.24503 0.00000 0.00000 0.00000
34 14D-1 -1.24503 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.00000 6.98401 6.29289 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.68987
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39 15D-1 0.04668 0.00000 0.00000 0.00000 0.00000
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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 1.16140 0.00000 0.00000 0.00000 0.00000
55 17F-3 0.00000 -1.16140 0.00000 0.00000 0.00000
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57 18F+1 -0.90242 0.00000 0.00000 0.00000 0.00000
58 18F-1 0.00000 -0.90242 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 1.16501 0.00000 0.00000 0.00000 0.00000
62 18F-3 0.00000 -1.16501 0.00000 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.31124 -0.34542 0.00000
64 19G+1 0.00000 -0.26363 0.00000 0.00000 0.00000
65 19G-1 -0.26363 0.00000 0.00000 0.00000 0.00000
66 19G+2 0.00000 0.00000 0.53512 0.48217 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.90667
68 19G+3 0.00000 -0.69749 0.00000 0.00000 0.00000
69 19G-3 0.69749 0.00000 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 -0.36826 0.40870 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.31996 -0.35510 0.00000
73 20G+1 0.00000 -0.70515 0.00000 0.00000 0.00000
74 20G-1 -0.70515 0.00000 0.00000 0.00000 0.00000
75 20G+2 0.00000 0.00000 0.55013 0.49569 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.00000 1.44342
77 20G+3 0.00000 -1.86566 0.00000 0.00000 0.00000
78 20G-3 1.86566 0.00000 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 -0.37859 0.42017 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 -0.86744
82 21H+1 -0.22543 0.00000 0.00000 0.00000 0.00000
83 21H-1 0.00000 -0.22543 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 -0.58670 0.65113 0.00000
86 21H+3 0.15895 0.00000 0.00000 0.00000 0.00000
87 21H-3 0.00000 -0.15895 0.00000 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.14846
89 21H-4 0.00000 0.00000 0.65113 0.58670 0.00000
90 21H+5 -0.28887 0.00000 0.00000 0.00000 0.00000
91 21H-5 0.00000 -0.28887 0.00000 0.00000 0.00000
92 2 H 1S 0.06527 0.06527 0.00000 0.00000 0.01250
93 2S -0.04707 -0.04707 0.00000 0.00000 0.33455
94 3S -3.89051 -3.89051 0.00000 0.00000 -4.10960
95 4S -2.24745 -2.24745 0.00000 0.00000 -1.54081
96 5S 0.09883 0.09883 0.00000 0.00000 -0.15962
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99 6PZ 0.28129 0.28129 0.19692 -0.21855 0.59526
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101 7PY -0.52471 1.00049 -0.21709 -0.66895 0.10856
102 7PZ -0.52471 -0.52471 -0.47078 0.52248 -0.88389
103 8PX -2.08200 2.96930 -3.03879 -0.64703 2.04796
104 8PY 2.96930 -2.08200 0.95905 2.95519 2.04796
105 8PZ 2.96930 2.96930 2.07974 -2.30815 0.53627
106 9PX -0.28365 1.09469 -1.06824 -0.22746 0.65742
107 9PY 1.09469 -0.28365 0.33714 1.03885 0.65742
108 9PZ 1.09469 1.09469 0.73110 -0.81140 0.36888
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111 10D-1 0.34316 -0.14175 0.28967 0.06168 0.06743
112 10D+2 -0.44332 0.44332 -0.32854 -0.29603 0.00000
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117 11D+2 1.15467 -1.15467 1.02054 0.91955 0.00000
118 11D-2 0.19711 0.19711 0.56058 -0.62215 -0.97897
119 12D 0 -0.70158 -0.70158 -0.95047 1.05486 0.42983
120 12D+1 0.36081 -1.30388 0.31755 0.97848 -0.34426
121 12D-1 -1.30388 0.36081 -1.00616 -0.21424 -0.34426
122 12D+2 1.21518 -1.21518 1.05486 0.95047 0.00000
123 12D-2 0.36081 0.36081 0.68862 -0.76425 -0.58753
124 13F 0 -0.01305 -0.01305 0.08728 -0.09687 -0.17141
125 13F+1 0.06223 0.07361 0.11406 -0.15228 -0.22500
126 13F-1 0.07361 0.06223 0.13961 -0.12925 -0.22500
127 13F+2 -0.08300 0.08300 -0.16228 -0.14622 0.00000
128 13F-2 0.08427 0.08427 0.00000 0.00000 0.14914
129 13F+3 -0.08034 0.04051 -0.07296 -0.15230 -0.13998
130 13F-3 -0.04051 0.08034 -0.15906 -0.05675 0.13998
131 14F 0 0.09587 0.09587 0.16246 -0.18030 -0.27939
132 14F+1 0.14693 0.51345 0.27766 -0.59040 -0.13021
133 14F-1 0.51345 0.14693 0.55838 -0.33746 -0.13021
134 14F+2 -0.72373 0.72373 -0.59698 -0.53791 0.00000
135 14F-2 -0.08175 -0.08175 0.00000 0.00000 0.21826
136 14F+3 -0.18969 0.51899 -0.08518 -0.52125 -0.18852
137 14F-3 -0.51899 0.18969 -0.52728 -0.03060 0.18852
138 15G 0 0.12307 0.12307 0.09056 -0.10051 -0.00461
139 15G+1 -0.10510 -0.07977 -0.20227 0.17374 0.21313
140 15G-1 -0.07977 -0.10510 -0.15180 0.21921 0.21313
141 15G+2 0.18783 -0.18783 0.15571 0.14030 0.00000
142 15G-2 -0.10551 -0.10551 -0.19467 0.21604 0.03792
143 15G+3 0.15252 -0.21104 0.17242 0.23004 0.15301
144 15G-3 0.21104 -0.15252 0.24670 0.14760 -0.15301
145 15G+4 -0.03797 -0.03797 -0.10716 0.11893 0.12891
146 15G-4 0.15223 -0.15223 0.19539 0.17606 0.00000
147 3 H 1S -0.06527 -0.06527 0.00000 0.00000 0.01250
148 2S 0.04707 0.04707 0.00000 0.00000 0.33455
149 3S 3.89051 3.89051 0.00000 0.00000 -4.10960
150 4S 2.24745 2.24745 0.00000 0.00000 -1.54081
151 5S -0.09883 -0.09883 0.00000 0.00000 -0.15962
152 6PX -0.51134 0.28129 0.28773 0.06127 0.17665
153 6PY 0.28129 -0.51134 -0.09081 -0.27981 0.17665
154 6PZ -0.28129 -0.28129 0.19692 -0.21855 0.59526
155 7PX 1.00049 -0.52471 -0.68787 -0.14647 -0.10856
156 7PY -0.52471 1.00049 0.21709 0.66895 -0.10856
157 7PZ 0.52471 0.52471 -0.47078 0.52248 -0.88389
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159 8PY 2.96930 -2.08200 -0.95905 -2.95519 -2.04796
160 8PZ -2.96930 -2.96930 2.07974 -2.30815 0.53627
161 9PX -0.28365 1.09469 1.06824 0.22746 -0.65742
162 9PY 1.09469 -0.28365 -0.33714 -1.03885 -0.65742
163 9PZ -1.09469 -1.09469 0.73110 -0.81140 0.36888
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168 10D-2 0.14175 0.14175 -0.19825 0.22002 0.23243
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171 11D-1 -1.01909 0.19711 0.81909 0.17440 0.12205
172 11D+2 -1.15467 1.15467 1.02054 0.91955 0.00000
173 11D-2 -0.19711 -0.19711 0.56058 -0.62215 -0.97897
174 12D 0 0.70158 0.70158 -0.95047 1.05486 0.42983
175 12D+1 0.36081 -1.30388 -0.31755 -0.97848 0.34426
176 12D-1 -1.30388 0.36081 1.00616 0.21424 0.34426
177 12D+2 -1.21518 1.21518 1.05486 0.95047 0.00000
178 12D-2 -0.36081 -0.36081 0.68862 -0.76425 -0.58753
179 13F 0 0.01305 0.01305 0.08728 -0.09687 -0.17141
180 13F+1 0.06223 0.07361 -0.11406 0.15228 0.22500
181 13F-1 0.07361 0.06223 -0.13961 0.12925 0.22500
182 13F+2 0.08300 -0.08300 -0.16228 -0.14622 0.00000
183 13F-2 -0.08427 -0.08427 0.00000 0.00000 0.14914
184 13F+3 -0.08034 0.04051 0.07296 0.15230 0.13998
185 13F-3 -0.04051 0.08034 0.15906 0.05675 -0.13998
186 14F 0 -0.09587 -0.09587 0.16246 -0.18030 -0.27939
187 14F+1 0.14693 0.51345 -0.27766 0.59040 0.13021
188 14F-1 0.51345 0.14693 -0.55838 0.33746 0.13021
189 14F+2 0.72373 -0.72373 -0.59698 -0.53791 0.00000
190 14F-2 0.08175 0.08175 0.00000 0.00000 0.21826
191 14F+3 -0.18969 0.51899 0.08518 0.52125 0.18852
192 14F-3 -0.51899 0.18969 0.52728 0.03060 -0.18852
193 15G 0 -0.12307 -0.12307 0.09056 -0.10051 -0.00461
194 15G+1 -0.10510 -0.07977 0.20227 -0.17374 -0.21313
195 15G-1 -0.07977 -0.10510 0.15180 -0.21921 -0.21313
196 15G+2 -0.18783 0.18783 0.15571 0.14030 0.00000
197 15G-2 0.10551 0.10551 -0.19467 0.21604 0.03792
198 15G+3 0.15252 -0.21104 -0.17242 -0.23004 -0.15301
199 15G-3 0.21104 -0.15252 -0.24670 -0.14760 0.15301
200 15G+4 0.03797 0.03797 -0.10716 0.11893 0.12891
201 15G-4 -0.15223 0.15223 0.19539 0.17606 0.00000
202 4 H 1S 0.06527 -0.06527 0.00000 0.00000 -0.01250
203 2S -0.04707 0.04707 0.00000 0.00000 -0.33455
204 3S -3.89051 3.89051 0.00000 0.00000 4.10960
205 4S -2.24745 2.24745 0.00000 0.00000 1.54081
206 5S 0.09883 -0.09883 0.00000 0.00000 0.15962
207 6PX -0.51134 -0.28129 -0.28773 -0.06127 0.17665
208 6PY -0.28129 -0.51134 -0.09081 -0.27981 -0.17665
209 6PZ -0.28129 0.28129 -0.19692 0.21855 0.59526
210 7PX 1.00049 0.52471 0.68787 0.14647 -0.10856
211 7PY 0.52471 1.00049 0.21709 0.66895 0.10856
212 7PZ 0.52471 -0.52471 0.47078 -0.52248 -0.88389
213 8PX -2.08200 -2.96930 -3.03879 -0.64703 -2.04796
214 8PY -2.96930 -2.08200 -0.95905 -2.95519 2.04796
215 8PZ -2.96930 2.96930 -2.07974 2.30815 0.53627
216 9PX -0.28365 -1.09469 -1.06824 -0.22746 -0.65742
217 9PY -1.09469 -0.28365 -0.33714 -1.03885 0.65742
218 9PZ -1.09469 1.09469 -0.73110 0.81140 0.36888
219 10D 0 0.25595 -0.25595 0.29603 -0.32854 0.16798
220 10D+1 0.14175 0.34316 0.09142 0.28170 0.06743
221 10D-1 0.34316 0.14175 0.28967 0.06168 -0.06743
222 10D+2 -0.44332 -0.44332 -0.32854 -0.29603 0.00000
223 10D-2 0.14175 -0.14175 0.19825 -0.22002 0.23243
224 11D 0 -0.66665 0.66665 -0.91955 1.02054 -0.95384
225 11D+1 -0.19711 -1.01909 -0.25851 -0.79655 -0.12205
226 11D-1 -1.01909 -0.19711 -0.81909 -0.17440 0.12205
227 11D+2 1.15467 1.15467 1.02054 0.91955 0.00000
228 11D-2 -0.19711 0.19711 -0.56058 0.62215 -0.97897
229 12D 0 -0.70158 0.70158 -0.95047 1.05486 -0.42983
230 12D+1 -0.36081 -1.30388 -0.31755 -0.97848 -0.34426
231 12D-1 -1.30388 -0.36081 -1.00616 -0.21424 0.34426
232 12D+2 1.21518 1.21518 1.05486 0.95047 0.00000
233 12D-2 -0.36081 0.36081 -0.68862 0.76425 -0.58753
234 13F 0 0.01305 -0.01305 -0.08728 0.09687 -0.17141
235 13F+1 0.06223 -0.07361 0.11406 -0.15228 0.22500
236 13F-1 -0.07361 0.06223 -0.13961 0.12925 -0.22500
237 13F+2 0.08300 0.08300 0.16228 0.14622 0.00000
238 13F-2 0.08427 -0.08427 0.00000 0.00000 -0.14914
239 13F+3 -0.08034 -0.04051 -0.07296 -0.15230 0.13998
240 13F-3 0.04051 0.08034 0.15906 0.05675 0.13998
241 14F 0 -0.09587 0.09587 -0.16246 0.18030 -0.27939
242 14F+1 0.14693 -0.51345 0.27766 -0.59040 0.13021
243 14F-1 -0.51345 0.14693 -0.55838 0.33746 -0.13021
244 14F+2 0.72373 0.72373 0.59698 0.53791 0.00000
245 14F-2 -0.08175 0.08175 0.00000 0.00000 -0.21826
246 14F+3 -0.18969 -0.51899 -0.08518 -0.52125 0.18852
247 14F-3 0.51899 0.18969 0.52728 0.03060 0.18852
248 15G 0 0.12307 -0.12307 0.09056 -0.10051 0.00461
249 15G+1 0.10510 -0.07977 0.20227 -0.17374 0.21313
250 15G-1 -0.07977 0.10510 -0.15180 0.21921 -0.21313
251 15G+2 0.18783 0.18783 0.15571 0.14030 0.00000
252 15G-2 0.10551 -0.10551 0.19467 -0.21604 0.03792
253 15G+3 -0.15252 -0.21104 -0.17242 -0.23004 0.15301
254 15G-3 0.21104 0.15252 0.24670 0.14760 0.15301
255 15G+4 -0.03797 0.03797 -0.10716 0.11893 -0.12891
256 15G-4 -0.15223 -0.15223 -0.19539 -0.17606 0.00000
257 5 H 1S -0.06527 0.06527 0.00000 0.00000 -0.01250
258 2S 0.04707 -0.04707 0.00000 0.00000 -0.33455
259 3S 3.89051 -3.89051 0.00000 0.00000 4.10960
260 4S 2.24745 -2.24745 0.00000 0.00000 1.54081
261 5S -0.09883 0.09883 0.00000 0.00000 0.15962
262 6PX -0.51134 -0.28129 0.28773 0.06127 -0.17665
263 6PY -0.28129 -0.51134 0.09081 0.27981 0.17665
264 6PZ 0.28129 -0.28129 -0.19692 0.21855 0.59526
265 7PX 1.00049 0.52471 -0.68787 -0.14647 0.10856
266 7PY 0.52471 1.00049 -0.21709 -0.66895 -0.10856
267 7PZ -0.52471 0.52471 0.47078 -0.52248 -0.88389
268 8PX -2.08200 -2.96930 3.03879 0.64703 2.04796
269 8PY -2.96930 -2.08200 0.95905 2.95519 -2.04796
270 8PZ 2.96930 -2.96930 -2.07974 2.30815 0.53627
271 9PX -0.28365 -1.09469 1.06824 0.22746 0.65742
272 9PY -1.09469 -0.28365 0.33714 1.03885 -0.65742
273 9PZ 1.09469 -1.09469 -0.73110 0.81140 0.36888
274 10D 0 -0.25595 0.25595 0.29603 -0.32854 0.16798
275 10D+1 0.14175 0.34316 -0.09142 -0.28170 -0.06743
276 10D-1 0.34316 0.14175 -0.28967 -0.06168 0.06743
277 10D+2 0.44332 0.44332 -0.32854 -0.29603 0.00000
278 10D-2 -0.14175 0.14175 0.19825 -0.22002 0.23243
279 11D 0 0.66665 -0.66665 -0.91955 1.02054 -0.95384
280 11D+1 -0.19711 -1.01909 0.25851 0.79655 0.12205
281 11D-1 -1.01909 -0.19711 0.81909 0.17440 -0.12205
282 11D+2 -1.15467 -1.15467 1.02054 0.91955 0.00000
283 11D-2 0.19711 -0.19711 -0.56058 0.62215 -0.97897
284 12D 0 0.70158 -0.70158 -0.95047 1.05486 -0.42983
285 12D+1 -0.36081 -1.30388 0.31755 0.97848 0.34426
286 12D-1 -1.30388 -0.36081 1.00616 0.21424 -0.34426
287 12D+2 -1.21518 -1.21518 1.05486 0.95047 0.00000
288 12D-2 0.36081 -0.36081 -0.68862 0.76425 -0.58753
289 13F 0 -0.01305 0.01305 -0.08728 0.09687 -0.17141
290 13F+1 0.06223 -0.07361 -0.11406 0.15228 -0.22500
291 13F-1 -0.07361 0.06223 0.13961 -0.12925 0.22500
292 13F+2 -0.08300 -0.08300 0.16228 0.14622 0.00000
293 13F-2 -0.08427 0.08427 0.00000 0.00000 -0.14914
294 13F+3 -0.08034 -0.04051 0.07296 0.15230 -0.13998
295 13F-3 0.04051 0.08034 -0.15906 -0.05675 -0.13998
296 14F 0 0.09587 -0.09587 -0.16246 0.18030 -0.27939
297 14F+1 0.14693 -0.51345 -0.27766 0.59040 -0.13021
298 14F-1 -0.51345 0.14693 0.55838 -0.33746 0.13021
299 14F+2 -0.72373 -0.72373 0.59698 0.53791 0.00000
300 14F-2 0.08175 -0.08175 0.00000 0.00000 -0.21826
301 14F+3 -0.18969 -0.51899 0.08518 0.52125 -0.18852
302 14F-3 0.51899 0.18969 -0.52728 -0.03060 -0.18852
303 15G 0 -0.12307 0.12307 0.09056 -0.10051 0.00461
304 15G+1 0.10510 -0.07977 -0.20227 0.17374 -0.21313
305 15G-1 -0.07977 0.10510 0.15180 -0.21921 0.21313
306 15G+2 -0.18783 -0.18783 0.15571 0.14030 0.00000
307 15G-2 -0.10551 0.10551 0.19467 -0.21604 0.03792
308 15G+3 -0.15252 -0.21104 0.17242 0.23004 -0.15301
309 15G-3 0.21104 0.15252 -0.24670 -0.14760 -0.15301
310 15G+4 0.03797 -0.03797 -0.10716 0.11893 -0.12891
311 15G-4 0.15223 0.15223 -0.19539 -0.17606 0.00000
296 297 298 299 300
(T2)--V (T2)--V (E)--V (E)--V (T1)--V
Eigenvalues -- 18.37787 18.37787 18.50054 18.50054 18.63571
1 1 C 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 -0.65076 0.00000 0.00000 0.00000
8 7PY -0.65076 0.00000 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 1.03628 0.00000 0.00000 0.00000
11 8PY 1.03628 0.00000 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 10.36737 0.00000 0.00000 0.00000
14 9PY 10.36737 0.00000 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 2.04488 0.00000 0.00000 0.00000
17 10PY 2.04488 0.00000 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.37801 0.00000 0.00000 0.00000
20 11PY 0.37801 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 0.62090 -0.19762 0.00000
23 12D+1 0.50284 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.50284 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.19762 0.62090 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 -1.06010 0.33741 0.00000
28 13D+1 0.05656 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.05656 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00000 -0.33741 -1.06010 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 1.75564 -0.55878 0.00000
33 14D+1 0.68987 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.68987 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.55878 1.75564 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15D 0 0.00000 0.00000 1.37033 -0.43614 0.00000
38 15D+1 0.61650 0.00000 0.00000 0.00000 0.00000
39 15D-1 0.00000 0.61650 0.00000 0.00000 0.00000
40 15D+2 0.00000 0.00000 0.43614 1.37033 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 0.12895 0.00000 0.00000 0.00000
44 16F-1 0.12895 0.00000 0.00000 0.00000 -0.13159
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 -0.16647 0.00000 0.00000 0.00000
48 16F-3 0.16647 0.00000 0.00000 0.00000 0.10193
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.00000
50 17F+1 0.00000 -0.50757 0.00000 0.00000 0.00000
51 17F-1 -0.50757 0.00000 0.00000 0.00000 2.78780
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 0.65527 0.00000 0.00000 0.00000
55 17F-3 -0.65527 0.00000 0.00000 0.00000 -2.15942
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00000
57 18F+1 0.00000 0.16471 0.00000 0.00000 0.00000
58 18F-1 0.16471 0.00000 0.00000 0.00000 0.47316
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 -0.21263 0.00000 0.00000 0.00000
62 18F-3 0.21263 0.00000 0.00000 0.00000 -0.36650
63 19G 0 0.00000 0.00000 0.22726 -0.07233 0.00000
64 19G+1 -0.32055 0.00000 0.00000 0.00000 0.79793
65 19G-1 0.00000 -0.32055 0.00000 0.00000 0.00000
66 19G+2 0.00000 0.00000 -0.11206 -0.35207 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.00000 0.00000
68 19G+3 -0.84811 0.00000 0.00000 0.00000 -0.30159
69 19G-3 0.00000 0.84811 0.00000 0.00000 0.00000
70 19G+4 0.00000 0.00000 -0.26890 0.08558 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00000 0.00000 0.79645 -0.25349 0.00000
73 20G+1 -0.51032 0.00000 0.00000 0.00000 1.51647
74 20G-1 0.00000 -0.51032 0.00000 0.00000 0.00000
75 20G+2 0.00000 0.00000 -0.39271 -1.23386 0.00000
76 20G-2 0.00000 0.00000 0.00000 0.00000 0.00000
77 20G+3 -1.35019 0.00000 0.00000 0.00000 -0.57317
78 20G-3 0.00000 1.35019 0.00000 0.00000 0.00000
79 20G+4 0.00000 0.00000 -0.94237 0.29994 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 -0.33491 0.00000 0.00000 0.00000
83 21H-1 -0.33491 0.00000 0.00000 0.00000 0.26465
84 21H+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 21H-2 0.00000 0.00000 -0.69873 0.22239 0.00000
86 21H+3 0.00000 0.57170 0.00000 0.00000 0.00000
87 21H-3 -0.57170 0.00000 0.00000 0.00000 0.12251
88 21H+4 0.00000 0.00000 0.00000 0.00000 0.00000
89 21H-4 0.00000 0.00000 -0.22239 -0.69873 0.00000
90 21H+5 0.00000 -0.57922 0.00000 0.00000 0.00000
91 21H-5 -0.57922 0.00000 0.00000 0.00000 -0.27393
92 2 H 1S 0.01250 0.01250 0.00000 0.00000 0.00000
93 2S 0.33455 0.33455 0.00000 0.00000 0.00000
94 3S -4.10960 -4.10960 0.00000 0.00000 0.00000
95 4S -1.54081 -1.54081 0.00000 0.00000 0.00000
96 5S -0.15962 -0.15962 0.00000 0.00000 0.00000
97 6PX -0.17665 0.59526 0.15018 -0.68622 -0.48474
98 6PY 0.59526 -0.17665 0.51919 0.47317 0.00000
99 6PZ -0.17665 -0.17665 -0.66937 0.21305 0.48474
100 7PX 0.10856 -0.88389 -0.24208 1.10612 0.58007
101 7PY -0.88389 0.10856 -0.83689 -0.76271 0.00000
102 7PZ 0.10856 0.10856 1.07897 -0.34341 -0.58007
103 8PX 2.04796 0.53627 0.12649 -0.57796 1.10477
104 8PY 0.53627 2.04796 0.43728 0.39852 0.00000
105 8PZ 2.04796 2.04796 -0.56377 0.17944 -1.10477
106 9PX 0.65742 0.36888 0.13355 -0.61024 0.12749
107 9PY 0.36888 0.65742 0.46170 0.42078 0.00000
108 9PZ 0.65742 0.65742 -0.59526 0.18946 -0.12749
109 10D 0 0.08399 0.08399 0.01661 -0.00529 -0.26754
110 10D+1 0.23243 0.06743 -0.12792 -0.11658 0.00000
111 10D-1 0.06743 0.23243 -0.03700 0.16908 -0.21287
112 10D+2 0.14547 -0.14547 0.00529 0.01661 0.15446
113 10D-2 0.06743 0.06743 0.16493 -0.05249 0.21287
114 11D 0 -0.47692 -0.47692 -0.53991 0.17184 0.97789
115 11D+1 -0.97897 -0.12205 0.03078 0.02805 0.00000
116 11D-1 -0.12205 -0.97897 0.00890 -0.04068 0.77514
117 11D+2 -0.82605 0.82605 -0.17184 -0.53991 -0.56459
118 11D-2 -0.12205 -0.12205 -0.03968 0.01263 -0.77514
119 12D 0 -0.21492 -0.21492 0.33492 -0.10660 0.26755
120 12D+1 -0.58753 -0.34426 0.38851 0.35407 0.00000
121 12D-1 -0.34426 -0.58753 0.11238 -0.51349 0.22809
122 12D+2 -0.37225 0.37225 0.10660 0.33492 -0.15447
123 12D-2 -0.34426 -0.34426 -0.50089 0.15942 -0.22809
124 13F 0 0.02712 0.02712 0.11730 -0.03733 -0.04195
125 13F+1 0.19178 0.10497 0.23703 -0.02529 -0.13315
126 13F-1 0.10497 0.19178 0.20804 -0.11637 -0.27049
127 13F+2 0.26359 -0.26359 0.08676 0.27258 0.13593
128 13F-2 0.14914 0.14914 0.00000 0.00000 0.00000
129 13F+3 0.18286 -0.13551 0.15032 0.13252 -0.05008
130 13F-3 0.13551 -0.18286 -0.04607 0.19502 0.20952
131 14F 0 -0.06930 -0.06930 0.19733 -0.06281 -0.04480
132 14F+1 0.21509 0.17109 -0.17347 -0.16778 -0.23218
133 14F-1 0.17109 0.21509 -0.04458 0.23718 -0.30107
134 14F+2 0.21839 -0.21839 -0.07877 -0.24749 0.25898
135 14F-2 0.21826 0.21826 0.00000 0.00000 0.00000
136 14F+3 0.07895 -0.22088 -0.19037 0.12592 -0.12318
137 14F-3 0.22088 -0.07895 0.22814 -0.00728 0.23321
138 15G 0 0.09360 0.09360 -0.03404 0.01083 -0.13298
139 15G+1 -0.01341 -0.05865 -0.11790 0.09603 0.07235
140 15G-1 -0.05865 -0.01341 -0.15171 -0.01021 0.09700
141 15G+2 -0.08785 0.08785 0.01678 0.05273 -0.11894
142 15G-2 -0.21848 -0.21848 -0.06053 0.01927 0.18711
143 15G+3 -0.03548 0.25573 -0.00563 -0.08204 -0.02734
144 15G-3 -0.25573 0.03548 -0.04282 -0.07020 -0.16336
145 15G+4 0.01270 0.01270 0.04027 -0.01282 0.15734
146 15G-4 -0.14527 0.14527 -0.04876 -0.15320 -0.03298
147 3 H 1S -0.01250 -0.01250 0.00000 0.00000 0.00000
148 2S -0.33455 -0.33455 0.00000 0.00000 0.00000
149 3S 4.10960 4.10960 0.00000 0.00000 0.00000
150 4S 1.54081 1.54081 0.00000 0.00000 0.00000
151 5S 0.15962 0.15962 0.00000 0.00000 0.00000
152 6PX -0.17665 0.59526 -0.15018 0.68622 -0.48474
153 6PY 0.59526 -0.17665 -0.51919 -0.47317 0.00000
154 6PZ 0.17665 0.17665 -0.66937 0.21305 -0.48474
155 7PX 0.10856 -0.88389 0.24208 -1.10612 0.58007
156 7PY -0.88389 0.10856 0.83689 0.76271 0.00000
157 7PZ -0.10856 -0.10856 1.07897 -0.34341 0.58007
158 8PX 2.04796 0.53627 -0.12649 0.57796 1.10477
159 8PY 0.53627 2.04796 -0.43728 -0.39852 0.00000
160 8PZ -2.04796 -2.04796 -0.56377 0.17944 1.10477
161 9PX 0.65742 0.36888 -0.13355 0.61024 0.12749
162 9PY 0.36888 0.65742 -0.46170 -0.42078 0.00000
163 9PZ -0.65742 -0.65742 -0.59526 0.18946 0.12749
164 10D 0 -0.08399 -0.08399 0.01661 -0.00529 0.26754
165 10D+1 0.23243 0.06743 0.12792 0.11658 0.00000
166 10D-1 0.06743 0.23243 0.03700 -0.16908 -0.21287
167 10D+2 -0.14547 0.14547 0.00529 0.01661 -0.15446
168 10D-2 -0.06743 -0.06743 0.16493 -0.05249 -0.21287
169 11D 0 0.47692 0.47692 -0.53991 0.17184 -0.97789
170 11D+1 -0.97897 -0.12205 -0.03078 -0.02805 0.00000
171 11D-1 -0.12205 -0.97897 -0.00890 0.04068 0.77514
172 11D+2 0.82605 -0.82605 -0.17184 -0.53991 0.56459
173 11D-2 0.12205 0.12205 -0.03968 0.01263 0.77514
174 12D 0 0.21492 0.21492 0.33492 -0.10660 -0.26755
175 12D+1 -0.58753 -0.34426 -0.38851 -0.35407 0.00000
176 12D-1 -0.34426 -0.58753 -0.11238 0.51349 0.22809
177 12D+2 0.37225 -0.37225 0.10660 0.33492 0.15447
178 12D-2 0.34426 0.34426 -0.50089 0.15942 0.22809
179 13F 0 -0.02712 -0.02712 0.11730 -0.03733 0.04195
180 13F+1 0.19178 0.10497 -0.23703 0.02529 -0.13315
181 13F-1 0.10497 0.19178 -0.20804 0.11637 -0.27049
182 13F+2 -0.26359 0.26359 0.08676 0.27258 -0.13593
183 13F-2 -0.14914 -0.14914 0.00000 0.00000 0.00000
184 13F+3 0.18286 -0.13551 -0.15032 -0.13252 -0.05008
185 13F-3 0.13551 -0.18286 0.04607 -0.19502 0.20952
186 14F 0 0.06930 0.06930 0.19733 -0.06281 0.04480
187 14F+1 0.21509 0.17109 0.17347 0.16778 -0.23218
188 14F-1 0.17109 0.21509 0.04458 -0.23718 -0.30107
189 14F+2 -0.21839 0.21839 -0.07877 -0.24749 -0.25898
190 14F-2 -0.21826 -0.21826 0.00000 0.00000 0.00000
191 14F+3 0.07895 -0.22088 0.19037 -0.12592 -0.12318
192 14F-3 0.22088 -0.07895 -0.22814 0.00728 0.23321
193 15G 0 -0.09360 -0.09360 -0.03404 0.01083 0.13298
194 15G+1 -0.01341 -0.05865 0.11790 -0.09603 0.07235
195 15G-1 -0.05865 -0.01341 0.15171 0.01021 0.09700
196 15G+2 0.08785 -0.08785 0.01678 0.05273 0.11894
197 15G-2 0.21848 0.21848 -0.06053 0.01927 -0.18711
198 15G+3 -0.03548 0.25573 0.00563 0.08204 -0.02734
199 15G-3 -0.25573 0.03548 0.04282 0.07020 -0.16336
200 15G+4 -0.01270 -0.01270 0.04027 -0.01282 -0.15734
201 15G-4 0.14527 -0.14527 -0.04876 -0.15320 0.03298
202 4 H 1S -0.01250 0.01250 0.00000 0.00000 0.00000
203 2S -0.33455 0.33455 0.00000 0.00000 0.00000
204 3S 4.10960 -4.10960 0.00000 0.00000 0.00000
205 4S 1.54081 -1.54081 0.00000 0.00000 0.00000
206 5S 0.15962 -0.15962 0.00000 0.00000 0.00000
207 6PX 0.17665 0.59526 0.15018 -0.68622 0.48474
208 6PY 0.59526 0.17665 -0.51919 -0.47317 0.00000
209 6PZ -0.17665 0.17665 0.66937 -0.21305 0.48474
210 7PX -0.10856 -0.88389 -0.24208 1.10612 -0.58007
211 7PY -0.88389 -0.10856 0.83689 0.76271 0.00000
212 7PZ 0.10856 -0.10856 -1.07897 0.34341 -0.58007
213 8PX -2.04796 0.53627 0.12649 -0.57796 -1.10477
214 8PY 0.53627 -2.04796 -0.43728 -0.39852 0.00000
215 8PZ 2.04796 -2.04796 0.56377 -0.17944 -1.10477
216 9PX -0.65742 0.36888 0.13355 -0.61024 -0.12749
217 9PY 0.36888 -0.65742 -0.46170 -0.42078 0.00000
218 9PZ 0.65742 -0.65742 0.59526 -0.18946 -0.12749
219 10D 0 -0.08399 0.08399 0.01661 -0.00529 0.26754
220 10D+1 0.23243 -0.06743 0.12792 0.11658 0.00000
221 10D-1 -0.06743 0.23243 -0.03700 0.16908 0.21287
222 10D+2 -0.14547 -0.14547 0.00529 0.01661 -0.15446
223 10D-2 0.06743 -0.06743 -0.16493 0.05249 0.21287
224 11D 0 0.47692 -0.47692 -0.53991 0.17184 -0.97789
225 11D+1 -0.97897 0.12205 -0.03078 -0.02805 0.00000
226 11D-1 0.12205 -0.97897 0.00890 -0.04068 -0.77514
227 11D+2 0.82605 0.82605 -0.17184 -0.53991 0.56459
228 11D-2 -0.12205 0.12205 0.03968 -0.01263 -0.77514
229 12D 0 0.21492 -0.21492 0.33492 -0.10660 -0.26755
230 12D+1 -0.58753 0.34426 -0.38851 -0.35407 0.00000
231 12D-1 0.34426 -0.58753 0.11238 -0.51349 -0.22809
232 12D+2 0.37225 0.37225 0.10660 0.33492 0.15447
233 12D-2 -0.34426 0.34426 0.50089 -0.15942 -0.22809
234 13F 0 0.02712 -0.02712 -0.11730 0.03733 -0.04195
235 13F+1 -0.19178 0.10497 0.23703 -0.02529 0.13315
236 13F-1 0.10497 -0.19178 -0.20804 0.11637 -0.27049
237 13F+2 0.26359 0.26359 -0.08676 -0.27258 0.13593
238 13F-2 -0.14914 0.14914 0.00000 0.00000 0.00000
239 13F+3 -0.18286 -0.13551 0.15032 0.13252 0.05008
240 13F-3 0.13551 0.18286 0.04607 -0.19502 0.20952
241 14F 0 -0.06930 0.06930 -0.19733 0.06281 -0.04480
242 14F+1 -0.21509 0.17109 -0.17347 -0.16778 0.23218
243 14F-1 0.17109 -0.21509 0.04458 -0.23718 -0.30107
244 14F+2 0.21839 0.21839 0.07877 0.24749 0.25898
245 14F-2 -0.21826 0.21826 0.00000 0.00000 0.00000
246 14F+3 -0.07895 -0.22088 -0.19037 0.12592 0.12318
247 14F-3 0.22088 0.07895 -0.22814 0.00728 0.23321
248 15G 0 -0.09360 0.09360 -0.03404 0.01083 0.13298
249 15G+1 -0.01341 0.05865 0.11790 -0.09603 0.07235
250 15G-1 0.05865 -0.01341 -0.15171 -0.01021 -0.09700
251 15G+2 0.08785 0.08785 0.01678 0.05273 0.11894
252 15G-2 -0.21848 0.21848 0.06053 -0.01927 0.18711
253 15G+3 -0.03548 -0.25573 0.00563 0.08204 -0.02734
254 15G-3 0.25573 0.03548 -0.04282 -0.07020 0.16336
255 15G+4 -0.01270 0.01270 0.04027 -0.01282 -0.15734
256 15G-4 -0.14527 -0.14527 0.04876 0.15320 -0.03298
257 5 H 1S 0.01250 -0.01250 0.00000 0.00000 0.00000
258 2S 0.33455 -0.33455 0.00000 0.00000 0.00000
259 3S -4.10960 4.10960 0.00000 0.00000 0.00000
260 4S -1.54081 1.54081 0.00000 0.00000 0.00000
261 5S -0.15962 0.15962 0.00000 0.00000 0.00000
262 6PX 0.17665 0.59526 -0.15018 0.68622 0.48474
263 6PY 0.59526 0.17665 0.51919 0.47317 0.00000
264 6PZ 0.17665 -0.17665 0.66937 -0.21305 -0.48474
265 7PX -0.10856 -0.88389 0.24208 -1.10612 -0.58007
266 7PY -0.88389 -0.10856 -0.83689 -0.76271 0.00000
267 7PZ -0.10856 0.10856 -1.07897 0.34341 0.58007
268 8PX -2.04796 0.53627 -0.12649 0.57796 -1.10477
269 8PY 0.53627 -2.04796 0.43728 0.39852 0.00000
270 8PZ -2.04796 2.04796 0.56377 -0.17944 1.10477
271 9PX -0.65742 0.36888 -0.13355 0.61024 -0.12749
272 9PY 0.36888 -0.65742 0.46170 0.42078 0.00000
273 9PZ -0.65742 0.65742 0.59526 -0.18946 0.12749
274 10D 0 0.08399 -0.08399 0.01661 -0.00529 -0.26754
275 10D+1 0.23243 -0.06743 -0.12792 -0.11658 0.00000
276 10D-1 -0.06743 0.23243 0.03700 -0.16908 0.21287
277 10D+2 0.14547 0.14547 0.00529 0.01661 0.15446
278 10D-2 -0.06743 0.06743 -0.16493 0.05249 -0.21287
279 11D 0 -0.47692 0.47692 -0.53991 0.17184 0.97789
280 11D+1 -0.97897 0.12205 0.03078 0.02805 0.00000
281 11D-1 0.12205 -0.97897 -0.00890 0.04068 -0.77514
282 11D+2 -0.82605 -0.82605 -0.17184 -0.53991 -0.56459
283 11D-2 0.12205 -0.12205 0.03968 -0.01263 0.77514
284 12D 0 -0.21492 0.21492 0.33492 -0.10660 0.26755
285 12D+1 -0.58753 0.34426 0.38851 0.35407 0.00000
286 12D-1 0.34426 -0.58753 -0.11238 0.51349 -0.22809
287 12D+2 -0.37225 -0.37225 0.10660 0.33492 -0.15447
288 12D-2 0.34426 -0.34426 0.50089 -0.15942 0.22809
289 13F 0 -0.02712 0.02712 -0.11730 0.03733 0.04195
290 13F+1 -0.19178 0.10497 -0.23703 0.02529 0.13315
291 13F-1 0.10497 -0.19178 0.20804 -0.11637 -0.27049
292 13F+2 -0.26359 -0.26359 -0.08676 -0.27258 -0.13593
293 13F-2 0.14914 -0.14914 0.00000 0.00000 0.00000
294 13F+3 -0.18286 -0.13551 -0.15032 -0.13252 0.05008
295 13F-3 0.13551 0.18286 -0.04607 0.19502 0.20952
296 14F 0 0.06930 -0.06930 -0.19733 0.06281 0.04480
297 14F+1 -0.21509 0.17109 0.17347 0.16778 0.23218
298 14F-1 0.17109 -0.21509 -0.04458 0.23718 -0.30107
299 14F+2 -0.21839 -0.21839 0.07877 0.24749 -0.25898
300 14F-2 0.21826 -0.21826 0.00000 0.00000 0.00000
301 14F+3 -0.07895 -0.22088 0.19037 -0.12592 0.12318
302 14F-3 0.22088 0.07895 0.22814 -0.00728 0.23321
303 15G 0 0.09360 -0.09360 -0.03404 0.01083 -0.13298
304 15G+1 -0.01341 0.05865 -0.11790 0.09603 0.07235
305 15G-1 0.05865 -0.01341 0.15171 0.01021 -0.09700
306 15G+2 -0.08785 -0.08785 0.01678 0.05273 -0.11894
307 15G-2 0.21848 -0.21848 0.06053 -0.01927 -0.18711
308 15G+3 -0.03548 -0.25573 -0.00563 -0.08204 -0.02734
309 15G-3 0.25573 0.03548 0.04282 0.07020 0.16336
310 15G+4 0.01270 -0.01270 0.04027 -0.01282 0.15734
311 15G-4 0.14527 0.14527 0.04876 0.15320 0.03298
301 302 303 304 305
(T1)--V (T1)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 18.63571 18.63571 18.95411 18.95411 18.95411
1 1 C 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 0.00000 1.32393 0.00000
8 7PY 0.00000 0.00000 1.32393 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 1.32393
10 8PX 0.00000 0.00000 0.00000 -5.67770 0.00000
11 8PY 0.00000 0.00000 -5.67770 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 -5.67770
13 9PX 0.00000 0.00000 0.00000 -8.01858 0.00000
14 9PY 0.00000 0.00000 -8.01858 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 -8.01858
16 10PX 0.00000 0.00000 0.00000 -5.67438 0.00000
17 10PY 0.00000 0.00000 -5.67438 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 -5.67438
19 11PX 0.00000 0.00000 0.00000 -0.26272 0.00000
20 11PY 0.00000 0.00000 -0.26272 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.26272
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.73822 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.73822 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 0.73822
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 -4.26975 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 -4.26975 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 -4.26975
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 -4.08695 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 -4.08695 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 -4.08695
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 -1.54328 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 -1.54328 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 -1.54328
42 16F 0 0.00000 0.00000 0.00000 0.00000 0.84290
43 16F+1 -0.13159 0.00000 0.00000 -0.51617 0.00000
44 16F-1 0.00000 0.00000 -0.51617 0.00000 0.00000
45 16F+2 0.00000 -0.16645 0.00000 0.00000 0.00000
46 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+3 -0.10193 0.00000 0.00000 0.66637 0.00000
48 16F-3 0.00000 0.00000 -0.66637 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 0.00000 0.60999
50 17F+1 2.78780 0.00000 0.00000 -0.37354 0.00000
51 17F-1 0.00000 0.00000 -0.37354 0.00000 0.00000
52 17F+2 0.00000 3.52632 0.00000 0.00000 0.00000
53 17F-2 0.00000 0.00000 0.00000 0.00000 0.00000
54 17F+3 2.15942 0.00000 0.00000 0.48224 0.00000
55 17F-3 0.00000 0.00000 -0.48224 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 0.00000 0.00810
57 18F+1 0.47316 0.00000 0.00000 -0.00496 0.00000
58 18F-1 0.00000 0.00000 -0.00496 0.00000 0.00000
59 18F+2 0.00000 0.59850 0.00000 0.00000 0.00000
60 18F-2 0.00000 0.00000 0.00000 0.00000 0.00000
61 18F+3 0.36650 0.00000 0.00000 0.00641 0.00000
62 18F-3 0.00000 0.00000 -0.00641 0.00000 0.00000
63 19G 0 0.00000 0.00000 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 -0.01821 0.00000 0.00000
65 19G-1 0.79793 0.00000 0.00000 -0.01821 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 0.05151
68 19G+3 0.00000 0.00000 -0.04819 0.00000 0.00000
69 19G-3 0.30159 0.00000 0.00000 0.04819 0.00000
70 19G+4 0.00000 0.00000 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.85302 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 -0.29900 0.00000 0.00000
74 20G-1 1.51647 0.00000 0.00000 -0.29900 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 0.84570
77 20G+3 0.00000 0.00000 -0.79108 0.00000 0.00000
78 20G-3 0.57317 0.00000 0.00000 0.79108 0.00000
79 20G+4 0.00000 0.00000 0.00000 0.00000 0.00000
80 20G-4 0.00000 1.62118 0.00000 0.00000 0.00000
81 21H 0 0.00000 0.00000 0.00000 0.00000 -0.36461
82 21H+1 0.26465 0.00000 0.00000 -0.23341 0.00000
83 21H-1 0.00000 0.00000 -0.23341 0.00000 0.00000
84 21H+2 0.00000 -0.40011 0.00000 0.00000 0.00000
85 21H-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 21H+3 -0.12251 0.00000 0.00000 0.11165 0.00000
87 21H-3 0.00000 0.00000 -0.11165 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 0.00000 -0.09932
89 21H-4 0.00000 0.00000 0.00000 0.00000 0.00000
90 21H+5 -0.27393 0.00000 0.00000 -0.27542 0.00000
91 21H-5 0.00000 0.00000 -0.27542 0.00000 0.00000
92 2 H 1S 0.00000 0.00000 0.14977 0.14977 0.14977
93 2S 0.00000 0.00000 -2.47496 -2.47496 -2.47496
94 3S 0.00000 0.00000 8.42279 8.42279 8.42279
95 4S 0.00000 0.00000 4.35302 4.35302 4.35302
96 5S 0.00000 0.00000 0.01568 0.01568 0.01568
97 6PX 0.00000 0.48474 0.01277 0.24060 0.01277
98 6PY -0.48474 -0.48474 0.24060 0.01277 0.01277
99 6PZ 0.48474 0.00000 0.01277 0.01277 0.24060
100 7PX 0.00000 -0.58007 0.58865 0.26500 0.58865
101 7PY 0.58007 0.58007 0.26500 0.58865 0.58865
102 7PZ -0.58007 0.00000 0.58865 0.58865 0.26500
103 8PX 0.00000 -1.10477 -3.09951 -3.67874 -3.09951
104 8PY 1.10477 1.10477 -3.67874 -3.09951 -3.09951
105 8PZ -1.10477 0.00000 -3.09951 -3.09951 -3.67874
106 9PX 0.00000 -0.12749 -1.51407 -1.46672 -1.51407
107 9PY 0.12749 0.12749 -1.46672 -1.51407 -1.51407
108 9PZ -0.12749 0.00000 -1.51407 -1.51407 -1.46672
109 10D 0 -0.26754 0.00000 0.04533 0.04533 -0.09066
110 10D+1 -0.21287 -0.21287 -0.39699 -0.43880 -0.43880
111 10D-1 0.00000 0.21287 -0.43880 -0.39699 -0.43880
112 10D+2 -0.15446 -0.30892 0.07851 -0.07851 0.00000
113 10D-2 0.21287 0.00000 -0.43880 -0.43880 -0.39699
114 11D 0 0.97789 0.00000 -0.20178 -0.20178 0.40356
115 11D+1 0.77514 0.77514 0.98571 1.27090 1.27090
116 11D-1 0.00000 -0.77514 1.27090 0.98571 1.27090
117 11D+2 0.56459 1.12917 -0.34950 0.34950 0.00000
118 11D-2 -0.77514 0.00000 1.27090 1.27090 0.98571
119 12D 0 0.26755 0.00000 -0.10448 -0.10448 0.20896
120 12D+1 0.22809 0.22809 1.01183 0.95308 0.95308
121 12D-1 0.00000 -0.22809 0.95308 1.01183 0.95308
122 12D+2 0.15447 0.30895 -0.18097 0.18097 0.00000
123 12D-2 -0.22809 0.00000 0.95308 0.95308 1.01183
124 13F 0 -0.04195 0.00000 0.16256 0.16256 0.11216
125 13F+1 -0.27049 -0.08178 -0.02219 -0.06868 -0.17691
126 13F-1 -0.13315 0.08178 -0.06868 -0.02219 -0.17691
127 13F+2 -0.13593 -0.34214 0.09786 -0.09786 0.00000
128 13F-2 0.00000 0.00000 -0.25906 -0.25906 -0.25906
129 13F+3 -0.20952 -0.11640 0.18844 0.08867 0.06859
130 13F-3 0.05008 -0.11640 -0.08867 -0.18844 -0.06859
131 14F 0 -0.04480 0.00000 0.38594 0.38594 0.17865
132 14F+1 -0.30107 -0.17731 -0.16863 -0.10940 -0.30405
133 14F-1 -0.23218 0.17731 -0.10940 -0.16863 -0.30405
134 14F+2 -0.25898 -0.38083 0.08565 -0.08565 0.00000
135 14F-2 0.00000 0.00000 -0.63088 -0.63088 -0.63088
136 14F+3 -0.23321 -0.19402 0.35756 0.14124 0.25266
137 14F-3 0.12318 -0.19402 -0.14124 -0.35756 -0.25266
138 15G 0 -0.13298 0.00000 -0.16021 -0.16021 -0.20924
139 15G+1 0.09700 0.03530 -0.09880 -0.14004 0.02820
140 15G-1 0.07235 -0.03530 -0.14004 -0.09880 0.02820
141 15G+2 0.11894 0.23788 -0.04386 0.04386 0.00000
142 15G-2 0.18711 0.00000 0.15815 0.15815 0.27943
143 15G+3 0.16336 0.18668 -0.26139 -0.11614 -0.17973
144 15G-3 0.02734 0.18668 0.11614 0.26139 0.17973
145 15G+4 0.15734 0.00000 -0.16855 -0.16855 -0.11054
146 15G-4 0.03298 0.07734 -0.08993 0.08993 0.00000
147 3 H 1S 0.00000 0.00000 -0.14977 -0.14977 0.14977
148 2S 0.00000 0.00000 2.47496 2.47496 -2.47496
149 3S 0.00000 0.00000 -8.42279 -8.42279 8.42279
150 4S 0.00000 0.00000 -4.35302 -4.35302 4.35302
151 5S 0.00000 0.00000 -0.01568 -0.01568 0.01568
152 6PX 0.00000 -0.48474 0.01277 0.24060 -0.01277
153 6PY -0.48474 0.48474 0.24060 0.01277 -0.01277
154 6PZ -0.48474 0.00000 -0.01277 -0.01277 0.24060
155 7PX 0.00000 0.58007 0.58865 0.26500 -0.58865
156 7PY 0.58007 -0.58007 0.26500 0.58865 -0.58865
157 7PZ 0.58007 0.00000 -0.58865 -0.58865 0.26500
158 8PX 0.00000 1.10477 -3.09951 -3.67874 3.09951
159 8PY 1.10477 -1.10477 -3.67874 -3.09951 3.09951
160 8PZ 1.10477 0.00000 3.09951 3.09951 -3.67874
161 9PX 0.00000 0.12749 -1.51407 -1.46672 1.51407
162 9PY 0.12749 -0.12749 -1.46672 -1.51407 1.51407
163 9PZ 0.12749 0.00000 1.51407 1.51407 -1.46672
164 10D 0 0.26754 0.00000 -0.04533 -0.04533 -0.09066
165 10D+1 -0.21287 0.21287 -0.39699 -0.43880 0.43880
166 10D-1 0.00000 -0.21287 -0.43880 -0.39699 0.43880
167 10D+2 0.15446 -0.30892 -0.07851 0.07851 0.00000
168 10D-2 -0.21287 0.00000 0.43880 0.43880 -0.39699
169 11D 0 -0.97789 0.00000 0.20178 0.20178 0.40356
170 11D+1 0.77514 -0.77514 0.98571 1.27090 -1.27090
171 11D-1 0.00000 0.77514 1.27090 0.98571 -1.27090
172 11D+2 -0.56459 1.12917 0.34950 -0.34950 0.00000
173 11D-2 0.77514 0.00000 -1.27090 -1.27090 0.98571
174 12D 0 -0.26755 0.00000 0.10448 0.10448 0.20896
175 12D+1 0.22809 -0.22809 1.01183 0.95308 -0.95308
176 12D-1 0.00000 0.22809 0.95308 1.01183 -0.95308
177 12D+2 -0.15447 0.30895 0.18097 -0.18097 0.00000
178 12D-2 0.22809 0.00000 -0.95308 -0.95308 1.01183
179 13F 0 0.04195 0.00000 -0.16256 -0.16256 0.11216
180 13F+1 -0.27049 0.08178 -0.02219 -0.06868 0.17691
181 13F-1 -0.13315 -0.08178 -0.06868 -0.02219 0.17691
182 13F+2 0.13593 -0.34214 -0.09786 0.09786 0.00000
183 13F-2 0.00000 0.00000 0.25906 0.25906 -0.25906
184 13F+3 -0.20952 0.11640 0.18844 0.08867 -0.06859
185 13F-3 0.05008 0.11640 -0.08867 -0.18844 0.06859
186 14F 0 0.04480 0.00000 -0.38594 -0.38594 0.17865
187 14F+1 -0.30107 0.17731 -0.16863 -0.10940 0.30405
188 14F-1 -0.23218 -0.17731 -0.10940 -0.16863 0.30405
189 14F+2 0.25898 -0.38083 -0.08565 0.08565 0.00000
190 14F-2 0.00000 0.00000 0.63088 0.63088 -0.63088
191 14F+3 -0.23321 0.19402 0.35756 0.14124 -0.25266
192 14F-3 0.12318 0.19402 -0.14124 -0.35756 0.25266
193 15G 0 0.13298 0.00000 0.16021 0.16021 -0.20924
194 15G+1 0.09700 -0.03530 -0.09880 -0.14004 -0.02820
195 15G-1 0.07235 0.03530 -0.14004 -0.09880 -0.02820
196 15G+2 -0.11894 0.23788 0.04386 -0.04386 0.00000
197 15G-2 -0.18711 0.00000 -0.15815 -0.15815 0.27943
198 15G+3 0.16336 -0.18668 -0.26139 -0.11614 0.17973
199 15G-3 0.02734 -0.18668 0.11614 0.26139 -0.17973
200 15G+4 -0.15734 0.00000 0.16855 0.16855 -0.11054
201 15G-4 -0.03298 0.07734 0.08993 -0.08993 0.00000
202 4 H 1S 0.00000 0.00000 -0.14977 0.14977 -0.14977
203 2S 0.00000 0.00000 2.47496 -2.47496 2.47496
204 3S 0.00000 0.00000 -8.42279 8.42279 -8.42279
205 4S 0.00000 0.00000 -4.35302 4.35302 -4.35302
206 5S 0.00000 0.00000 -0.01568 0.01568 -0.01568
207 6PX 0.00000 -0.48474 -0.01277 0.24060 -0.01277
208 6PY 0.48474 -0.48474 0.24060 -0.01277 0.01277
209 6PZ -0.48474 0.00000 0.01277 -0.01277 0.24060
210 7PX 0.00000 0.58007 -0.58865 0.26500 -0.58865
211 7PY -0.58007 0.58007 0.26500 -0.58865 0.58865
212 7PZ 0.58007 0.00000 0.58865 -0.58865 0.26500
213 8PX 0.00000 1.10477 3.09951 -3.67874 3.09951
214 8PY -1.10477 1.10477 -3.67874 3.09951 -3.09951
215 8PZ 1.10477 0.00000 -3.09951 3.09951 -3.67874
216 9PX 0.00000 0.12749 1.51407 -1.46672 1.51407
217 9PY -0.12749 0.12749 -1.46672 1.51407 -1.51407
218 9PZ 0.12749 0.00000 -1.51407 1.51407 -1.46672
219 10D 0 -0.26754 0.00000 -0.04533 0.04533 0.09066
220 10D+1 0.21287 -0.21287 -0.39699 0.43880 -0.43880
221 10D-1 0.00000 -0.21287 0.43880 -0.39699 0.43880
222 10D+2 -0.15446 0.30892 -0.07851 -0.07851 0.00000
223 10D-2 -0.21287 0.00000 -0.43880 0.43880 -0.39699
224 11D 0 0.97789 0.00000 0.20178 -0.20178 -0.40356
225 11D+1 -0.77514 0.77514 0.98571 -1.27090 1.27090
226 11D-1 0.00000 0.77514 -1.27090 0.98571 -1.27090
227 11D+2 0.56459 -1.12917 0.34950 0.34950 0.00000
228 11D-2 0.77514 0.00000 1.27090 -1.27090 0.98571
229 12D 0 0.26755 0.00000 0.10448 -0.10448 -0.20896
230 12D+1 -0.22809 0.22809 1.01183 -0.95308 0.95308
231 12D-1 0.00000 0.22809 -0.95308 1.01183 -0.95308
232 12D+2 0.15447 -0.30895 0.18097 0.18097 0.00000
233 12D-2 0.22809 0.00000 0.95308 -0.95308 1.01183
234 13F 0 0.04195 0.00000 0.16256 -0.16256 0.11216
235 13F+1 -0.27049 0.08178 0.02219 -0.06868 0.17691
236 13F-1 0.13315 0.08178 -0.06868 0.02219 -0.17691
237 13F+2 0.13593 -0.34214 0.09786 0.09786 0.00000
238 13F-2 0.00000 0.00000 0.25906 -0.25906 0.25906
239 13F+3 -0.20952 0.11640 -0.18844 0.08867 -0.06859
240 13F-3 -0.05008 -0.11640 -0.08867 0.18844 -0.06859
241 14F 0 0.04480 0.00000 0.38594 -0.38594 0.17865
242 14F+1 -0.30107 0.17731 0.16863 -0.10940 0.30405
243 14F-1 0.23218 0.17731 -0.10940 0.16863 -0.30405
244 14F+2 0.25898 -0.38083 0.08565 0.08565 0.00000
245 14F-2 0.00000 0.00000 0.63088 -0.63088 0.63088
246 14F+3 -0.23321 0.19402 -0.35756 0.14124 -0.25266
247 14F-3 -0.12318 -0.19402 -0.14124 0.35756 -0.25266
248 15G 0 -0.13298 0.00000 0.16021 -0.16021 0.20924
249 15G+1 -0.09700 0.03530 -0.09880 0.14004 0.02820
250 15G-1 0.07235 0.03530 0.14004 -0.09880 -0.02820
251 15G+2 0.11894 -0.23788 0.04386 0.04386 0.00000
252 15G-2 -0.18711 0.00000 0.15815 -0.15815 0.27943
253 15G+3 -0.16336 0.18668 -0.26139 0.11614 -0.17973
254 15G-3 0.02734 -0.18668 -0.11614 0.26139 -0.17973
255 15G+4 0.15734 0.00000 0.16855 -0.16855 0.11054
256 15G-4 -0.03298 0.07734 -0.08993 -0.08993 0.00000
257 5 H 1S 0.00000 0.00000 0.14977 -0.14977 -0.14977
258 2S 0.00000 0.00000 -2.47496 2.47496 2.47496
259 3S 0.00000 0.00000 8.42279 -8.42279 -8.42279
260 4S 0.00000 0.00000 4.35302 -4.35302 -4.35302
261 5S 0.00000 0.00000 0.01568 -0.01568 -0.01568
262 6PX 0.00000 0.48474 -0.01277 0.24060 0.01277
263 6PY 0.48474 0.48474 0.24060 -0.01277 -0.01277
264 6PZ 0.48474 0.00000 -0.01277 0.01277 0.24060
265 7PX 0.00000 -0.58007 -0.58865 0.26500 0.58865
266 7PY -0.58007 -0.58007 0.26500 -0.58865 -0.58865
267 7PZ -0.58007 0.00000 -0.58865 0.58865 0.26500
268 8PX 0.00000 -1.10477 3.09951 -3.67874 -3.09951
269 8PY -1.10477 -1.10477 -3.67874 3.09951 3.09951
270 8PZ -1.10477 0.00000 3.09951 -3.09951 -3.67874
271 9PX 0.00000 -0.12749 1.51407 -1.46672 -1.51407
272 9PY -0.12749 -0.12749 -1.46672 1.51407 1.51407
273 9PZ -0.12749 0.00000 1.51407 -1.51407 -1.46672
274 10D 0 0.26754 0.00000 0.04533 -0.04533 0.09066
275 10D+1 0.21287 0.21287 -0.39699 0.43880 0.43880
276 10D-1 0.00000 0.21287 0.43880 -0.39699 -0.43880
277 10D+2 0.15446 0.30892 0.07851 0.07851 0.00000
278 10D-2 0.21287 0.00000 0.43880 -0.43880 -0.39699
279 11D 0 -0.97789 0.00000 -0.20178 0.20178 -0.40356
280 11D+1 -0.77514 -0.77514 0.98571 -1.27090 -1.27090
281 11D-1 0.00000 -0.77514 -1.27090 0.98571 1.27090
282 11D+2 -0.56459 -1.12917 -0.34950 -0.34950 0.00000
283 11D-2 -0.77514 0.00000 -1.27090 1.27090 0.98571
284 12D 0 -0.26755 0.00000 -0.10448 0.10448 -0.20896
285 12D+1 -0.22809 -0.22809 1.01183 -0.95308 -0.95308
286 12D-1 0.00000 -0.22809 -0.95308 1.01183 0.95308
287 12D+2 -0.15447 -0.30895 -0.18097 -0.18097 0.00000
288 12D-2 -0.22809 0.00000 -0.95308 0.95308 1.01183
289 13F 0 -0.04195 0.00000 -0.16256 0.16256 0.11216
290 13F+1 -0.27049 -0.08178 0.02219 -0.06868 -0.17691
291 13F-1 0.13315 -0.08178 -0.06868 0.02219 0.17691
292 13F+2 -0.13593 -0.34214 -0.09786 -0.09786 0.00000
293 13F-2 0.00000 0.00000 -0.25906 0.25906 0.25906
294 13F+3 -0.20952 -0.11640 -0.18844 0.08867 0.06859
295 13F-3 -0.05008 0.11640 -0.08867 0.18844 0.06859
296 14F 0 -0.04480 0.00000 -0.38594 0.38594 0.17865
297 14F+1 -0.30107 -0.17731 0.16863 -0.10940 -0.30405
298 14F-1 0.23218 -0.17731 -0.10940 0.16863 0.30405
299 14F+2 -0.25898 -0.38083 -0.08565 -0.08565 0.00000
300 14F-2 0.00000 0.00000 -0.63088 0.63088 0.63088
301 14F+3 -0.23321 -0.19402 -0.35756 0.14124 0.25266
302 14F-3 -0.12318 0.19402 -0.14124 0.35756 0.25266
303 15G 0 0.13298 0.00000 -0.16021 0.16021 0.20924
304 15G+1 -0.09700 -0.03530 -0.09880 0.14004 -0.02820
305 15G-1 0.07235 -0.03530 0.14004 -0.09880 0.02820
306 15G+2 -0.11894 -0.23788 -0.04386 -0.04386 0.00000
307 15G-2 0.18711 0.00000 -0.15815 0.15815 0.27943
308 15G+3 -0.16336 -0.18668 -0.26139 0.11614 0.17973
309 15G-3 0.02734 0.18668 -0.11614 0.26139 0.17973
310 15G+4 -0.15734 0.00000 -0.16855 0.16855 0.11054
311 15G-4 0.03298 0.07734 0.08993 0.08993 0.00000
306 307 308 309 310
(A1)--V (A1)--V (T2)--V (T2)--V (T2)--V
Eigenvalues -- 19.12525 20.84862 20.86019 20.86019 20.86019
1 1 C 1S -0.11453 -0.13977 0.00000 0.00000 0.00000
2 2S -1.01463 0.17834 0.00000 0.00000 0.00000
3 3S -9.88921 0.55627 0.00000 0.00000 0.00000
4 4S 27.15772 5.45170 0.00000 0.00000 0.00000
5 5S 31.38909 3.61247 0.00000 0.00000 0.00000
6 6S 5.91488 1.91551 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 0.00000 -0.09923
8 7PY 0.00000 0.00000 -0.09923 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 -0.09923 0.00000
10 8PX 0.00000 0.00000 0.00000 0.00000 -2.86220
11 8PY 0.00000 0.00000 -2.86220 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 -2.86220 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 7.84547
14 9PY 0.00000 0.00000 7.84547 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 7.84547 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 3.65386
17 10PY 0.00000 0.00000 3.65386 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 3.65386 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 -0.02755
20 11PY 0.00000 0.00000 -0.02755 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 -0.02755 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 -0.67557 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 -0.67557
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 -0.67557 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.43878 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.43878
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.43878 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 4.30178 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 4.30178
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 4.30178 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00000 0.00000 1.16851 0.00000 0.00000
39 15D-1 0.00000 0.00000 0.00000 0.00000 1.16851
40 15D+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00000 0.00000 0.00000 1.16851 0.00000
42 16F 0 0.00000 0.00000 0.00000 0.12383 0.00000
43 16F+1 0.00000 0.00000 0.00000 0.00000 -0.07583
44 16F-1 0.00000 0.00000 -0.07583 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-2 1.86392 0.20437 0.00000 0.00000 0.00000
47 16F+3 0.00000 0.00000 0.00000 0.00000 0.09790
48 16F-3 0.00000 0.00000 -0.09790 0.00000 0.00000
49 17F 0 0.00000 0.00000 0.00000 -1.55614 0.00000
50 17F+1 0.00000 0.00000 0.00000 0.00000 0.95294
51 17F-1 0.00000 0.00000 0.95294 0.00000 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000 0.00000
53 17F-2 1.14928 -2.30588 0.00000 0.00000 0.00000
54 17F+3 0.00000 0.00000 0.00000 0.00000 -1.23024
55 17F-3 0.00000 0.00000 1.23024 0.00000 0.00000
56 18F 0 0.00000 0.00000 0.00000 -0.85199 0.00000
57 18F+1 0.00000 0.00000 0.00000 0.00000 0.52174
58 18F-1 0.00000 0.00000 0.52174 0.00000 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000 0.00000
60 18F-2 0.68622 -0.72203 0.00000 0.00000 0.00000
61 18F+3 0.00000 0.00000 0.00000 0.00000 -0.67356
62 18F-3 0.00000 0.00000 0.67356 0.00000 0.00000
63 19G 0 -0.39170 0.39258 0.00000 0.00000 0.00000
64 19G+1 0.00000 0.00000 -0.26911 0.00000 0.00000
65 19G-1 0.00000 0.00000 0.00000 0.00000 -0.26911
66 19G+2 0.00000 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00000 0.00000 0.00000 0.76117 0.00000
68 19G+3 0.00000 0.00000 -0.71201 0.00000 0.00000
69 19G-3 0.00000 0.00000 0.00000 0.00000 0.71201
70 19G+4 -0.33104 0.33179 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.65235 0.90617 0.00000 0.00000 0.00000
73 20G+1 0.00000 0.00000 -0.61275 0.00000 0.00000
74 20G-1 0.00000 0.00000 0.00000 0.00000 -0.61275
75 20G+2 0.00000 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00000 0.00000 0.00000 1.73311 0.00000
77 20G+3 0.00000 0.00000 -1.62118 0.00000 0.00000
78 20G-3 0.00000 0.00000 0.00000 0.00000 1.62118
79 20G+4 0.55134 0.76585 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 -0.37039 0.00000
82 21H+1 0.00000 0.00000 0.00000 0.00000 -0.66234
83 21H-1 0.00000 0.00000 -0.66234 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 -0.47712
87 21H-3 0.00000 0.00000 0.47712 0.00000 0.00000
88 21H+4 0.00000 0.00000 0.00000 -0.84325 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 -0.42651
91 21H-5 0.00000 0.00000 -0.42651 0.00000 0.00000
92 2 H 1S -0.19864 -0.75446 0.77739 0.77739 0.77739
93 2S 3.42113 2.98392 -2.97868 -2.97868 -2.97868
94 3S -12.36417 -1.84264 -2.06697 -2.06697 -2.06697
95 4S -4.72806 -1.58518 -1.03497 -1.03497 -1.03497
96 5S -0.27483 -0.05929 0.05090 0.05090 0.05090
97 6PX -0.03697 0.55559 -0.54712 -0.54712 -0.42944
98 6PY -0.03697 0.55559 -0.42944 -0.54712 -0.54712
99 6PZ -0.03697 0.55559 -0.54712 -0.42944 -0.54712
100 7PX -0.71378 -1.37890 1.44252 1.44252 1.21282
101 7PY -0.71378 -1.37890 1.21282 1.44252 1.44252
102 7PZ -0.71378 -1.37890 1.44252 1.21282 1.44252
103 8PX 4.77146 1.21771 0.04242 0.04242 -0.41660
104 8PY 4.77146 1.21771 -0.41660 0.04242 0.04242
105 8PZ 4.77146 1.21771 0.04242 -0.41660 0.04242
106 9PX 1.83783 0.59198 0.10756 0.10756 -0.13476
107 9PY 1.83783 0.59198 -0.13476 0.10756 0.10756
108 9PZ 1.83783 0.59198 0.10756 -0.13476 0.10756
109 10D 0 0.00000 0.00000 0.00442 -0.00885 0.00442
110 10D+1 0.50439 0.20093 -0.27203 -0.23073 -0.23073
111 10D-1 0.50439 0.20093 -0.23073 -0.23073 -0.27203
112 10D+2 0.00000 0.00000 0.00766 0.00000 -0.00766
113 10D-2 0.50439 0.20093 -0.23073 -0.27203 -0.23073
114 11D 0 0.00000 0.00000 -0.08513 0.17026 -0.08513
115 11D+1 -1.55571 -0.03277 -0.16535 -0.04946 -0.04946
116 11D-1 -1.55571 -0.03277 -0.04946 -0.04946 -0.16535
117 11D+2 0.00000 0.00000 -0.14745 0.00000 0.14745
118 11D-2 -1.55571 -0.03277 -0.04946 -0.16535 -0.04946
119 12D 0 0.00000 0.00000 -0.09459 0.18918 -0.09459
120 12D+1 -1.30213 -0.58122 0.30467 0.44634 0.44634
121 12D-1 -1.30213 -0.58122 0.44634 0.44634 0.30467
122 12D+2 0.00000 0.00000 -0.16383 0.00000 0.16383
123 12D-2 -1.30213 -0.58122 0.44634 0.30467 0.44634
124 13F 0 -0.18226 0.06118 -0.11316 -0.09850 -0.11316
125 13F+1 0.11161 -0.03746 0.11570 0.02289 0.06032
126 13F-1 0.11161 -0.03746 0.06032 0.02289 0.11570
127 13F+2 0.00000 0.00000 0.05870 0.00000 -0.05870
128 13F-2 0.35346 -0.13325 0.21992 0.21992 0.21992
129 13F+3 -0.14409 0.04836 -0.05352 -0.12541 -0.07787
130 13F-3 0.14409 -0.04836 0.07787 0.12541 0.05352
131 14F 0 -0.42984 -0.14389 0.13776 0.08982 0.13776
132 14F+1 0.26322 0.08812 -0.05894 -0.10977 -0.05500
133 14F-1 0.26322 0.08812 -0.05500 -0.10977 -0.05894
134 14F+2 0.00000 0.00000 0.03215 0.00000 -0.03215
135 14F-2 0.68158 0.15993 -0.27678 -0.27678 -0.27678
136 14F+3 -0.33982 -0.11376 0.12859 0.08922 0.07101
137 14F-3 0.33982 0.11376 -0.07101 -0.08922 -0.12859
138 15G 0 0.21968 0.04261 0.04049 0.00215 0.04049
139 15G+1 0.07075 -0.01468 -0.00300 0.02020 0.00590
140 15G-1 0.07075 -0.01468 0.00590 0.02020 -0.00300
141 15G+2 0.00000 0.00000 -0.03429 0.00000 0.03429
142 15G-2 -0.20012 0.04153 -0.03690 0.00849 -0.03690
143 15G+3 0.18719 -0.03885 -0.00794 0.03182 0.03722
144 15G-3 -0.18719 0.03885 -0.03722 -0.03182 0.00794
145 15G+4 0.18567 0.03602 0.00830 0.05366 0.00830
146 15G-4 0.00000 0.00000 -0.00764 0.00000 0.00764
147 3 H 1S -0.19864 -0.75446 -0.77739 0.77739 -0.77739
148 2S 3.42113 2.98392 2.97868 -2.97868 2.97868
149 3S -12.36417 -1.84264 2.06697 -2.06697 2.06697
150 4S -4.72806 -1.58518 1.03497 -1.03497 1.03497
151 5S -0.27483 -0.05929 -0.05090 0.05090 -0.05090
152 6PX 0.03697 -0.55559 -0.54712 0.54712 -0.42944
153 6PY 0.03697 -0.55559 -0.42944 0.54712 -0.54712
154 6PZ -0.03697 0.55559 0.54712 -0.42944 0.54712
155 7PX 0.71378 1.37890 1.44252 -1.44252 1.21282
156 7PY 0.71378 1.37890 1.21282 -1.44252 1.44252
157 7PZ -0.71378 -1.37890 -1.44252 1.21282 -1.44252
158 8PX -4.77146 -1.21771 0.04242 -0.04242 -0.41660
159 8PY -4.77146 -1.21771 -0.41660 -0.04242 0.04242
160 8PZ 4.77146 1.21771 -0.04242 -0.41660 -0.04242
161 9PX -1.83783 -0.59198 0.10756 -0.10756 -0.13476
162 9PY -1.83783 -0.59198 -0.13476 -0.10756 0.10756
163 9PZ 1.83783 0.59198 -0.10756 -0.13476 -0.10756
164 10D 0 0.00000 0.00000 -0.00442 -0.00885 -0.00442
165 10D+1 -0.50439 -0.20093 -0.27203 0.23073 -0.23073
166 10D-1 -0.50439 -0.20093 -0.23073 0.23073 -0.27203
167 10D+2 0.00000 0.00000 -0.00766 0.00000 0.00766
168 10D-2 0.50439 0.20093 0.23073 -0.27203 0.23073
169 11D 0 0.00000 0.00000 0.08513 0.17026 0.08513
170 11D+1 1.55571 0.03277 -0.16535 0.04946 -0.04946
171 11D-1 1.55571 0.03277 -0.04946 0.04946 -0.16535
172 11D+2 0.00000 0.00000 0.14745 0.00000 -0.14745
173 11D-2 -1.55571 -0.03277 0.04946 -0.16535 0.04946
174 12D 0 0.00000 0.00000 0.09459 0.18918 0.09459
175 12D+1 1.30213 0.58122 0.30467 -0.44634 0.44634
176 12D-1 1.30213 0.58122 0.44634 -0.44634 0.30467
177 12D+2 0.00000 0.00000 0.16383 0.00000 -0.16383
178 12D-2 -1.30213 -0.58122 -0.44634 0.30467 -0.44634
179 13F 0 -0.18226 0.06118 0.11316 -0.09850 0.11316
180 13F+1 -0.11161 0.03746 0.11570 -0.02289 0.06032
181 13F-1 -0.11161 0.03746 0.06032 -0.02289 0.11570
182 13F+2 0.00000 0.00000 -0.05870 0.00000 0.05870
183 13F-2 0.35346 -0.13325 -0.21992 0.21992 -0.21992
184 13F+3 0.14409 -0.04836 -0.05352 0.12541 -0.07787
185 13F-3 -0.14409 0.04836 0.07787 -0.12541 0.05352
186 14F 0 -0.42984 -0.14389 -0.13776 0.08982 -0.13776
187 14F+1 -0.26322 -0.08812 -0.05894 0.10977 -0.05500
188 14F-1 -0.26322 -0.08812 -0.05500 0.10977 -0.05894
189 14F+2 0.00000 0.00000 -0.03215 0.00000 0.03215
190 14F-2 0.68158 0.15993 0.27678 -0.27678 0.27678
191 14F+3 0.33982 0.11376 0.12859 -0.08922 0.07101
192 14F-3 -0.33982 -0.11376 -0.07101 0.08922 -0.12859
193 15G 0 0.21968 0.04261 -0.04049 0.00215 -0.04049
194 15G+1 -0.07075 0.01468 -0.00300 -0.02020 0.00590
195 15G-1 -0.07075 0.01468 0.00590 -0.02020 -0.00300
196 15G+2 0.00000 0.00000 0.03429 0.00000 -0.03429
197 15G-2 -0.20012 0.04153 0.03690 0.00849 0.03690
198 15G+3 -0.18719 0.03885 -0.00794 -0.03182 0.03722
199 15G-3 0.18719 -0.03885 -0.03722 0.03182 0.00794
200 15G+4 0.18567 0.03602 -0.00830 0.05366 -0.00830
201 15G-4 0.00000 0.00000 0.00764 0.00000 -0.00764
202 4 H 1S -0.19864 -0.75446 -0.77739 -0.77739 0.77739
203 2S 3.42113 2.98392 2.97868 2.97868 -2.97868
204 3S -12.36417 -1.84264 2.06697 2.06697 -2.06697
205 4S -4.72806 -1.58518 1.03497 1.03497 -1.03497
206 5S -0.27483 -0.05929 -0.05090 -0.05090 0.05090
207 6PX -0.03697 0.55559 0.54712 0.54712 -0.42944
208 6PY 0.03697 -0.55559 -0.42944 -0.54712 0.54712
209 6PZ 0.03697 -0.55559 -0.54712 -0.42944 0.54712
210 7PX -0.71378 -1.37890 -1.44252 -1.44252 1.21282
211 7PY 0.71378 1.37890 1.21282 1.44252 -1.44252
212 7PZ 0.71378 1.37890 1.44252 1.21282 -1.44252
213 8PX 4.77146 1.21771 -0.04242 -0.04242 -0.41660
214 8PY -4.77146 -1.21771 -0.41660 0.04242 -0.04242
215 8PZ -4.77146 -1.21771 0.04242 -0.41660 -0.04242
216 9PX 1.83783 0.59198 -0.10756 -0.10756 -0.13476
217 9PY -1.83783 -0.59198 -0.13476 0.10756 -0.10756
218 9PZ -1.83783 -0.59198 0.10756 -0.13476 -0.10756
219 10D 0 0.00000 0.00000 -0.00442 0.00885 0.00442
220 10D+1 -0.50439 -0.20093 -0.27203 -0.23073 0.23073
221 10D-1 0.50439 0.20093 0.23073 0.23073 -0.27203
222 10D+2 0.00000 0.00000 -0.00766 0.00000 -0.00766
223 10D-2 -0.50439 -0.20093 -0.23073 -0.27203 0.23073
224 11D 0 0.00000 0.00000 0.08513 -0.17026 -0.08513
225 11D+1 1.55571 0.03277 -0.16535 -0.04946 0.04946
226 11D-1 -1.55571 -0.03277 0.04946 0.04946 -0.16535
227 11D+2 0.00000 0.00000 0.14745 0.00000 0.14745
228 11D-2 1.55571 0.03277 -0.04946 -0.16535 0.04946
229 12D 0 0.00000 0.00000 0.09459 -0.18918 -0.09459
230 12D+1 1.30213 0.58122 0.30467 0.44634 -0.44634
231 12D-1 -1.30213 -0.58122 -0.44634 -0.44634 0.30467
232 12D+2 0.00000 0.00000 0.16383 0.00000 0.16383
233 12D-2 1.30213 0.58122 0.44634 0.30467 -0.44634
234 13F 0 0.18226 -0.06118 -0.11316 -0.09850 0.11316
235 13F+1 0.11161 -0.03746 -0.11570 -0.02289 0.06032
236 13F-1 -0.11161 0.03746 0.06032 0.02289 -0.11570
237 13F+2 0.00000 0.00000 0.05870 0.00000 0.05870
238 13F-2 0.35346 -0.13325 -0.21992 -0.21992 0.21992
239 13F+3 -0.14409 0.04836 0.05352 0.12541 -0.07787
240 13F-3 -0.14409 0.04836 0.07787 0.12541 -0.05352
241 14F 0 0.42984 0.14389 0.13776 0.08982 -0.13776
242 14F+1 0.26322 0.08812 0.05894 0.10977 -0.05500
243 14F-1 -0.26322 -0.08812 -0.05500 -0.10977 0.05894
244 14F+2 0.00000 0.00000 0.03215 0.00000 0.03215
245 14F-2 0.68158 0.15993 0.27678 0.27678 -0.27678
246 14F+3 -0.33982 -0.11376 -0.12859 -0.08922 0.07101
247 14F-3 -0.33982 -0.11376 -0.07101 -0.08922 0.12859
248 15G 0 0.21968 0.04261 -0.04049 -0.00215 0.04049
249 15G+1 -0.07075 0.01468 -0.00300 0.02020 -0.00590
250 15G-1 0.07075 -0.01468 -0.00590 -0.02020 -0.00300
251 15G+2 0.00000 0.00000 0.03429 0.00000 0.03429
252 15G-2 0.20012 -0.04153 -0.03690 0.00849 0.03690
253 15G+3 -0.18719 0.03885 -0.00794 0.03182 -0.03722
254 15G-3 -0.18719 0.03885 0.03722 0.03182 0.00794
255 15G+4 0.18567 0.03602 -0.00830 -0.05366 0.00830
256 15G-4 0.00000 0.00000 -0.00764 0.00000 -0.00764
257 5 H 1S -0.19864 -0.75446 0.77739 -0.77739 -0.77739
258 2S 3.42113 2.98392 -2.97868 2.97868 2.97868
259 3S -12.36417 -1.84264 -2.06697 2.06697 2.06697
260 4S -4.72806 -1.58518 -1.03497 1.03497 1.03497
261 5S -0.27483 -0.05929 0.05090 -0.05090 -0.05090
262 6PX 0.03697 -0.55559 0.54712 -0.54712 -0.42944
263 6PY -0.03697 0.55559 -0.42944 0.54712 0.54712
264 6PZ 0.03697 -0.55559 0.54712 -0.42944 -0.54712
265 7PX 0.71378 1.37890 -1.44252 1.44252 1.21282
266 7PY -0.71378 -1.37890 1.21282 -1.44252 -1.44252
267 7PZ 0.71378 1.37890 -1.44252 1.21282 1.44252
268 8PX -4.77146 -1.21771 -0.04242 0.04242 -0.41660
269 8PY 4.77146 1.21771 -0.41660 -0.04242 -0.04242
270 8PZ -4.77146 -1.21771 -0.04242 -0.41660 0.04242
271 9PX -1.83783 -0.59198 -0.10756 0.10756 -0.13476
272 9PY 1.83783 0.59198 -0.13476 -0.10756 -0.10756
273 9PZ -1.83783 -0.59198 -0.10756 -0.13476 0.10756
274 10D 0 0.00000 0.00000 0.00442 0.00885 -0.00442
275 10D+1 0.50439 0.20093 -0.27203 0.23073 0.23073
276 10D-1 -0.50439 -0.20093 0.23073 -0.23073 -0.27203
277 10D+2 0.00000 0.00000 0.00766 0.00000 0.00766
278 10D-2 -0.50439 -0.20093 0.23073 -0.27203 -0.23073
279 11D 0 0.00000 0.00000 -0.08513 -0.17026 0.08513
280 11D+1 -1.55571 -0.03277 -0.16535 0.04946 0.04946
281 11D-1 1.55571 0.03277 0.04946 -0.04946 -0.16535
282 11D+2 0.00000 0.00000 -0.14745 0.00000 -0.14745
283 11D-2 1.55571 0.03277 0.04946 -0.16535 -0.04946
284 12D 0 0.00000 0.00000 -0.09459 -0.18918 0.09459
285 12D+1 -1.30213 -0.58122 0.30467 -0.44634 -0.44634
286 12D-1 1.30213 0.58122 -0.44634 0.44634 0.30467
287 12D+2 0.00000 0.00000 -0.16383 0.00000 -0.16383
288 12D-2 1.30213 0.58122 -0.44634 0.30467 0.44634
289 13F 0 0.18226 -0.06118 0.11316 -0.09850 -0.11316
290 13F+1 -0.11161 0.03746 -0.11570 0.02289 0.06032
291 13F-1 0.11161 -0.03746 0.06032 -0.02289 -0.11570
292 13F+2 0.00000 0.00000 -0.05870 0.00000 -0.05870
293 13F-2 0.35346 -0.13325 0.21992 -0.21992 -0.21992
294 13F+3 0.14409 -0.04836 0.05352 -0.12541 -0.07787
295 13F-3 0.14409 -0.04836 0.07787 -0.12541 -0.05352
296 14F 0 0.42984 0.14389 -0.13776 0.08982 0.13776
297 14F+1 -0.26322 -0.08812 0.05894 -0.10977 -0.05500
298 14F-1 0.26322 0.08812 -0.05500 0.10977 0.05894
299 14F+2 0.00000 0.00000 -0.03215 0.00000 -0.03215
300 14F-2 0.68158 0.15993 -0.27678 0.27678 0.27678
301 14F+3 0.33982 0.11376 -0.12859 0.08922 0.07101
302 14F-3 0.33982 0.11376 -0.07101 0.08922 0.12859
303 15G 0 0.21968 0.04261 0.04049 -0.00215 -0.04049
304 15G+1 0.07075 -0.01468 -0.00300 -0.02020 -0.00590
305 15G-1 -0.07075 0.01468 -0.00590 0.02020 -0.00300
306 15G+2 0.00000 0.00000 -0.03429 0.00000 -0.03429
307 15G-2 0.20012 -0.04153 0.03690 0.00849 -0.03690
308 15G+3 0.18719 -0.03885 -0.00794 -0.03182 -0.03722
309 15G-3 0.18719 -0.03885 0.03722 -0.03182 0.00794
310 15G+4 0.18567 0.03602 0.00830 -0.05366 -0.00830
311 15G-4 0.00000 0.00000 0.00764 0.00000 0.00764
311
(A1)--V
Eigenvalues -- 43.12644
1 1 C 1S -2.96028
2 2S -6.67544
3 3S -12.15887
4 4S 13.62926
5 5S 34.63540
6 6S 6.63568
7 7PX 0.00000
8 7PY 0.00000
9 7PZ 0.00000
10 8PX 0.00000
11 8PY 0.00000
12 8PZ 0.00000
13 9PX 0.00000
14 9PY 0.00000
15 9PZ 0.00000
16 10PX 0.00000
17 10PY 0.00000
18 10PZ 0.00000
19 11PX 0.00000
20 11PY 0.00000
21 11PZ 0.00000
22 12D 0 0.00000
23 12D+1 0.00000
24 12D-1 0.00000
25 12D+2 0.00000
26 12D-2 0.00000
27 13D 0 0.00000
28 13D+1 0.00000
29 13D-1 0.00000
30 13D+2 0.00000
31 13D-2 0.00000
32 14D 0 0.00000
33 14D+1 0.00000
34 14D-1 0.00000
35 14D+2 0.00000
36 14D-2 0.00000
37 15D 0 0.00000
38 15D+1 0.00000
39 15D-1 0.00000
40 15D+2 0.00000
41 15D-2 0.00000
42 16F 0 0.00000
43 16F+1 0.00000
44 16F-1 0.00000
45 16F+2 0.00000
46 16F-2 -0.01214
47 16F+3 0.00000
48 16F-3 0.00000
49 17F 0 0.00000
50 17F+1 0.00000
51 17F-1 0.00000
52 17F+2 0.00000
53 17F-2 3.38583
54 17F+3 0.00000
55 17F-3 0.00000
56 18F 0 0.00000
57 18F+1 0.00000
58 18F-1 0.00000
59 18F+2 0.00000
60 18F-2 1.85924
61 18F+3 0.00000
62 18F-3 0.00000
63 19G 0 -0.27515
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 0.00000
70 19G+4 -0.23254
71 19G-4 0.00000
72 20G 0 -0.44620
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 0.00000
79 20G+4 -0.37710
80 20G-4 0.00000
81 21H 0 0.00000
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 0.00000
88 21H+4 0.00000
89 21H-4 0.00000
90 21H+5 0.00000
91 21H-5 0.00000
92 2 H 1S 0.15368
93 2S 0.48943
94 3S -9.60948
95 4S -5.04624
96 5S -0.25559
97 6PX -0.06699
98 6PY -0.06699
99 6PZ -0.06699
100 7PX 0.09051
101 7PY 0.09051
102 7PZ 0.09051
103 8PX 2.96340
104 8PY 2.96340
105 8PZ 2.96340
106 9PX 1.63677
107 9PY 1.63677
108 9PZ 1.63677
109 10D 0 0.00000
110 10D+1 0.05783
111 10D-1 0.05783
112 10D+2 0.00000
113 10D-2 0.05783
114 11D 0 0.00000
115 11D+1 -0.68754
116 11D-1 -0.68754
117 11D+2 0.00000
118 11D-2 -0.68754
119 12D 0 0.00000
120 12D+1 -0.74205
121 12D-1 -0.74205
122 12D+2 0.00000
123 12D-2 -0.74205
124 13F 0 -0.04569
125 13F+1 0.02798
126 13F-1 0.02798
127 13F+2 0.00000
128 13F-2 0.09646
129 13F+3 -0.03612
130 13F-3 0.03612
131 14F 0 -0.15314
132 14F+1 0.09378
133 14F-1 0.09378
134 14F+2 0.00000
135 14F-2 0.26574
136 14F+3 -0.12107
137 14F-3 0.12107
138 15G 0 0.00160
139 15G+1 -0.00137
140 15G-1 -0.00137
141 15G+2 0.00000
142 15G-2 0.00387
143 15G+3 -0.00362
144 15G-3 0.00362
145 15G+4 0.00136
146 15G-4 0.00000
147 3 H 1S 0.15368
148 2S 0.48943
149 3S -9.60948
150 4S -5.04624
151 5S -0.25559
152 6PX 0.06699
153 6PY 0.06699
154 6PZ -0.06699
155 7PX -0.09051
156 7PY -0.09051
157 7PZ 0.09051
158 8PX -2.96340
159 8PY -2.96340
160 8PZ 2.96340
161 9PX -1.63677
162 9PY -1.63677
163 9PZ 1.63677
164 10D 0 0.00000
165 10D+1 -0.05783
166 10D-1 -0.05783
167 10D+2 0.00000
168 10D-2 0.05783
169 11D 0 0.00000
170 11D+1 0.68754
171 11D-1 0.68754
172 11D+2 0.00000
173 11D-2 -0.68754
174 12D 0 0.00000
175 12D+1 0.74205
176 12D-1 0.74205
177 12D+2 0.00000
178 12D-2 -0.74205
179 13F 0 -0.04569
180 13F+1 -0.02798
181 13F-1 -0.02798
182 13F+2 0.00000
183 13F-2 0.09646
184 13F+3 0.03612
185 13F-3 -0.03612
186 14F 0 -0.15314
187 14F+1 -0.09378
188 14F-1 -0.09378
189 14F+2 0.00000
190 14F-2 0.26574
191 14F+3 0.12107
192 14F-3 -0.12107
193 15G 0 0.00160
194 15G+1 0.00137
195 15G-1 0.00137
196 15G+2 0.00000
197 15G-2 0.00387
198 15G+3 0.00362
199 15G-3 -0.00362
200 15G+4 0.00136
201 15G-4 0.00000
202 4 H 1S 0.15368
203 2S 0.48943
204 3S -9.60948
205 4S -5.04624
206 5S -0.25559
207 6PX -0.06699
208 6PY 0.06699
209 6PZ 0.06699
210 7PX 0.09051
211 7PY -0.09051
212 7PZ -0.09051
213 8PX 2.96340
214 8PY -2.96340
215 8PZ -2.96340
216 9PX 1.63677
217 9PY -1.63677
218 9PZ -1.63677
219 10D 0 0.00000
220 10D+1 -0.05783
221 10D-1 0.05783
222 10D+2 0.00000
223 10D-2 -0.05783
224 11D 0 0.00000
225 11D+1 0.68754
226 11D-1 -0.68754
227 11D+2 0.00000
228 11D-2 0.68754
229 12D 0 0.00000
230 12D+1 0.74205
231 12D-1 -0.74205
232 12D+2 0.00000
233 12D-2 0.74205
234 13F 0 0.04569
235 13F+1 0.02798
236 13F-1 -0.02798
237 13F+2 0.00000
238 13F-2 0.09646
239 13F+3 -0.03612
240 13F-3 -0.03612
241 14F 0 0.15314
242 14F+1 0.09378
243 14F-1 -0.09378
244 14F+2 0.00000
245 14F-2 0.26574
246 14F+3 -0.12107
247 14F-3 -0.12107
248 15G 0 0.00160
249 15G+1 0.00137
250 15G-1 -0.00137
251 15G+2 0.00000
252 15G-2 -0.00387
253 15G+3 0.00362
254 15G-3 0.00362
255 15G+4 0.00136
256 15G-4 0.00000
257 5 H 1S 0.15368
258 2S 0.48943
259 3S -9.60948
260 4S -5.04624
261 5S -0.25559
262 6PX 0.06699
263 6PY -0.06699
264 6PZ 0.06699
265 7PX -0.09051
266 7PY 0.09051
267 7PZ -0.09051
268 8PX -2.96340
269 8PY 2.96340
270 8PZ -2.96340
271 9PX -1.63677
272 9PY 1.63677
273 9PZ -1.63677
274 10D 0 0.00000
275 10D+1 0.05783
276 10D-1 -0.05783
277 10D+2 0.00000
278 10D-2 -0.05783
279 11D 0 0.00000
280 11D+1 -0.68754
281 11D-1 0.68754
282 11D+2 0.00000
283 11D-2 0.68754
284 12D 0 0.00000
285 12D+1 -0.74205
286 12D-1 0.74205
287 12D+2 0.00000
288 12D-2 0.74205
289 13F 0 0.04569
290 13F+1 -0.02798
291 13F-1 0.02798
292 13F+2 0.00000
293 13F-2 0.09646
294 13F+3 0.03612
295 13F-3 0.03612
296 14F 0 0.15314
297 14F+1 -0.09378
298 14F-1 0.09378
299 14F+2 0.00000
300 14F-2 0.26574
301 14F+3 0.12107
302 14F-3 0.12107
303 15G 0 0.00160
304 15G+1 -0.00137
305 15G-1 0.00137
306 15G+2 0.00000
307 15G-2 -0.00387
308 15G+3 -0.00362
309 15G-3 -0.00362
310 15G+4 0.00136
311 15G-4 0.00000
Alpha Density Matrix:
1 2 3 4 5
1 1 C 1S 0.33020
2 2S -0.25456 0.20449
3 3S 0.04726 -0.03718 0.00683
4 4S -0.02442 0.04141 -0.00553 0.06366
5 5S -0.03352 0.05571 -0.00749 0.08429 0.11162
6 6S -0.00689 0.01137 -0.00153 0.01711 0.02266
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
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Beta Density Matrix:
1 2 3 4 5
1 1 C 1S 0.33020
2 2S -0.25456 0.20449
3 3S 0.04726 -0.03718 0.00683
4 4S -0.02442 0.04141 -0.00553 0.06366
5 5S -0.03352 0.05571 -0.00749 0.08429 0.11162
6 6S -0.00689 0.01137 -0.00153 0.01711 0.02266
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62 18F-3 0.00000 0.00000 0.00000 0.00000 0.00000
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72 20G 0 0.00012 -0.00023 0.00003 -0.00037 -0.00048
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78 20G-3 0.00000 0.00000 0.00000 0.00000 0.00000
79 20G+4 0.00011 -0.00019 0.00002 -0.00031 -0.00041
80 20G-4 0.00000 0.00000 0.00000 0.00000 0.00000
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93 2S -0.00457 0.00758 -0.00102 0.01145 0.01516
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95 4S -0.00591 0.00977 -0.00131 0.01471 0.01949
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101 7PY 0.00017 -0.00029 0.00004 -0.00044 -0.00059
102 7PZ 0.00017 -0.00029 0.00004 -0.00044 -0.00059
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104 8PY 0.00071 -0.00124 0.00016 -0.00195 -0.00258
105 8PZ 0.00071 -0.00124 0.00016 -0.00195 -0.00258
106 9PX 0.00047 -0.00079 0.00011 -0.00120 -0.00160
107 9PY 0.00047 -0.00079 0.00011 -0.00120 -0.00160
108 9PZ 0.00047 -0.00079 0.00011 -0.00120 -0.00160
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111 10D-1 -0.00002 0.00003 0.00000 0.00004 0.00005
112 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
113 10D-2 -0.00002 0.00003 0.00000 0.00004 0.00005
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115 11D+1 -0.00005 0.00010 -0.00001 0.00018 0.00024
116 11D-1 -0.00005 0.00010 -0.00001 0.00018 0.00024
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119 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
120 12D+1 -0.00014 0.00026 -0.00003 0.00042 0.00056
121 12D-1 -0.00014 0.00026 -0.00003 0.00042 0.00056
122 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
123 12D-2 -0.00014 0.00026 -0.00003 0.00042 0.00056
124 13F 0 0.00000 0.00001 0.00000 0.00002 0.00002
125 13F+1 0.00000 -0.00001 0.00000 -0.00001 -0.00001
126 13F-1 0.00000 -0.00001 0.00000 -0.00001 -0.00001
127 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
128 13F-2 0.00001 -0.00002 0.00000 -0.00003 -0.00004
129 13F+3 0.00000 0.00001 0.00000 0.00001 0.00002
130 13F-3 0.00000 -0.00001 0.00000 -0.00001 -0.00002
131 14F 0 -0.00001 0.00002 0.00000 0.00004 0.00006
132 14F+1 0.00000 -0.00001 0.00000 -0.00003 -0.00003
133 14F-1 0.00000 -0.00001 0.00000 -0.00003 -0.00003
134 14F+2 0.00000 0.00000 0.00000 0.00000 0.00000
135 14F-2 0.00000 -0.00002 0.00000 -0.00006 -0.00007
136 14F+3 -0.00001 0.00002 0.00000 0.00003 0.00004
137 14F-3 0.00001 -0.00002 0.00000 -0.00003 -0.00004
138 15G 0 0.00000 0.00000 0.00000 -0.00001 -0.00001
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141 15G+2 0.00000 0.00000 0.00000 0.00000 0.00000
142 15G-2 0.00000 0.00000 0.00000 0.00001 0.00001
143 15G+3 0.00000 0.00000 0.00000 -0.00001 -0.00001
144 15G-3 0.00000 0.00000 0.00000 0.00001 0.00001
145 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
146 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
147 3 H 1S -0.00201 0.00334 -0.00045 0.00507 0.00672
148 2S -0.00457 0.00758 -0.00102 0.01145 0.01516
149 3S -0.00863 0.01438 -0.00193 0.02180 0.02886
150 4S -0.00591 0.00977 -0.00131 0.01471 0.01949
151 5S -0.00035 0.00058 -0.00008 0.00087 0.00116
152 6PX -0.00005 0.00009 -0.00001 0.00015 0.00019
153 6PY -0.00005 0.00009 -0.00001 0.00015 0.00019
154 6PZ 0.00005 -0.00009 0.00001 -0.00015 -0.00019
155 7PX -0.00017 0.00029 -0.00004 0.00044 0.00059
156 7PY -0.00017 0.00029 -0.00004 0.00044 0.00059
157 7PZ 0.00017 -0.00029 0.00004 -0.00044 -0.00059
158 8PX -0.00071 0.00124 -0.00016 0.00195 0.00258
159 8PY -0.00071 0.00124 -0.00016 0.00195 0.00258
160 8PZ 0.00071 -0.00124 0.00016 -0.00195 -0.00258
161 9PX -0.00047 0.00079 -0.00011 0.00120 0.00160
162 9PY -0.00047 0.00079 -0.00011 0.00120 0.00160
163 9PZ 0.00047 -0.00079 0.00011 -0.00120 -0.00160
164 10D 0 0.00000 0.00000 0.00000 0.00000 0.00000
165 10D+1 0.00002 -0.00003 0.00000 -0.00004 -0.00005
166 10D-1 0.00002 -0.00003 0.00000 -0.00004 -0.00005
167 10D+2 0.00000 0.00000 0.00000 0.00000 0.00000
168 10D-2 -0.00002 0.00003 0.00000 0.00004 0.00005
169 11D 0 0.00000 0.00000 0.00000 0.00000 0.00000
170 11D+1 0.00005 -0.00010 0.00001 -0.00018 -0.00024
171 11D-1 0.00005 -0.00010 0.00001 -0.00018 -0.00024
172 11D+2 0.00000 0.00000 0.00000 0.00000 0.00000
173 11D-2 -0.00005 0.00010 -0.00001 0.00018 0.00024
174 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
175 12D+1 0.00014 -0.00026 0.00003 -0.00042 -0.00056
176 12D-1 0.00014 -0.00026 0.00003 -0.00042 -0.00056
177 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
178 12D-2 -0.00014 0.00026 -0.00003 0.00042 0.00056
179 13F 0 0.00000 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 0.00001 0.00000 0.00001 0.00001
182 13F+2 0.00000 0.00000 0.00000 0.00000 0.00000
183 13F-2 0.00001 -0.00002 0.00000 -0.00003 -0.00004
184 13F+3 0.00000 -0.00001 0.00000 -0.00001 -0.00002
185 13F-3 0.00000 0.00001 0.00000 0.00001 0.00002
186 14F 0 -0.00001 0.00002 0.00000 0.00004 0.00006
187 14F+1 0.00000 0.00001 0.00000 0.00003 0.00003
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191 14F+3 0.00001 -0.00002 0.00000 -0.00003 -0.00004
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199 15G-3 0.00000 0.00000 0.00000 -0.00001 -0.00001
200 15G+4 0.00000 0.00000 0.00000 -0.00001 -0.00001
201 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
202 4 H 1S -0.00201 0.00334 -0.00045 0.00507 0.00672
203 2S -0.00457 0.00758 -0.00102 0.01145 0.01516
204 3S -0.00863 0.01438 -0.00193 0.02180 0.02886
205 4S -0.00591 0.00977 -0.00131 0.01471 0.01949
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311
311 15G-4 0.00000
Full Mulliken population analysis:
1 2 3 4 5
1 1 C 1S 0.66039
2 2S 0.42311 0.40898
3 3S 0.04665 0.06147 0.01366
4 4S -0.01329 -0.04417 -0.00935 0.12731
5 5S -0.00969 -0.03392 -0.00839 0.14500 0.22323
6 6S -0.00102 -0.00368 -0.00098 0.01966 0.03894
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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
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19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
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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
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307 15G-2 0.00000 0.00000 0.00000 0.00000 0.00000
308 15G+3 0.00000 0.00000 0.00000 0.00000 0.00000
309 15G-3 0.00000 0.00000 0.00000 0.00000 0.00000
310 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
311 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
306 307 308 309 310
306 15G+2 0.00000
307 15G-2 0.00000 0.00000
308 15G+3 0.00000 0.00000 0.00000
309 15G-3 0.00000 0.00000 0.00000 0.00000
310 15G+4 0.00000 0.00000 0.00000 0.00000 0.00000
311 15G-4 0.00000 0.00000 0.00000 0.00000 0.00000
311
311 15G-4 0.00000
Gross orbital populations:
Total Alpha Beta Spin
1 1 C 1S 1.09951 0.54976 0.54976 0.00000
2 2S 0.78691 0.39345 0.39345 0.00000
3 3S 0.09615 0.04808 0.04808 0.00000
4 4S 0.37300 0.18650 0.18650 0.00000
5 5S 0.63272 0.31636 0.31636 0.00000
6 6S 0.11890 0.05945 0.05945 0.00000
7 7PX 0.06348 0.03174 0.03174 0.00000
8 7PY 0.06348 0.03174 0.03174 0.00000
9 7PZ 0.06348 0.03174 0.03174 0.00000
10 8PX 0.19710 0.09855 0.09855 0.00000
11 8PY 0.19710 0.09855 0.09855 0.00000
12 8PZ 0.19710 0.09855 0.09855 0.00000
13 9PX 0.38865 0.19432 0.19432 0.00000
14 9PY 0.38865 0.19432 0.19432 0.00000
15 9PZ 0.38865 0.19432 0.19432 0.00000
16 10PX 0.26410 0.13205 0.13205 0.00000
17 10PY 0.26410 0.13205 0.13205 0.00000
18 10PZ 0.26410 0.13205 0.13205 0.00000
19 11PX 0.05048 0.02524 0.02524 0.00000
20 11PY 0.05048 0.02524 0.02524 0.00000
21 11PZ 0.05048 0.02524 0.02524 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00020 0.00010 0.00010 0.00000
24 12D-1 0.00020 0.00010 0.00010 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00020 0.00010 0.00010 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00226 0.00113 0.00113 0.00000
29 13D-1 0.00226 0.00113 0.00113 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00226 0.00113 0.00113 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.01129 0.00565 0.00565 0.00000
34 14D-1 0.01129 0.00565 0.00565 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.01129 0.00565 0.00565 0.00000
37 15D 0 0.00000 0.00000 0.00000 0.00000
38 15D+1 0.00590 0.00295 0.00295 0.00000
39 15D-1 0.00590 0.00295 0.00295 0.00000
40 15D+2 0.00000 0.00000 0.00000 0.00000
41 15D-2 0.00590 0.00295 0.00295 0.00000
42 16F 0 0.00002 0.00001 0.00001 0.00000
43 16F+1 0.00001 0.00000 0.00000 0.00000
44 16F-1 0.00001 0.00000 0.00000 0.00000
45 16F+2 0.00000 0.00000 0.00000 0.00000
46 16F-2 0.00009 0.00004 0.00004 0.00000
47 16F+3 0.00001 0.00001 0.00001 0.00000
48 16F-3 0.00001 0.00001 0.00001 0.00000
49 17F 0 0.00026 0.00013 0.00013 0.00000
50 17F+1 0.00010 0.00005 0.00005 0.00000
51 17F-1 0.00010 0.00005 0.00005 0.00000
52 17F+2 0.00000 0.00000 0.00000 0.00000
53 17F-2 0.00136 0.00068 0.00068 0.00000
54 17F+3 0.00016 0.00008 0.00008 0.00000
55 17F-3 0.00016 0.00008 0.00008 0.00000
56 18F 0 0.00048 0.00024 0.00024 0.00000
57 18F+1 0.00018 0.00009 0.00009 0.00000
58 18F-1 0.00018 0.00009 0.00009 0.00000
59 18F+2 0.00000 0.00000 0.00000 0.00000
60 18F-2 0.00197 0.00099 0.00099 0.00000
61 18F+3 0.00030 0.00015 0.00015 0.00000
62 18F-3 0.00030 0.00015 0.00015 0.00000
63 19G 0 0.00001 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
66 19G+2 0.00000 0.00000 0.00000 0.00000
67 19G-2 0.00003 0.00001 0.00001 0.00000
68 19G+3 0.00002 0.00001 0.00001 0.00000
69 19G-3 0.00002 0.00001 0.00001 0.00000
70 19G+4 0.00001 0.00000 0.00000 0.00000
71 19G-4 0.00000 0.00000 0.00000 0.00000
72 20G 0 0.00014 0.00007 0.00007 0.00000
73 20G+1 0.00006 0.00003 0.00003 0.00000
74 20G-1 0.00006 0.00003 0.00003 0.00000
75 20G+2 0.00000 0.00000 0.00000 0.00000
76 20G-2 0.00045 0.00023 0.00023 0.00000
77 20G+3 0.00040 0.00020 0.00020 0.00000
78 20G-3 0.00040 0.00020 0.00020 0.00000
79 20G+4 0.00010 0.00005 0.00005 0.00000
80 20G-4 0.00000 0.00000 0.00000 0.00000
81 21H 0 0.00001 0.00000 0.00000 0.00000
82 21H+1 0.00002 0.00001 0.00001 0.00000
83 21H-1 0.00002 0.00001 0.00001 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 0.00003 0.00001 0.00001 0.00000
89 21H-4 0.00000 0.00000 0.00000 0.00000
90 21H+5 0.00001 0.00001 0.00001 0.00000
91 21H-5 0.00001 0.00001 0.00001 0.00000
92 2 H 1S 0.03631 0.01815 0.01815 0.00000
93 2S 0.14922 0.07461 0.07461 0.00000
94 3S 0.39031 0.19515 0.19515 0.00000
95 4S 0.32791 0.16395 0.16395 0.00000
96 5S 0.03287 0.01644 0.01644 0.00000
97 6PX 0.00010 0.00005 0.00005 0.00000
98 6PY 0.00010 0.00005 0.00005 0.00000
99 6PZ 0.00010 0.00005 0.00005 0.00000
100 7PX 0.00084 0.00042 0.00042 0.00000
101 7PY 0.00084 0.00042 0.00042 0.00000
102 7PZ 0.00084 0.00042 0.00042 0.00000
103 8PX 0.00681 0.00341 0.00341 0.00000
104 8PY 0.00681 0.00341 0.00341 0.00000
105 8PZ 0.00681 0.00341 0.00341 0.00000
106 9PX 0.00634 0.00317 0.00317 0.00000
107 9PY 0.00634 0.00317 0.00317 0.00000
108 9PZ 0.00634 0.00317 0.00317 0.00000
109 10D 0 0.00001 0.00001 0.00001 0.00000
110 10D+1 0.00001 0.00001 0.00001 0.00000
111 10D-1 0.00001 0.00001 0.00001 0.00000
112 10D+2 0.00001 0.00001 0.00001 0.00000
113 10D-2 0.00001 0.00001 0.00001 0.00000
114 11D 0 0.00013 0.00006 0.00006 0.00000
115 11D+1 0.00032 0.00016 0.00016 0.00000
116 11D-1 0.00032 0.00016 0.00016 0.00000
117 11D+2 0.00013 0.00006 0.00006 0.00000
118 11D-2 0.00032 0.00016 0.00016 0.00000
119 12D 0 0.00054 0.00027 0.00027 0.00000
120 12D+1 0.00072 0.00036 0.00036 0.00000
121 12D-1 0.00072 0.00036 0.00036 0.00000
122 12D+2 0.00054 0.00027 0.00027 0.00000
123 12D-2 0.00072 0.00036 0.00036 0.00000
124 13F 0 0.00000 0.00000 0.00000 0.00000
125 13F+1 0.00000 0.00000 0.00000 0.00000
126 13F-1 0.00000 0.00000 0.00000 0.00000
127 13F+2 0.00000 0.00000 0.00000 0.00000
128 13F-2 0.00001 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
131 14F 0 0.00001 0.00001 0.00001 0.00000
132 14F+1 0.00004 0.00002 0.00002 0.00000
133 14F-1 0.00004 0.00002 0.00002 0.00000
134 14F+2 0.00006 0.00003 0.00003 0.00000
135 14F-2 0.00007 0.00003 0.00003 0.00000
136 14F+3 0.00003 0.00001 0.00001 0.00000
137 14F-3 0.00003 0.00001 0.00001 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 0.00000 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 0.03631 0.01815 0.01815 0.00000
148 2S 0.14922 0.07461 0.07461 0.00000
149 3S 0.39031 0.19515 0.19515 0.00000
150 4S 0.32791 0.16395 0.16395 0.00000
151 5S 0.03287 0.01644 0.01644 0.00000
152 6PX 0.00010 0.00005 0.00005 0.00000
153 6PY 0.00010 0.00005 0.00005 0.00000
154 6PZ 0.00010 0.00005 0.00005 0.00000
155 7PX 0.00084 0.00042 0.00042 0.00000
156 7PY 0.00084 0.00042 0.00042 0.00000
157 7PZ 0.00084 0.00042 0.00042 0.00000
158 8PX 0.00681 0.00341 0.00341 0.00000
159 8PY 0.00681 0.00341 0.00341 0.00000
160 8PZ 0.00681 0.00341 0.00341 0.00000
161 9PX 0.00634 0.00317 0.00317 0.00000
162 9PY 0.00634 0.00317 0.00317 0.00000
163 9PZ 0.00634 0.00317 0.00317 0.00000
164 10D 0 0.00001 0.00001 0.00001 0.00000
165 10D+1 0.00001 0.00001 0.00001 0.00000
166 10D-1 0.00001 0.00001 0.00001 0.00000
167 10D+2 0.00001 0.00001 0.00001 0.00000
168 10D-2 0.00001 0.00001 0.00001 0.00000
169 11D 0 0.00013 0.00006 0.00006 0.00000
170 11D+1 0.00032 0.00016 0.00016 0.00000
171 11D-1 0.00032 0.00016 0.00016 0.00000
172 11D+2 0.00013 0.00006 0.00006 0.00000
173 11D-2 0.00032 0.00016 0.00016 0.00000
174 12D 0 0.00054 0.00027 0.00027 0.00000
175 12D+1 0.00072 0.00036 0.00036 0.00000
176 12D-1 0.00072 0.00036 0.00036 0.00000
177 12D+2 0.00054 0.00027 0.00027 0.00000
178 12D-2 0.00072 0.00036 0.00036 0.00000
179 13F 0 0.00000 0.00000 0.00000 0.00000
180 13F+1 0.00000 0.00000 0.00000 0.00000
181 13F-1 0.00000 0.00000 0.00000 0.00000
182 13F+2 0.00000 0.00000 0.00000 0.00000
183 13F-2 0.00001 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
186 14F 0 0.00001 0.00001 0.00001 0.00000
187 14F+1 0.00004 0.00002 0.00002 0.00000
188 14F-1 0.00004 0.00002 0.00002 0.00000
189 14F+2 0.00006 0.00003 0.00003 0.00000
190 14F-2 0.00007 0.00003 0.00003 0.00000
191 14F+3 0.00003 0.00001 0.00001 0.00000
192 14F-3 0.00003 0.00001 0.00001 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 0.00000 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 0.03631 0.01815 0.01815 0.00000
203 2S 0.14922 0.07461 0.07461 0.00000
204 3S 0.39031 0.19515 0.19515 0.00000
205 4S 0.32791 0.16395 0.16395 0.00000
206 5S 0.03287 0.01644 0.01644 0.00000
207 6PX 0.00010 0.00005 0.00005 0.00000
208 6PY 0.00010 0.00005 0.00005 0.00000
209 6PZ 0.00010 0.00005 0.00005 0.00000
210 7PX 0.00084 0.00042 0.00042 0.00000
211 7PY 0.00084 0.00042 0.00042 0.00000
212 7PZ 0.00084 0.00042 0.00042 0.00000
213 8PX 0.00681 0.00341 0.00341 0.00000
214 8PY 0.00681 0.00341 0.00341 0.00000
215 8PZ 0.00681 0.00341 0.00341 0.00000
216 9PX 0.00634 0.00317 0.00317 0.00000
217 9PY 0.00634 0.00317 0.00317 0.00000
218 9PZ 0.00634 0.00317 0.00317 0.00000
219 10D 0 0.00001 0.00001 0.00001 0.00000
220 10D+1 0.00001 0.00001 0.00001 0.00000
221 10D-1 0.00001 0.00001 0.00001 0.00000
222 10D+2 0.00001 0.00001 0.00001 0.00000
223 10D-2 0.00001 0.00001 0.00001 0.00000
224 11D 0 0.00013 0.00006 0.00006 0.00000
225 11D+1 0.00032 0.00016 0.00016 0.00000
226 11D-1 0.00032 0.00016 0.00016 0.00000
227 11D+2 0.00013 0.00006 0.00006 0.00000
228 11D-2 0.00032 0.00016 0.00016 0.00000
229 12D 0 0.00054 0.00027 0.00027 0.00000
230 12D+1 0.00072 0.00036 0.00036 0.00000
231 12D-1 0.00072 0.00036 0.00036 0.00000
232 12D+2 0.00054 0.00027 0.00027 0.00000
233 12D-2 0.00072 0.00036 0.00036 0.00000
234 13F 0 0.00000 0.00000 0.00000 0.00000
235 13F+1 0.00000 0.00000 0.00000 0.00000
236 13F-1 0.00000 0.00000 0.00000 0.00000
237 13F+2 0.00000 0.00000 0.00000 0.00000
238 13F-2 0.00001 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
241 14F 0 0.00001 0.00001 0.00001 0.00000
242 14F+1 0.00004 0.00002 0.00002 0.00000
243 14F-1 0.00004 0.00002 0.00002 0.00000
244 14F+2 0.00006 0.00003 0.00003 0.00000
245 14F-2 0.00007 0.00003 0.00003 0.00000
246 14F+3 0.00003 0.00001 0.00001 0.00000
247 14F-3 0.00003 0.00001 0.00001 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 0.00000 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
257 5 H 1S 0.03631 0.01815 0.01815 0.00000
258 2S 0.14922 0.07461 0.07461 0.00000
259 3S 0.39031 0.19515 0.19515 0.00000
260 4S 0.32791 0.16395 0.16395 0.00000
261 5S 0.03287 0.01644 0.01644 0.00000
262 6PX 0.00010 0.00005 0.00005 0.00000
263 6PY 0.00010 0.00005 0.00005 0.00000
264 6PZ 0.00010 0.00005 0.00005 0.00000
265 7PX 0.00084 0.00042 0.00042 0.00000
266 7PY 0.00084 0.00042 0.00042 0.00000
267 7PZ 0.00084 0.00042 0.00042 0.00000
268 8PX 0.00681 0.00341 0.00341 0.00000
269 8PY 0.00681 0.00341 0.00341 0.00000
270 8PZ 0.00681 0.00341 0.00341 0.00000
271 9PX 0.00634 0.00317 0.00317 0.00000
272 9PY 0.00634 0.00317 0.00317 0.00000
273 9PZ 0.00634 0.00317 0.00317 0.00000
274 10D 0 0.00001 0.00001 0.00001 0.00000
275 10D+1 0.00001 0.00001 0.00001 0.00000
276 10D-1 0.00001 0.00001 0.00001 0.00000
277 10D+2 0.00001 0.00001 0.00001 0.00000
278 10D-2 0.00001 0.00001 0.00001 0.00000
279 11D 0 0.00013 0.00006 0.00006 0.00000
280 11D+1 0.00032 0.00016 0.00016 0.00000
281 11D-1 0.00032 0.00016 0.00016 0.00000
282 11D+2 0.00013 0.00006 0.00006 0.00000
283 11D-2 0.00032 0.00016 0.00016 0.00000
284 12D 0 0.00054 0.00027 0.00027 0.00000
285 12D+1 0.00072 0.00036 0.00036 0.00000
286 12D-1 0.00072 0.00036 0.00036 0.00000
287 12D+2 0.00054 0.00027 0.00027 0.00000
288 12D-2 0.00072 0.00036 0.00036 0.00000
289 13F 0 0.00000 0.00000 0.00000 0.00000
290 13F+1 0.00000 0.00000 0.00000 0.00000
291 13F-1 0.00000 0.00000 0.00000 0.00000
292 13F+2 0.00000 0.00000 0.00000 0.00000
293 13F-2 0.00001 0.00000 0.00000 0.00000
294 13F+3 0.00000 0.00000 0.00000 0.00000
295 13F-3 0.00000 0.00000 0.00000 0.00000
296 14F 0 0.00001 0.00001 0.00001 0.00000
297 14F+1 0.00004 0.00002 0.00002 0.00000
298 14F-1 0.00004 0.00002 0.00002 0.00000
299 14F+2 0.00006 0.00003 0.00003 0.00000
300 14F-2 0.00007 0.00003 0.00003 0.00000
301 14F+3 0.00003 0.00001 0.00001 0.00000
302 14F-3 0.00003 0.00001 0.00001 0.00000
303 15G 0 0.00000 0.00000 0.00000 0.00000
304 15G+1 0.00000 0.00000 0.00000 0.00000
305 15G-1 0.00000 0.00000 0.00000 0.00000
306 15G+2 0.00000 0.00000 0.00000 0.00000
307 15G-2 0.00000 0.00000 0.00000 0.00000
308 15G+3 0.00000 0.00000 0.00000 0.00000
309 15G-3 0.00000 0.00000 0.00000 0.00000
310 15G+4 0.00000 0.00000 0.00000 0.00000
311 15G-4 0.00000 0.00000 0.00000 0.00000
Condensed to atoms (all electrons):
1 2 3 4 5
1 C 4.369441 0.423917 0.423917 0.423917 0.423917
2 H 0.423917 0.648298 -0.029497 -0.029497 -0.029497
3 H 0.423917 -0.029497 0.648298 -0.029497 -0.029497
4 H 0.423917 -0.029497 -0.029497 0.648298 -0.029497
5 H 0.423917 -0.029497 -0.029497 -0.029497 0.648298
Atomic-Atomic Spin Densities.
1 2 3 4 5
1 C 0.000000 0.000000 0.000000 0.000000 0.000000
2 H 0.000000 0.000000 0.000000 0.000000 0.000000
3 H 0.000000 0.000000 0.000000 0.000000 0.000000
4 H 0.000000 0.000000 0.000000 0.000000 0.000000
5 H 0.000000 0.000000 0.000000 0.000000 0.000000
Mulliken charges and spin densities:
1 2
1 C -0.065107 0.000000
2 H 0.016277 0.000000
3 H 0.016277 0.000000
4 H 0.016277 0.000000
5 H 0.016277 0.000000
Sum of Mulliken charges = 0.00000 0.00000
Mulliken charges and spin densities with hydrogens summed into heavy atoms:
1 2
1 C 0.000000 0.000000
Electronic spatial extent (au): <R**2>= 35.8126
Charge= 0.0000 electrons
Dipole moment (field-independent basis, Debye):
X= 0.0000 Y= 0.0000 Z= 0.0000 Tot= 0.0000
Quadrupole moment (field-independent basis, Debye-Ang):
XX= -8.4216 YY= -8.4216 ZZ= -8.4216
XY= 0.0000 XZ= 0.0000 YZ= 0.0000
Traceless Quadrupole moment (field-independent basis, Debye-Ang):
XX= 0.0000 YY= 0.0000 ZZ= 0.0000
XY= 0.0000 XZ= 0.0000 YZ= 0.0000
Octapole moment (field-independent basis, Debye-Ang**2):
XXX= 0.0000 YYY= 0.0000 ZZZ= 0.0000 XYY= 0.0000
XXY= 0.0000 XXZ= 0.0000 XZZ= 0.0000 YZZ= 0.0000
YYZ= 0.0000 XYZ= 0.7083
Hexadecapole moment (field-independent basis, Debye-Ang**3):
XXXX= -16.7404 YYYY= -16.7404 ZZZZ= -16.7404 XXXY= 0.0000
XXXZ= 0.0000 YYYX= 0.0000 YYYZ= 0.0000 ZZZX= 0.0000
ZZZY= 0.0000 XXYY= -5.0139 XXZZ= -5.0139 YYZZ= -5.0139
XXYZ= 0.0000 YYXZ= 0.0000 ZZXY= 0.0000
N-N= 1.341257317792D+01 E-N=-1.198519805314D+02 KE= 4.015595480405D+01
Symmetry A KE= 3.445808139897D+01
Symmetry B1 KE= 1.899291135026D+00
Symmetry B2 KE= 1.899291135026D+00
Symmetry B3 KE= 1.899291135026D+00
Orbital energies and kinetic energies (alpha):
1 2
1 (A1)--O -11.207103 16.020793
2 (A1)--O -0.941449 1.208248
3 (T2)--O -0.544255 0.949646
4 (T2)--O -0.544255 0.949646
5 (T2)--O -0.544255 0.949646
6 (A1)--V 0.094920 0.234045
7 (T2)--V 0.148653 0.236126
8 (T2)--V 0.148653 0.236126
9 (T2)--V 0.148653 0.236126
10 (T2)--V 0.210120 0.271734
11 (T2)--V 0.210120 0.271734
12 (T2)--V 0.210120 0.271734
13 (A1)--V 0.397202 0.698989
14 (T2)--V 0.448800 0.936263
15 (T2)--V 0.448800 0.936263
16 (T2)--V 0.448800 0.936263
17 (E)--V 0.464953 0.593153
18 (E)--V 0.464953 0.593153
19 (A1)--V 0.501294 0.897621
20 (T2)--V 0.589084 0.763961
21 (T2)--V 0.589084 0.763961
22 (T2)--V 0.589084 0.763961
23 (T1)--V 0.671545 0.716957
24 (T1)--V 0.671545 0.716957
25 (T1)--V 0.671545 0.716957
26 (T2)--V 0.710770 0.786360
27 (T2)--V 0.710770 0.786360
28 (T2)--V 0.710770 0.786360
29 (T2)--V 0.930912 1.071393
30 (T2)--V 0.930912 1.071393
31 (T2)--V 0.930912 1.071393
32 (A1)--V 0.969661 1.206886
33 (E)--V 0.972149 0.999463
34 (E)--V 0.972149 0.999463
35 (T2)--V 1.062797 1.767199
36 (T2)--V 1.062797 1.767199
37 (T2)--V 1.062797 1.767199
38 (A1)--V 1.156309 2.149456
39 (T2)--V 1.292022 1.622854
40 (T2)--V 1.292022 1.622854
41 (T2)--V 1.292022 1.622854
42 (E)--V 1.452592 1.809764
43 (E)--V 1.452592 1.809764
44 (T1)--V 1.479005 1.609007
45 (T1)--V 1.479005 1.609007
46 (T1)--V 1.479005 1.609007
47 (A1)--V 1.584757 1.810404
48 (T2)--V 1.622072 1.760025
49 (T2)--V 1.622072 1.760025
50 (T2)--V 1.622072 1.760025
51 (T1)--V 1.782425 1.876462
52 (T1)--V 1.782425 1.876462
53 (T1)--V 1.782425 1.876462
54 (E)--V 1.881705 1.946439
55 (E)--V 1.881705 1.946439
56 (T2)--V 1.904183 2.157325
57 (T2)--V 1.904183 2.157325
58 (T2)--V 1.904183 2.157325
59 (A1)--V 2.082679 2.760735
60 (E)--V 2.085926 2.201832
61 (E)--V 2.085926 2.201832
62 (T2)--V 2.108901 2.324024
63 (T2)--V 2.108901 2.324024
64 (T2)--V 2.108901 2.324024
65 (T2)--V 2.183300 2.676604
66 (T2)--V 2.183300 2.676604
67 (T2)--V 2.183300 2.676604
68 (T1)--V 2.388366 2.455949
69 (T1)--V 2.388366 2.455949
70 (T1)--V 2.388366 2.455949
71 (T2)--V 2.465342 2.681841
72 (T2)--V 2.465342 2.681841
73 (T2)--V 2.465342 2.681841
74 (A1)--V 2.584393 2.929980
75 (T1)--V 2.658246 2.872724
76 (T1)--V 2.658246 2.872724
77 (T1)--V 2.658246 2.872724
78 (T2)--V 2.712266 3.493583
79 (T2)--V 2.712266 3.493583
80 (T2)--V 2.712266 3.493583
81 (A1)--V 2.922725 3.829091
82 (T2)--V 3.163354 3.663035
83 (T2)--V 3.163354 3.663035
84 (T2)--V 3.163354 3.663035
85 (E)--V 3.302155 3.772150
86 (E)--V 3.302155 3.772150
87 (T2)--V 3.462209 3.908048
88 (T2)--V 3.462209 3.908048
89 (T2)--V 3.462209 3.908048
90 (T1)--V 3.737270 3.955716
91 (T1)--V 3.737270 3.955716
92 (T1)--V 3.737270 3.955716
93 (T2)--V 3.773092 4.400212
94 (T2)--V 3.773092 4.400212
95 (T2)--V 3.773092 4.400212
96 (A1)--V 3.916566 4.232448
97 (T2)--V 4.075991 4.347896
98 (T2)--V 4.075991 4.347896
99 (T2)--V 4.075991 4.347896
100 (A2)--V 4.116199 4.213661
101 (E)--V 4.126255 4.514247
102 (E)--V 4.126255 4.514247
103 (E)--V 4.163857 4.425113
104 (E)--V 4.163857 4.425113
105 (A1)--V 4.199879 5.547849
106 (T1)--V 4.258155 4.428760
107 (T1)--V 4.258155 4.428760
108 (T1)--V 4.258155 4.428760
109 (T2)--V 4.548578 4.909527
110 (T2)--V 4.548578 4.909527
111 (T2)--V 4.548578 4.909527
112 (E)--V 4.725578 4.875031
113 (E)--V 4.725578 4.875031
114 (T2)--V 4.726779 5.245826
115 (T2)--V 4.726779 5.245826
116 (T2)--V 4.726779 5.245826
117 (A1)--V 4.757038 5.013524
118 (T1)--V 4.812059 5.111404
119 (T1)--V 4.812059 5.111404
120 (T1)--V 4.812059 5.111404
121 (T1)--V 4.878067 5.127413
122 (T1)--V 4.878067 5.127413
123 (T1)--V 4.878067 5.127413
124 (T2)--V 4.914051 5.114984
125 (T2)--V 4.914051 5.114984
126 (T2)--V 4.914051 5.114984
127 (A1)--V 5.193283 5.786580
128 (T2)--V 5.372784 5.636243
129 (T2)--V 5.372784 5.636243
130 (T2)--V 5.372784 5.636243
131 (T2)--V 5.430683 6.190472
132 (T2)--V 5.430683 6.190472
133 (T2)--V 5.430683 6.190472
134 (T1)--V 5.489467 5.642935
135 (T1)--V 5.489467 5.642935
136 (T1)--V 5.489467 5.642935
137 (E)--V 5.513533 5.831075
138 (E)--V 5.513533 5.831075
139 (T1)--V 5.677180 5.891479
140 (T1)--V 5.677180 5.891479
141 (T1)--V 5.677180 5.891479
142 (T2)--V 5.759625 6.521596
143 (T2)--V 5.759625 6.521596
144 (T2)--V 5.759625 6.521596
145 (T2)--V 6.021430 6.437006
146 (T2)--V 6.021430 6.437006
147 (T2)--V 6.021430 6.437006
148 (A1)--V 6.038134 7.420920
149 (E)--V 6.080248 6.729538
150 (E)--V 6.080248 6.729538
151 (T2)--V 6.263961 6.746444
152 (T2)--V 6.263961 6.746444
153 (T2)--V 6.263961 6.746444
154 (A1)--V 6.417563 6.983176
155 (E)--V 6.898497 7.314687
156 (E)--V 6.898497 7.314687
157 (T1)--V 7.012398 7.425295
158 (T1)--V 7.012398 7.425295
159 (T1)--V 7.012398 7.425295
160 (T2)--V 7.116970 8.017741
161 (T2)--V 7.116970 8.017741
162 (T2)--V 7.116970 8.017741
163 (T2)--V 7.480766 8.432797
164 (T2)--V 7.480766 8.432797
165 (T2)--V 7.480766 8.432797
166 (T1)--V 7.637405 8.208072
167 (T1)--V 7.637405 8.208072
168 (T1)--V 7.637405 8.208072
169 (E)--V 7.833997 8.286066
170 (E)--V 7.833997 8.286066
171 (T2)--V 8.185904 8.873746
172 (T2)--V 8.185904 8.873746
173 (T2)--V 8.185904 8.873746
174 (A1)--V 8.223373 9.298224
175 (T1)--V 9.500296 10.026026
176 (T1)--V 9.500296 10.026026
177 (T1)--V 9.500296 10.026026
178 (T2)--V 9.615725 11.123308
179 (T2)--V 9.615725 11.123308
180 (T2)--V 9.615725 11.123308
181 (T2)--V 9.848508 10.474346
182 (T2)--V 9.848508 10.474346
183 (T2)--V 9.848508 10.474346
184 (A1)--V 9.880069 14.023816
185 (E)--V 9.952221 10.604983
186 (E)--V 9.952221 10.604983
187 (E)--V 10.300043 11.156195
188 (E)--V 10.300043 11.156195
189 (T2)--V 10.475009 12.241870
190 (T2)--V 10.475009 12.241870
191 (T2)--V 10.475009 12.241870
192 (T1)--V 10.478306 11.368110
193 (T1)--V 10.478306 11.368110
194 (T1)--V 10.478306 11.368110
195 (A1)--V 10.866853 12.428258
196 (T2)--V 11.128135 12.214863
197 (T2)--V 11.128135 12.214863
198 (T2)--V 11.128135 12.214863
199 (T2)--V 11.443660 13.963500
200 (T2)--V 11.443660 13.963500
201 (T2)--V 11.443660 13.963500
202 (A1)--V 11.563460 13.034650
203 (T1)--V 11.824859 12.941646
204 (T1)--V 11.824859 12.941646
205 (T1)--V 11.824859 12.941646
206 (E)--V 12.400623 14.287772
207 (E)--V 12.400623 14.287772
208 (A2)--V 12.574106 12.935585
209 (T1)--V 12.732048 13.021619
210 (T1)--V 12.732048 13.021619
211 (T1)--V 12.732048 13.021619
212 (T2)--V 12.762501 13.167846
213 (T2)--V 12.762501 13.167846
214 (T2)--V 12.762501 13.167846
215 (E)--V 12.812219 13.217409
216 (E)--V 12.812219 13.217409
217 (T1)--V 12.862990 13.283356
218 (T1)--V 12.862990 13.283356
219 (T1)--V 12.862990 13.283356
220 (T2)--V 12.954484 13.665177
221 (T2)--V 12.954484 13.665177
222 (T2)--V 12.954484 13.665177
223 (A2)--V 13.000761 13.344656
224 (T2)--V 13.021893 14.849664
225 (T2)--V 13.021893 14.849664
226 (T2)--V 13.021893 14.849664
227 (A1)--V 13.027483 13.556337
228 (T1)--V 13.263152 13.700557
229 (T1)--V 13.263152 13.700557
230 (T1)--V 13.263152 13.700557
231 (E)--V 13.429374 13.979049
232 (E)--V 13.429374 13.979049
233 (T2)--V 13.434013 13.864302
234 (T2)--V 13.434013 13.864302
235 (T2)--V 13.434013 13.864302
236 (T2)--V 13.561287 14.095118
237 (T2)--V 13.561287 14.095118
238 (T2)--V 13.561287 14.095118
239 (A1)--V 13.641698 14.104557
240 (T1)--V 13.998247 14.581165
241 (T1)--V 13.998247 14.581165
242 (T1)--V 13.998247 14.581165
243 (T2)--V 14.079132 14.671249
244 (T2)--V 14.079132 14.671249
245 (T2)--V 14.079132 14.671249
246 (T1)--V 14.228704 14.868633
247 (T1)--V 14.228704 14.868633
248 (T1)--V 14.228704 14.868633
249 (E)--V 14.265438 14.778503
250 (E)--V 14.265438 14.778503
251 (E)--V 14.289000 14.966466
252 (E)--V 14.289000 14.966466
253 (T2)--V 14.354278 16.088102
254 (T2)--V 14.354278 16.088102
255 (T2)--V 14.354278 16.088102
256 (A1)--V 14.358987 16.153667
257 (T1)--V 14.473046 14.909781
258 (T1)--V 14.473046 14.909781
259 (T1)--V 14.473046 14.909781
260 (T2)--V 14.571774 15.170708
261 (T2)--V 14.571774 15.170708
262 (T2)--V 14.571774 15.170708
263 (T1)--V 14.784918 15.436487
264 (T1)--V 14.784918 15.436487
265 (T1)--V 14.784918 15.436487
266 (T2)--V 14.885284 15.466377
267 (T2)--V 14.885284 15.466377
268 (T2)--V 14.885284 15.466377
269 (E)--V 15.101709 15.939141
270 (E)--V 15.101709 15.939141
271 (A1)--V 15.539300 16.699107
272 (T2)--V 15.634659 16.714301
273 (T2)--V 15.634659 16.714301
274 (T2)--V 15.634659 16.714301
275 (A1)--V 15.679228 17.003855
276 (T2)--V 15.796321 16.648246
277 (T2)--V 15.796321 16.648246
278 (T2)--V 15.796321 16.648246
279 (E)--V 15.946358 16.625230
280 (E)--V 15.946358 16.625230
281 (T1)--V 16.614148 17.168900
282 (T1)--V 16.614148 17.168900
283 (T1)--V 16.614148 17.168900
284 (T2)--V 16.915636 18.682755
285 (T2)--V 16.915636 18.682755
286 (T2)--V 16.915636 18.682755
287 (T1)--V 17.440178 18.359578
288 (T1)--V 17.440178 18.359578
289 (T1)--V 17.440178 18.359578
290 (T2)--V 17.893660 18.903849
291 (T2)--V 17.893660 18.903849
292 (T2)--V 17.893660 18.903849
293 (E)--V 17.980786 19.153621
294 (E)--V 17.980786 19.153621
295 (T2)--V 18.377868 19.946939
296 (T2)--V 18.377868 19.946939
297 (T2)--V 18.377868 19.946939
298 (E)--V 18.500543 19.829206
299 (E)--V 18.500543 19.829206
300 (T1)--V 18.635712 19.694985
301 (T1)--V 18.635712 19.694985
302 (T1)--V 18.635712 19.694985
303 (T2)--V 18.954113 21.148052
304 (T2)--V 18.954113 21.148052
305 (T2)--V 18.954113 21.148052
306 (A1)--V 19.125247 20.249033
307 (A1)--V 20.848622 23.307921
308 (T2)--V 20.860192 23.094570
309 (T2)--V 20.860192 23.094570
310 (T2)--V 20.860192 23.094570
311 (A1)--V 43.126439 82.492096
Total kinetic energy from orbitals= 4.015595480405D+01
Isotropic Fermi Contact Couplings
Atom a.u. MegaHertz Gauss 10(-4) cm-1
1 C(13) 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
5 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
5 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
5 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 C(13) 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
Baa 0.0000 0.000 0.000 0.000 1.0000 0.0000 0.0000
5 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 Tue Apr 2 23:59:06 2019, MaxMem= 13421772800 cpu: 28.4
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l9999.exe)
1\1\GINC-COMPUTE-3-5\SP\ROCCSD(T)-FC\CC-pV5Z\C1H4\LOOS\02-Apr-2019\0\\
#p ROCCSD(T) cc-pV5Z pop=full gfprint\\G2\\0,1\C\H,1,1.09185419\H,1,1.
09185419,2,109.47122063\H,1,1.09185419,2,109.47122063,3,109.47122063,1
\H,1,1.09185419,2,109.47122063,3,109.47122063,-1\\Version=ES64L-G09Rev
D.01\State=1-A1\HF=-40.216757\MP2=-40.4311611\MP3=-40.4456182\PUHF=-40
.216757\PMP2-0=-40.4311611\MP4SDQ=-40.4473523\CCSD=-40.4473628\CCSD(T)
=-40.4545009\RMSD=2.602e-09\PG=TD [O(C1),4C3(H1)]\\@
IN SO FAR AS QUANTUM MECHANICS IS CORRECT, CHEMICAL
QUESTIONS ARE PROBLEMS IN APPLIED MATHEMATICS.
-- EYRING, WALTER, & KIMBALL, 1944
Job cpu time: 1 days 10 hours 3 minutes 36.9 seconds.
File lengths (MBytes): RWF= 2082 Int= 0 D2E= 0 Chk= 9 Scr= 1
Normal termination of Gaussian 09 at Tue Apr 2 23:59:07 2019.
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