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srDFT_G2/G09/Large_core/Molecules/vqz/Si2H6.out
Pierre-Francois Loos de88456a86 LC VQZ G2
2019-04-01 09:40:22 +02:00

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Entering Gaussian System, Link 0=g09
Input=Si2H6.inp
Output=Si2H6.out
Initial command:
/share/apps/gaussian/g09d01/nehalem/g09/l1.exe "/mnt/beegfs/tmpdir/42176/Gau-50506.inp" -scrdir="/mnt/beegfs/tmpdir/42176/"
Entering Link 1 = /share/apps/gaussian/g09d01/nehalem/g09/l1.exe PID= 50507.
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
30-Mar-2019
******************************************
-------------------------------------
#p ROCCSD(T) cc-pVQZ pop=full gfprint
-------------------------------------
1/38=1/1;
2/12=2,17=6,18=5,40=1/2;
3/5=16,6=2,11=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 Sat Mar 30 18:52:45 2019, MaxMem= 0 cpu: 0.0
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l101.exe)
--
G2
--
Symbolic Z-matrix:
Charge = 0 Multiplicity = 1
Si
Si 1 R
H 1 SIH 2 SICC
H 1 SIH 2 SICC 3 120. 0
H 1 SIH 2 SICC 3 -120. 0
H 2 SIH 1 SICC 3 180. 0
H 2 SIH 1 SICC 6 120. 0
H 2 SIH 1 SICC 6 -120. 0
Variables:
SICC 110.49912
SIH 1.48549
R 2.35422
NAtoms= 8 NQM= 8 NQMF= 0 NMMI= 0 NMMIF= 0
NMic= 0 NMicF= 0.
Isotopes and Nuclear Properties:
(Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
in nuclear magnetons)
Atom 1 2 3 4 5 6 7 8
IAtWgt= 28 28 1 1 1 1 1 1
AtmWgt= 27.9769284 27.9769284 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250
NucSpn= 0 0 1 1 1 1 1 1
AtZEff= 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
NQMom= 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
NMagM= 0.0000000 0.0000000 2.7928460 2.7928460 2.7928460 2.7928460 2.7928460 2.7928460
AtZNuc= 14.0000000 14.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000
Leave Link 101 at Sat Mar 30 18:52:45 2019, MaxMem= 33554432 cpu: 0.1
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l202.exe)
Input orientation:
---------------------------------------------------------------------
Center Atomic Atomic Coordinates (Angstroms)
Number Number Type X Y Z
---------------------------------------------------------------------
1 14 0 0.000000 0.000000 0.000000
2 14 0 0.000000 0.000000 2.354217
3 1 0 1.391424 0.000000 -0.520208
4 1 0 -0.695712 -1.205009 -0.520208
5 1 0 -0.695712 1.205009 -0.520208
6 1 0 -1.391424 0.000000 2.874425
7 1 0 0.695712 -1.205009 2.874425
8 1 0 0.695712 1.205009 2.874425
---------------------------------------------------------------------
Distance matrix (angstroms):
1 2 3 4 5
1 Si 0.000000
2 Si 2.354217 0.000000
3 H 1.485489 3.193491 0.000000
4 H 1.485489 3.193491 2.410017 0.000000
5 H 1.485489 3.193491 2.410017 2.410017 0.000000
6 H 3.193491 1.485489 4.389508 3.668732 3.668732
7 H 3.193491 1.485489 3.668732 3.668732 4.389508
8 H 3.193491 1.485489 3.668732 4.389508 3.668732
6 7 8
6 H 0.000000
7 H 2.410017 0.000000
8 H 2.410017 2.410017 0.000000
Stoichiometry H6Si2
Framework group D3D[C3(Si.Si),3SGD(H2)]
Deg. of freedom 3
Full point group D3D NOp 12
Largest Abelian subgroup C2H NOp 4
Largest concise Abelian subgroup C2H NOp 4
Standard orientation:
---------------------------------------------------------------------
Center Atomic Atomic Coordinates (Angstroms)
Number Number Type X Y Z
---------------------------------------------------------------------
1 14 0 0.000000 0.000000 1.177109
2 14 0 0.000000 0.000000 -1.177109
3 1 0 0.000000 1.391424 1.697317
4 1 0 -1.205009 -0.695712 1.697317
5 1 0 1.205009 -0.695712 1.697317
6 1 0 0.000000 -1.391424 -1.697317
7 1 0 -1.205009 0.695712 -1.697317
8 1 0 1.205009 0.695712 -1.697317
---------------------------------------------------------------------
Rotational constants (GHZ): 43.1679761 5.0135307 5.0135307
Leave Link 202 at Sat Mar 30 18:52:45 2019, MaxMem= 33554432 cpu: 0.0
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l301.exe)
Standard basis: CC-pVQZ (5D, 7F)
Ernie: Thresh= 0.10000D-02 Tol= 0.10000D-05 Strict=F.
Ernie: 30 primitive shells out of 206 were deleted.
AO basis set (Overlap normalization):
Atom Si1 Shell 1 S 11 bf 1 - 1 0.000000000000 0.000000000000 2.224413109432
0.5130000000D+06 0.2607781083D-04
0.7682000000D+05 0.2028157922D-03
0.1747000000D+05 0.1066649530D-02
0.4935000000D+04 0.4503842253D-02
0.1602000000D+04 0.1622782614D-01
0.5741000000D+03 0.5086354442D-01
0.2215000000D+03 0.1350620363D+00
0.9054000000D+02 0.2810096407D+00
0.3874000000D+02 0.3846002751D+00
0.1695000000D+02 0.2447731501D+00
0.6452000000D+01 0.3581541130D-01
Atom Si1 Shell 2 S 8 bf 2 - 2 0.000000000000 0.000000000000 2.224413109432
0.1602000000D+04 -0.9818514227D-04
0.5741000000D+03 -0.8033937896D-03
0.2215000000D+03 -0.6276246020D-02
0.9054000000D+02 -0.3168321153D-01
0.3874000000D+02 -0.1184442739D+00
0.1695000000D+02 -0.1631947300D+00
0.6452000000D+01 0.3276933289D+00
0.2874000000D+01 0.8386096255D+00
Atom Si1 Shell 3 S 7 bf 3 - 3 0.000000000000 0.000000000000 2.224413109432
0.5741000000D+03 -0.4194107713D-04
0.9054000000D+02 -0.4594478384D-03
0.3874000000D+02 0.1309605478D-02
0.1695000000D+02 0.2647771767D-02
0.6452000000D+01 -0.1120602294D-01
0.2874000000D+01 -0.2477791054D+00
0.1250000000D+01 -0.7681163209D+00
Atom Si1 Shell 4 S 1 bf 4 - 4 0.000000000000 0.000000000000 2.224413109432
0.3599000000D+00 0.1000000000D+01
Atom Si1 Shell 5 S 1 bf 5 - 5 0.000000000000 0.000000000000 2.224413109432
0.1699000000D+00 0.1000000000D+01
Atom Si1 Shell 6 S 1 bf 6 - 6 0.000000000000 0.000000000000 2.224413109432
0.7066000000D-01 0.1000000000D+01
Atom Si1 Shell 7 P 7 bf 7 - 9 0.000000000000 0.000000000000 2.224413109432
0.1122000000D+04 0.4310266760D-03
0.2660000000D+03 0.3578968253D-02
0.8592000000D+02 0.1938729574D-01
0.3233000000D+02 0.7083458531D-01
0.1337000000D+02 0.2021530634D+00
0.5800000000D+01 0.3509189081D+00
0.2559000000D+01 0.5103514540D+00
Atom Si1 Shell 8 P 7 bf 10 - 12 0.000000000000 0.000000000000 2.224413109432
0.1122000000D+04 -0.7629940014D-04
0.8592000000D+02 -0.5735085171D-02
0.3233000000D+02 -0.1882148056D-01
0.1337000000D+02 -0.1709703682D+00
0.5800000000D+01 -0.2560529823D+00
0.2559000000D+01 -0.1095575212D+01
0.1124000000D+01 0.1337170357D+01
Atom Si1 Shell 9 P 1 bf 13 - 15 0.000000000000 0.000000000000 2.224413109432
0.3988000000D+00 0.1000000000D+01
Atom Si1 Shell 10 P 1 bf 16 - 18 0.000000000000 0.000000000000 2.224413109432
0.1533000000D+00 0.1000000000D+01
Atom Si1 Shell 11 P 1 bf 19 - 21 0.000000000000 0.000000000000 2.224413109432
0.5728000000D-01 0.1000000000D+01
Atom Si1 Shell 12 D 1 bf 22 - 26 0.000000000000 0.000000000000 2.224413109432
0.1200000000D+00 0.1000000000D+01
Atom Si1 Shell 13 D 1 bf 27 - 31 0.000000000000 0.000000000000 2.224413109432
0.3020000000D+00 0.1000000000D+01
Atom Si1 Shell 14 D 1 bf 32 - 36 0.000000000000 0.000000000000 2.224413109432
0.7600000000D+00 0.1000000000D+01
Atom Si1 Shell 15 F 1 bf 37 - 43 0.000000000000 0.000000000000 2.224413109432
0.2120000000D+00 0.1000000000D+01
Atom Si1 Shell 16 F 1 bf 44 - 50 0.000000000000 0.000000000000 2.224413109432
0.5410000000D+00 0.1000000000D+01
Atom Si1 Shell 17 G 1 bf 51 - 59 0.000000000000 0.000000000000 2.224413109432
0.4610000000D+00 0.1000000000D+01
Atom Si2 Shell 18 S 11 bf 60 - 60 0.000000000000 0.000000000000 -2.224413109432
0.5130000000D+06 0.2607781083D-04
0.7682000000D+05 0.2028157922D-03
0.1747000000D+05 0.1066649530D-02
0.4935000000D+04 0.4503842253D-02
0.1602000000D+04 0.1622782614D-01
0.5741000000D+03 0.5086354442D-01
0.2215000000D+03 0.1350620363D+00
0.9054000000D+02 0.2810096407D+00
0.3874000000D+02 0.3846002751D+00
0.1695000000D+02 0.2447731501D+00
0.6452000000D+01 0.3581541130D-01
Atom Si2 Shell 19 S 8 bf 61 - 61 0.000000000000 0.000000000000 -2.224413109432
0.1602000000D+04 -0.9818514227D-04
0.5741000000D+03 -0.8033937896D-03
0.2215000000D+03 -0.6276246020D-02
0.9054000000D+02 -0.3168321153D-01
0.3874000000D+02 -0.1184442739D+00
0.1695000000D+02 -0.1631947300D+00
0.6452000000D+01 0.3276933289D+00
0.2874000000D+01 0.8386096255D+00
Atom Si2 Shell 20 S 7 bf 62 - 62 0.000000000000 0.000000000000 -2.224413109432
0.5741000000D+03 -0.4194107713D-04
0.9054000000D+02 -0.4594478384D-03
0.3874000000D+02 0.1309605478D-02
0.1695000000D+02 0.2647771767D-02
0.6452000000D+01 -0.1120602294D-01
0.2874000000D+01 -0.2477791054D+00
0.1250000000D+01 -0.7681163209D+00
Atom Si2 Shell 21 S 1 bf 63 - 63 0.000000000000 0.000000000000 -2.224413109432
0.3599000000D+00 0.1000000000D+01
Atom Si2 Shell 22 S 1 bf 64 - 64 0.000000000000 0.000000000000 -2.224413109432
0.1699000000D+00 0.1000000000D+01
Atom Si2 Shell 23 S 1 bf 65 - 65 0.000000000000 0.000000000000 -2.224413109432
0.7066000000D-01 0.1000000000D+01
Atom Si2 Shell 24 P 7 bf 66 - 68 0.000000000000 0.000000000000 -2.224413109432
0.1122000000D+04 0.4310266760D-03
0.2660000000D+03 0.3578968253D-02
0.8592000000D+02 0.1938729574D-01
0.3233000000D+02 0.7083458531D-01
0.1337000000D+02 0.2021530634D+00
0.5800000000D+01 0.3509189081D+00
0.2559000000D+01 0.5103514540D+00
Atom Si2 Shell 25 P 7 bf 69 - 71 0.000000000000 0.000000000000 -2.224413109432
0.1122000000D+04 -0.7629940014D-04
0.8592000000D+02 -0.5735085171D-02
0.3233000000D+02 -0.1882148056D-01
0.1337000000D+02 -0.1709703682D+00
0.5800000000D+01 -0.2560529823D+00
0.2559000000D+01 -0.1095575212D+01
0.1124000000D+01 0.1337170357D+01
Atom Si2 Shell 26 P 1 bf 72 - 74 0.000000000000 0.000000000000 -2.224413109432
0.3988000000D+00 0.1000000000D+01
Atom Si2 Shell 27 P 1 bf 75 - 77 0.000000000000 0.000000000000 -2.224413109432
0.1533000000D+00 0.1000000000D+01
Atom Si2 Shell 28 P 1 bf 78 - 80 0.000000000000 0.000000000000 -2.224413109432
0.5728000000D-01 0.1000000000D+01
Atom Si2 Shell 29 D 1 bf 81 - 85 0.000000000000 0.000000000000 -2.224413109432
0.1200000000D+00 0.1000000000D+01
Atom Si2 Shell 30 D 1 bf 86 - 90 0.000000000000 0.000000000000 -2.224413109432
0.3020000000D+00 0.1000000000D+01
Atom Si2 Shell 31 D 1 bf 91 - 95 0.000000000000 0.000000000000 -2.224413109432
0.7600000000D+00 0.1000000000D+01
Atom Si2 Shell 32 F 1 bf 96 - 102 0.000000000000 0.000000000000 -2.224413109432
0.2120000000D+00 0.1000000000D+01
Atom Si2 Shell 33 F 1 bf 103 - 109 0.000000000000 0.000000000000 -2.224413109432
0.5410000000D+00 0.1000000000D+01
Atom Si2 Shell 34 G 1 bf 110 - 118 0.000000000000 0.000000000000 -2.224413109432
0.4610000000D+00 0.1000000000D+01
Atom H3 Shell 35 S 3 bf 119 - 119 0.000000000000 2.629410702247 3.207463557531
0.8264000000D+02 0.2295075779D-01
0.1241000000D+02 0.1755401181D+00
0.2824000000D+01 0.8647035510D+00
Atom H3 Shell 36 S 1 bf 120 - 120 0.000000000000 2.629410702247 3.207463557531
0.7977000000D+00 0.1000000000D+01
Atom H3 Shell 37 S 1 bf 121 - 121 0.000000000000 2.629410702247 3.207463557531
0.2581000000D+00 0.1000000000D+01
Atom H3 Shell 38 S 1 bf 122 - 122 0.000000000000 2.629410702247 3.207463557531
0.8989000000D-01 0.1000000000D+01
Atom H3 Shell 39 P 1 bf 123 - 125 0.000000000000 2.629410702247 3.207463557531
0.2292000000D+01 0.1000000000D+01
Atom H3 Shell 40 P 1 bf 126 - 128 0.000000000000 2.629410702247 3.207463557531
0.8380000000D+00 0.1000000000D+01
Atom H3 Shell 41 P 1 bf 129 - 131 0.000000000000 2.629410702247 3.207463557531
0.2920000000D+00 0.1000000000D+01
Atom H3 Shell 42 D 1 bf 132 - 136 0.000000000000 2.629410702247 3.207463557531
0.2062000000D+01 0.1000000000D+01
Atom H3 Shell 43 D 1 bf 137 - 141 0.000000000000 2.629410702247 3.207463557531
0.6620000000D+00 0.1000000000D+01
Atom H3 Shell 44 F 1 bf 142 - 148 0.000000000000 2.629410702247 3.207463557531
0.1397000000D+01 0.1000000000D+01
Atom H4 Shell 45 S 3 bf 149 - 149 -2.277136465129 -1.314705351124 3.207463557531
0.8264000000D+02 0.2295075779D-01
0.1241000000D+02 0.1755401181D+00
0.2824000000D+01 0.8647035510D+00
Atom H4 Shell 46 S 1 bf 150 - 150 -2.277136465129 -1.314705351124 3.207463557531
0.7977000000D+00 0.1000000000D+01
Atom H4 Shell 47 S 1 bf 151 - 151 -2.277136465129 -1.314705351124 3.207463557531
0.2581000000D+00 0.1000000000D+01
Atom H4 Shell 48 S 1 bf 152 - 152 -2.277136465129 -1.314705351124 3.207463557531
0.8989000000D-01 0.1000000000D+01
Atom H4 Shell 49 P 1 bf 153 - 155 -2.277136465129 -1.314705351124 3.207463557531
0.2292000000D+01 0.1000000000D+01
Atom H4 Shell 50 P 1 bf 156 - 158 -2.277136465129 -1.314705351124 3.207463557531
0.8380000000D+00 0.1000000000D+01
Atom H4 Shell 51 P 1 bf 159 - 161 -2.277136465129 -1.314705351124 3.207463557531
0.2920000000D+00 0.1000000000D+01
Atom H4 Shell 52 D 1 bf 162 - 166 -2.277136465129 -1.314705351124 3.207463557531
0.2062000000D+01 0.1000000000D+01
Atom H4 Shell 53 D 1 bf 167 - 171 -2.277136465129 -1.314705351124 3.207463557531
0.6620000000D+00 0.1000000000D+01
Atom H4 Shell 54 F 1 bf 172 - 178 -2.277136465129 -1.314705351124 3.207463557531
0.1397000000D+01 0.1000000000D+01
Atom H5 Shell 55 S 3 bf 179 - 179 2.277136465129 -1.314705351124 3.207463557531
0.8264000000D+02 0.2295075779D-01
0.1241000000D+02 0.1755401181D+00
0.2824000000D+01 0.8647035510D+00
Atom H5 Shell 56 S 1 bf 180 - 180 2.277136465129 -1.314705351124 3.207463557531
0.7977000000D+00 0.1000000000D+01
Atom H5 Shell 57 S 1 bf 181 - 181 2.277136465129 -1.314705351124 3.207463557531
0.2581000000D+00 0.1000000000D+01
Atom H5 Shell 58 S 1 bf 182 - 182 2.277136465129 -1.314705351124 3.207463557531
0.8989000000D-01 0.1000000000D+01
Atom H5 Shell 59 P 1 bf 183 - 185 2.277136465129 -1.314705351124 3.207463557531
0.2292000000D+01 0.1000000000D+01
Atom H5 Shell 60 P 1 bf 186 - 188 2.277136465129 -1.314705351124 3.207463557531
0.8380000000D+00 0.1000000000D+01
Atom H5 Shell 61 P 1 bf 189 - 191 2.277136465129 -1.314705351124 3.207463557531
0.2920000000D+00 0.1000000000D+01
Atom H5 Shell 62 D 1 bf 192 - 196 2.277136465129 -1.314705351124 3.207463557531
0.2062000000D+01 0.1000000000D+01
Atom H5 Shell 63 D 1 bf 197 - 201 2.277136465129 -1.314705351124 3.207463557531
0.6620000000D+00 0.1000000000D+01
Atom H5 Shell 64 F 1 bf 202 - 208 2.277136465129 -1.314705351124 3.207463557531
0.1397000000D+01 0.1000000000D+01
Atom H6 Shell 65 S 3 bf 209 - 209 0.000000000000 -2.629410702247 -3.207463557531
0.8264000000D+02 0.2295075779D-01
0.1241000000D+02 0.1755401181D+00
0.2824000000D+01 0.8647035510D+00
Atom H6 Shell 66 S 1 bf 210 - 210 0.000000000000 -2.629410702247 -3.207463557531
0.7977000000D+00 0.1000000000D+01
Atom H6 Shell 67 S 1 bf 211 - 211 0.000000000000 -2.629410702247 -3.207463557531
0.2581000000D+00 0.1000000000D+01
Atom H6 Shell 68 S 1 bf 212 - 212 0.000000000000 -2.629410702247 -3.207463557531
0.8989000000D-01 0.1000000000D+01
Atom H6 Shell 69 P 1 bf 213 - 215 0.000000000000 -2.629410702247 -3.207463557531
0.2292000000D+01 0.1000000000D+01
Atom H6 Shell 70 P 1 bf 216 - 218 0.000000000000 -2.629410702247 -3.207463557531
0.8380000000D+00 0.1000000000D+01
Atom H6 Shell 71 P 1 bf 219 - 221 0.000000000000 -2.629410702247 -3.207463557531
0.2920000000D+00 0.1000000000D+01
Atom H6 Shell 72 D 1 bf 222 - 226 0.000000000000 -2.629410702247 -3.207463557531
0.2062000000D+01 0.1000000000D+01
Atom H6 Shell 73 D 1 bf 227 - 231 0.000000000000 -2.629410702247 -3.207463557531
0.6620000000D+00 0.1000000000D+01
Atom H6 Shell 74 F 1 bf 232 - 238 0.000000000000 -2.629410702247 -3.207463557531
0.1397000000D+01 0.1000000000D+01
Atom H7 Shell 75 S 3 bf 239 - 239 -2.277136465129 1.314705351124 -3.207463557531
0.8264000000D+02 0.2295075779D-01
0.1241000000D+02 0.1755401181D+00
0.2824000000D+01 0.8647035510D+00
Atom H7 Shell 76 S 1 bf 240 - 240 -2.277136465129 1.314705351124 -3.207463557531
0.7977000000D+00 0.1000000000D+01
Atom H7 Shell 77 S 1 bf 241 - 241 -2.277136465129 1.314705351124 -3.207463557531
0.2581000000D+00 0.1000000000D+01
Atom H7 Shell 78 S 1 bf 242 - 242 -2.277136465129 1.314705351124 -3.207463557531
0.8989000000D-01 0.1000000000D+01
Atom H7 Shell 79 P 1 bf 243 - 245 -2.277136465129 1.314705351124 -3.207463557531
0.2292000000D+01 0.1000000000D+01
Atom H7 Shell 80 P 1 bf 246 - 248 -2.277136465129 1.314705351124 -3.207463557531
0.8380000000D+00 0.1000000000D+01
Atom H7 Shell 81 P 1 bf 249 - 251 -2.277136465129 1.314705351124 -3.207463557531
0.2920000000D+00 0.1000000000D+01
Atom H7 Shell 82 D 1 bf 252 - 256 -2.277136465129 1.314705351124 -3.207463557531
0.2062000000D+01 0.1000000000D+01
Atom H7 Shell 83 D 1 bf 257 - 261 -2.277136465129 1.314705351124 -3.207463557531
0.6620000000D+00 0.1000000000D+01
Atom H7 Shell 84 F 1 bf 262 - 268 -2.277136465129 1.314705351124 -3.207463557531
0.1397000000D+01 0.1000000000D+01
Atom H8 Shell 85 S 3 bf 269 - 269 2.277136465129 1.314705351124 -3.207463557531
0.8264000000D+02 0.2295075779D-01
0.1241000000D+02 0.1755401181D+00
0.2824000000D+01 0.8647035510D+00
Atom H8 Shell 86 S 1 bf 270 - 270 2.277136465129 1.314705351124 -3.207463557531
0.7977000000D+00 0.1000000000D+01
Atom H8 Shell 87 S 1 bf 271 - 271 2.277136465129 1.314705351124 -3.207463557531
0.2581000000D+00 0.1000000000D+01
Atom H8 Shell 88 S 1 bf 272 - 272 2.277136465129 1.314705351124 -3.207463557531
0.8989000000D-01 0.1000000000D+01
Atom H8 Shell 89 P 1 bf 273 - 275 2.277136465129 1.314705351124 -3.207463557531
0.2292000000D+01 0.1000000000D+01
Atom H8 Shell 90 P 1 bf 276 - 278 2.277136465129 1.314705351124 -3.207463557531
0.8380000000D+00 0.1000000000D+01
Atom H8 Shell 91 P 1 bf 279 - 281 2.277136465129 1.314705351124 -3.207463557531
0.2920000000D+00 0.1000000000D+01
Atom H8 Shell 92 D 1 bf 282 - 286 2.277136465129 1.314705351124 -3.207463557531
0.2062000000D+01 0.1000000000D+01
Atom H8 Shell 93 D 1 bf 287 - 291 2.277136465129 1.314705351124 -3.207463557531
0.6620000000D+00 0.1000000000D+01
Atom H8 Shell 94 F 1 bf 292 - 298 2.277136465129 1.314705351124 -3.207463557531
0.1397000000D+01 0.1000000000D+01
There are 108 symmetry adapted cartesian basis functions of AG symmetry.
There are 71 symmetry adapted cartesian basis functions of BG symmetry.
There are 71 symmetry adapted cartesian basis functions of AU symmetry.
There are 108 symmetry adapted cartesian basis functions of BU symmetry.
There are 88 symmetry adapted basis functions of AG symmetry.
There are 61 symmetry adapted basis functions of BG symmetry.
There are 61 symmetry adapted basis functions of AU symmetry.
There are 88 symmetry adapted basis functions of BU symmetry.
298 basis functions, 488 primitive gaussians, 358 cartesian basis functions
17 alpha electrons 17 beta electrons
nuclear repulsion energy 90.4437310430 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= 8 NActive= 8 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 Sat Mar 30 18:52:45 2019, MaxMem= 33554432 cpu: 0.0
(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= 298 RedAO= T EigKep= 1.23D-04 NBF= 88 61 61 88
NBsUse= 298 1.00D-06 EigRej= -1.00D+00 NBFU= 88 61 61 88
Leave Link 302 at Sat Mar 30 18:52:46 2019, MaxMem= 33554432 cpu: 0.2
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l303.exe)
DipDrv: MaxL=1.
Leave Link 303 at Sat Mar 30 18:52:46 2019, MaxMem= 33554432 cpu: 0.0
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l401.exe)
ExpMin= 5.73D-02 ExpMax= 5.13D+05 ExpMxC= 1.60D+03 IAcc=2 IRadAn= 4 AccDes= 0.00D+00
Harris functional with IExCor= 205 and IRadAn= 4 diagonalized for initial guess.
HarFok: IExCor= 205 AccDes= 0.00D+00 IRadAn= 4 IDoV= 1 UseB2=F ITyADJ=14
ICtDFT= 3500011 ScaDFX= 1.000000 1.000000 1.000000 1.000000
FoFCou: FMM=F IPFlag= 0 FMFlag= 100000 FMFlg1= 0
NFxFlg= 0 DoJE=T BraDBF=F KetDBF=T FulRan=T
wScrn= 0.000000 ICntrl= 500 IOpCl= 0 I1Cent= 200000004 NGrid= 0
NMat0= 1 NMatS0= 1 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0
Petite list used in FoFCou.
Harris En= -580.910948198933
JPrj=0 DoOrth=F DoCkMO=F.
Initial guess orbital symmetries:
Occupied (A2U) (A1G) (A1G) (A2U) (EU) (EU) (EG) (EG) (A1G)
(A2U) (A1G) (A2U) (EU) (EU) (EG) (EG) (A1G)
Virtual (EU) (EU) (A2U) (A1G) (EG) (EG) (A2U) (A1G) (EU)
(EU) (EU) (EU) (EG) (EG) (A2U) (A1G) (EG) (EG)
(EU) (EU) (A1G) (EG) (EG) (A2U) (A2U) (EG) (EG)
(A1G) (A2U) (A1U) (EU) (EU) (A2G) (A1G) (EG) (EG)
(EU) (EU) (A2U) (EG) (EG) (EU) (EU) (EU) (EU)
(A1G) (EG) (EG) (A1G) (A2U) (EU) (EU) (A1U) (A2U)
(EU) (EU) (EG) (EG) (A1G) (EG) (EG) (EG) (EG)
(A2U) (A1G) (A2U) (A2G) (EU) (EU) (EG) (EG) (EU)
(EU) (A2U) (A1G) (EU) (EU) (EG) (EG) (A1G) (A2U)
(A1G) (EU) (EU) (EG) (EG) (A1U) (EU) (EU) (A2G)
(EG) (EG) (EG) (EG) (A2U) (EU) (EU) (A1G) (EU)
(EU) (A2U) (A1G) (EG) (EG) (A1U) (EU) (EU) (A2U)
(EG) (EG) (EG) (EG) (EU) (EU) (A1G) (A2G) (A1U)
(A2U) (EU) (EU) (A2G) (EG) (EG) (EU) (EU) (A1G)
(EG) (EG) (A2U) (EG) (EG) (A2U) (EU) (EU) (A1G)
(A1U) (A1G) (EG) (EG) (EU) (EU) (A1G) (EU) (EU)
(A2G) (EG) (EG) (A2U) (A2U) (EG) (EG) (EU) (EU)
(EU) (EU) (EG) (EG) (A1G) (A2U) (EG) (EG) (EU)
(EU) (A2U) (EU) (EU) (A1G) (EG) (EG) (EG) (EG)
(A1U) (A1G) (EU) (EU) (A2G) (A2U) (A2G) (A1U)
(EG) (EG) (EU) (EU) (EG) (EG) (EU) (EU) (A1G)
(A2U) (A2U) (A1U) (A1G) (EG) (EG) (A2G) (EU) (EU)
(EU) (EU) (A2U) (EG) (EG) (A1G) (A2U) (EU) (EU)
(A1G) (EG) (EG) (EG) (EG) (EU) (EU) (EG) (EG)
(EU) (EU) (A1U) (A2G) (A1G) (EG) (EG) (A2U) (EU)
(EU) (A2U) (A1G) (EG) (EG) (EU) (EU) (EG) (EG)
(EU) (EU) (A1G) (A2U) (A1U) (EG) (EG) (A2G) (EU)
(EU) (A1U) (A2U) (EG) (EG) (EU) (EU) (EG) (EG)
(A2G) (A1G) (EU) (EU) (A1G) (A2U) (A1U) (EG) (EG)
(EU) (EU) (A2U) (A2G) (EU) (EU) (EG) (EG) (A1G)
(EG) (EG) (EU) (EU) (A1G) (A2U) (EG) (EG) (EU)
(EU) (A1G) (A2U)
The electronic state of the initial guess is 1-A1G.
Leave Link 401 at Sat Mar 30 18:52:46 2019, MaxMem= 33554432 cpu: 0.5
(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.
IVT= 409686 IEndB= 409686 NGot= 33554432 MDV= 33289909
LenX= 33289909 LenY= 33161304
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.
Fock matrices will be formed incrementally for 20 cycles.
Integral accuracy reduced to 1.0D-05 until final iterations.
Cycle 1 Pass 0 IDiag 1:
FoFJK: IHMeth= 1 ICntrl= 0 DoSepK=F KAlg= 0 I1Cent= 0 FoldK=F
IRaf= 950000000 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.
E= -581.316244299214
DIIS: error= 3.97D-02 at cycle 1 NSaved= 1.
NSaved= 1 IEnMin= 1 EnMin= -581.316244299214 IErMin= 1 ErrMin= 3.97D-02
ErrMax= 3.97D-02 0.00D+00 EMaxC= 1.00D-01 BMatC= 2.30D-01 BMatP= 2.30D-01
IDIUse=3 WtCom= 6.03D-01 WtEn= 3.97D-01
Coeff-Com: 0.100D+01
Coeff-En: 0.100D+01
Coeff: 0.100D+01
Gap= 0.530 Goal= None Shift= 0.000
GapD= 0.530 DampG=2.000 DampE=0.500 DampFc=1.0000 IDamp=-1.
RMSDP=1.46D-03 MaxDP=8.33D-02 OVMax= 4.70D-02
Cycle 2 Pass 0 IDiag 1:
RMSU= 1.40D-03 CP: 9.66D-01
E= -581.378874401210 Delta-E= -0.062630101995 Rises=F Damp=F
DIIS: error= 3.41D-03 at cycle 2 NSaved= 2.
NSaved= 2 IEnMin= 2 EnMin= -581.378874401210 IErMin= 2 ErrMin= 3.41D-03
ErrMax= 3.41D-03 0.00D+00 EMaxC= 1.00D-01 BMatC= 1.16D-03 BMatP= 2.30D-01
IDIUse=3 WtCom= 9.66D-01 WtEn= 3.41D-02
Coeff-Com: -0.103D-01 0.101D+01
Coeff-En: 0.000D+00 0.100D+01
Coeff: -0.998D-02 0.101D+01
Gap= 0.495 Goal= None Shift= 0.000
RMSDP=4.27D-04 MaxDP=2.80D-02 DE=-6.26D-02 OVMax= 1.50D-02
Cycle 3 Pass 0 IDiag 1:
RMSU= 1.69D-04 CP: 9.61D-01 1.27D+00
E= -581.380331244290 Delta-E= -0.001456843081 Rises=F Damp=F
DIIS: error= 1.22D-03 at cycle 3 NSaved= 3.
NSaved= 3 IEnMin= 3 EnMin= -581.380331244290 IErMin= 3 ErrMin= 1.22D-03
ErrMax= 1.22D-03 0.00D+00 EMaxC= 1.00D-01 BMatC= 5.91D-05 BMatP= 1.16D-03
IDIUse=3 WtCom= 9.88D-01 WtEn= 1.22D-02
Coeff-Com: -0.520D-02-0.115D+00 0.112D+01
Coeff-En: 0.000D+00 0.000D+00 0.100D+01
Coeff: -0.513D-02-0.114D+00 0.112D+01
Gap= 0.496 Goal= None Shift= 0.000
RMSDP=4.34D-05 MaxDP=2.82D-03 DE=-1.46D-03 OVMax= 6.10D-03
Cycle 4 Pass 0 IDiag 1:
RMSU= 4.00D-05 CP: 9.60D-01 1.29D+00 1.03D+00
E= -581.380492466418 Delta-E= -0.000161222128 Rises=F Damp=F
DIIS: error= 3.61D-04 at cycle 4 NSaved= 4.
NSaved= 4 IEnMin= 4 EnMin= -581.380492466418 IErMin= 4 ErrMin= 3.61D-04
ErrMax= 3.61D-04 0.00D+00 EMaxC= 1.00D-01 BMatC= 3.98D-06 BMatP= 5.91D-05
IDIUse=3 WtCom= 9.96D-01 WtEn= 3.61D-03
Coeff-Com: 0.199D-02-0.350D-02-0.316D+00 0.132D+01
Coeff-En: 0.000D+00 0.000D+00 0.000D+00 0.100D+01
Coeff: 0.199D-02-0.349D-02-0.315D+00 0.132D+01
Gap= 0.497 Goal= None Shift= 0.000
RMSDP=1.47D-05 MaxDP=9.05D-04 DE=-1.61D-04 OVMax= 2.65D-03
Cycle 5 Pass 0 IDiag 1:
RMSU= 5.46D-06 CP: 9.60D-01 1.29D+00 1.05D+00 1.30D+00
E= -581.380507829121 Delta-E= -0.000015362703 Rises=F Damp=F
DIIS: error= 4.89D-05 at cycle 5 NSaved= 5.
NSaved= 5 IEnMin= 5 EnMin= -581.380507829121 IErMin= 5 ErrMin= 4.89D-05
ErrMax= 4.89D-05 0.00D+00 EMaxC= 1.00D-01 BMatC= 8.50D-08 BMatP= 3.98D-06
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: -0.204D-03 0.348D-02 0.972D-02-0.185D+00 0.117D+01
Coeff: -0.204D-03 0.348D-02 0.972D-02-0.185D+00 0.117D+01
Gap= 0.497 Goal= None Shift= 0.000
RMSDP=3.43D-06 MaxDP=2.30D-04 DE=-1.54D-05 OVMax= 4.41D-04
Initial convergence to 1.0D-05 achieved. Increase integral accuracy.
Cycle 6 Pass 1 IDiag 1:
E= -581.380512589768 Delta-E= -0.000004760647 Rises=F Damp=F
DIIS: error= 4.89D-05 at cycle 1 NSaved= 1.
NSaved= 1 IEnMin= 1 EnMin= -581.380512589768 IErMin= 1 ErrMin= 4.89D-05
ErrMax= 4.89D-05 0.00D+00 EMaxC= 1.00D-01 BMatC= 1.62D-07 BMatP= 1.62D-07
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: 0.100D+01
Coeff: 0.100D+01
Gap= 0.497 Goal= None Shift= 0.000
RMSDP=3.43D-06 MaxDP=2.30D-04 DE=-4.76D-06 OVMax= 5.34D-05
Cycle 7 Pass 1 IDiag 1:
RMSU= 5.27D-06 CP: 1.00D+00
E= -581.380512616092 Delta-E= -0.000000026324 Rises=F Damp=F
DIIS: error= 2.39D-06 at cycle 2 NSaved= 2.
NSaved= 2 IEnMin= 2 EnMin= -581.380512616092 IErMin= 2 ErrMin= 2.39D-06
ErrMax= 2.39D-06 0.00D+00 EMaxC= 1.00D-01 BMatC= 4.38D-10 BMatP= 1.62D-07
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: -0.150D-01 0.101D+01
Coeff: -0.150D-01 0.101D+01
Gap= 0.497 Goal= None Shift= 0.000
RMSDP=3.50D-07 MaxDP=3.56D-05 DE=-2.63D-08 OVMax= 2.09D-05
Cycle 8 Pass 1 IDiag 1:
RMSU= 1.94D-07 CP: 1.00D+00 1.06D+00
E= -581.380512617382 Delta-E= -0.000000001290 Rises=F Damp=F
DIIS: error= 9.24D-07 at cycle 3 NSaved= 3.
NSaved= 3 IEnMin= 3 EnMin= -581.380512617382 IErMin= 3 ErrMin= 9.24D-07
ErrMax= 9.24D-07 0.00D+00 EMaxC= 1.00D-01 BMatC= 4.88D-11 BMatP= 4.38D-10
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: 0.415D-02-0.432D+00 0.143D+01
Coeff: 0.415D-02-0.432D+00 0.143D+01
Gap= 0.497 Goal= None Shift= 0.000
RMSDP=9.35D-08 MaxDP=6.86D-06 DE=-1.29D-09 OVMax= 1.20D-05
Cycle 9 Pass 1 IDiag 1:
RMSU= 6.37D-08 CP: 1.00D+00 1.06D+00 1.34D+00
E= -581.380512617580 Delta-E= -0.000000000198 Rises=F Damp=F
DIIS: error= 1.58D-07 at cycle 4 NSaved= 4.
NSaved= 4 IEnMin= 4 EnMin= -581.380512617580 IErMin= 4 ErrMin= 1.58D-07
ErrMax= 1.58D-07 0.00D+00 EMaxC= 1.00D-01 BMatC= 1.14D-12 BMatP= 4.88D-11
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: -0.290D-03 0.517D-01-0.293D+00 0.124D+01
Coeff: -0.290D-03 0.517D-01-0.293D+00 0.124D+01
Gap= 0.497 Goal= None Shift= 0.000
RMSDP=2.07D-08 MaxDP=2.14D-06 DE=-1.98D-10 OVMax= 2.11D-06
Cycle 10 Pass 1 IDiag 1:
RMSU= 4.08D-09 CP: 1.00D+00 1.06D+00 1.37D+00 1.26D+00
E= -581.380512617584 Delta-E= -0.000000000004 Rises=F Damp=F
DIIS: error= 1.76D-08 at cycle 5 NSaved= 5.
NSaved= 5 IEnMin= 5 EnMin= -581.380512617584 IErMin= 5 ErrMin= 1.76D-08
ErrMax= 1.76D-08 0.00D+00 EMaxC= 1.00D-01 BMatC= 2.20D-14 BMatP= 1.14D-12
IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
Coeff-Com: -0.329D-04-0.148D-03 0.230D-01-0.219D+00 0.120D+01
Coeff: -0.329D-04-0.148D-03 0.230D-01-0.219D+00 0.120D+01
Gap= 0.497 Goal= None Shift= 0.000
RMSDP=1.48D-09 MaxDP=1.17D-07 DE=-3.64D-12 OVMax= 1.82D-07
SCF Done: E(ROHF) = -581.380512618 A.U. after 10 cycles
NFock= 10 Conv=0.15D-08 -V/T= 1.9999
<Sx>= 0.0000 <Sy>= 0.0000 <Sz>= 0.0000 <S**2>= 0.0000 S= 0.0000
<L.S>= 0.000000000000E+00
KE= 5.814222159296D+02 PE=-1.567200515792D+03 EE= 3.139540562017D+02
Annihilation of the first spin contaminant:
S**2 before annihilation 0.0000, after 0.0000
Leave Link 502 at Sat Mar 30 18:53:46 2019, MaxMem= 33554432 cpu: 59.0
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l801.exe)
Windowed orbitals will be sorted by symmetry type.
GenMOA: NOpAll= 12 NOp2=4 NOpUse= 12 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= 5.73D-02 ExpMax= 5.13D+05 ExpMxC= 1.60D+03 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 3.03D-04
Largest core mixing into a valence orbital is 8.70D-05
Largest valence mixing into a core orbital is 3.03D-04
Largest core mixing into a valence orbital is 8.70D-05
Range of M.O.s used for correlation: 11 298
NBasis= 298 NAE= 17 NBE= 17 NFC= 10 NFV= 0
NROrb= 288 NOA= 7 NOB= 7 NVA= 281 NVB= 281
**** Warning!!: The largest alpha MO coefficient is 0.25254106D+02
**** Warning!!: The largest beta MO coefficient is 0.25254106D+02
Singles contribution to E2= -0.8507400401D-15
Leave Link 801 at Sat Mar 30 18:53:54 2019, MaxMem= 33554432 cpu: 7.4
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l804.exe)
Open-shell transformation, MDV= 33554432 ITran=4 ISComp=2.
Semi-Direct transformation.
ModeAB= 4 MOrb= 7 LenV= 30979677
LASXX= 20564167 LTotXX= 20564167 LenRXX= 41366695
LTotAB= 20802528 MaxLAS= 43952832 LenRXY= 0
NonZer= 61930862 LenScr= 93847552 LnRSAI= 43952832
LnScr1= 67043328 LExtra= 0 Total= 246210407
MaxDsk= -1 SrtSym= T ITran= 4
DoSDTr: NPSUse= 1
JobTyp=1 Pass 1: I= 1 to 7.
Complete sort for first half transformation.
First half transformation complete.
Complete sort for second half transformation.
Second half transformation complete.
ModeAB= 4 MOrb= 7 LenV= 30979677
LASXX= 20564167 LTotXX= 20564167 LenRXX= 40366572
LTotAB= 19802405 MaxLAS= 43952832 LenRXY= 0
NonZer= 60930739 LenScr= 92405760 LnRSAI= 43952832
LnScr1= 67043328 LExtra= 0 Total= 243768492
MaxDsk= -1 SrtSym= T ITran= 4
DoSDTr: NPSUse= 1
JobTyp=2 Pass 1: I= 1 to 7.
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 = 0.9058090293D-02 E2= -0.1758212516D-01
alpha-beta T2 = 0.9913526873D-01 E2= -0.2476610444D+00
beta-beta T2 = 0.9058090293D-02 E2= -0.1758212516D-01
ANorm= 0.1057001159D+01
E2 = -0.2828252947D+00 EUMP2 = -0.58166333791226D+03
(S**2,0)= 0.00000D+00 (S**2,1)= 0.00000D+00
E(PUHF)= -0.58138051262D+03 E(PMP2)= -0.58166333791D+03
Leave Link 804 at Sat Mar 30 18:55:55 2019, MaxMem= 33554432 cpu: 113.7
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l913.exe)
CIDS: MDV= 33554432.
Frozen-core window: NFC= 10 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.
Would need an additional 1207410933 words for in-memory AO integral storage.
CCSD(T)
=======
Iterations= 50 Convergence= 0.100D-06
Iteration Nr. 1
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
FoFJK: IHMeth= 1 ICntrl= 200 DoSepK=F KAlg= 0 I1Cent= 0 FoldK=F
IRaf= 990000000 NMat= 140 IRICut= 227 DoRegI=T DoRafI=T 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= 200 IOpCl= 0 I1Cent= 0 NGrid= 0
NMat0= 140 NMatS0= 0 NMatT0= 49 NMatD0= 140 NMtDS0= 0 NMtDT0= 0
Petite list used in FoFCou.
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
MP4(R+Q)= 0.46785087D-01
Maximum subspace dimension= 5
Norm of the A-vectors is 9.7917614D-02 conv= 1.00D-05.
RLE energy= -0.2760214008
E3= -0.39813478D-01 EROMP3= -0.58170315139D+03
E4(SDQ)= -0.57906118D-02 ROMP4(SDQ)= -0.58170894200D+03
VARIATIONAL ENERGIES WITH THE FIRST-ORDER WAVEFUNCTION:
DE(Corr)= -0.27585369 E(Corr)= -581.65636630
NORM(A)= 0.10537219D+01
Iteration Nr. 2
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 5.6756291D-01 conv= 1.00D-05.
RLE energy= -0.2839445966
DE(Corr)= -0.31484771 E(CORR)= -581.69536033 Delta=-3.90D-02
NORM(A)= 0.10575218D+01
Iteration Nr. 3
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 4.8510098D-01 conv= 1.00D-05.
RLE energy= -0.3094817813
DE(Corr)= -0.31693644 E(CORR)= -581.69744905 Delta=-2.09D-03
NORM(A)= 0.10719480D+01
Iteration Nr. 4
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 2.1696598D-01 conv= 1.00D-05.
RLE energy= -0.3299197598
DE(Corr)= -0.32372937 E(CORR)= -581.70424199 Delta=-6.79D-03
NORM(A)= 0.10862279D+01
Iteration Nr. 5
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 1.5048389D-02 conv= 1.00D-05.
RLE energy= -0.3266834878
DE(Corr)= -0.32943609 E(CORR)= -581.70994871 Delta=-5.71D-03
NORM(A)= 0.10841272D+01
Iteration Nr. 6
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 2.8477811D-02 conv= 1.00D-05.
RLE energy= -0.3293186759
DE(Corr)= -0.32859422 E(CORR)= -581.70910684 Delta= 8.42D-04
NORM(A)= 0.10861097D+01
Iteration Nr. 7
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 1.1551225D-03 conv= 1.00D-05.
RLE energy= -0.3292901529
DE(Corr)= -0.32929810 E(CORR)= -581.70981071 Delta=-7.04D-04
NORM(A)= 0.10860955D+01
Iteration Nr. 8
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 3.7873410D-04 conv= 1.00D-05.
RLE energy= -0.3292902918
DE(Corr)= -0.32929218 E(CORR)= -581.70980479 Delta= 5.92D-06
NORM(A)= 0.10860949D+01
Iteration Nr. 9
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 1.0143321D-04 conv= 1.00D-05.
RLE energy= -0.3292914912
DE(Corr)= -0.32929102 E(CORR)= -581.70980363 Delta= 1.16D-06
NORM(A)= 0.10860959D+01
Iteration Nr. 10
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 3.0715500D-05 conv= 1.00D-05.
RLE energy= -0.3292914931
DE(Corr)= -0.32929146 E(CORR)= -581.70980407 Delta=-4.41D-07
NORM(A)= 0.10860961D+01
Iteration Nr. 11
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 1.0654183D-05 conv= 1.00D-05.
RLE energy= -0.3292915439
DE(Corr)= -0.32929149 E(CORR)= -581.70980411 Delta=-3.86D-08
NORM(A)= 0.10860962D+01
Iteration Nr. 12
**********************
DD1Dir will call FoFJK 1 times, MxPair= 140
NAB= 49 NAA= 21 NBB= 21 NumPrc= 1.
Norm of the A-vectors is 2.9777125D-06 conv= 1.00D-05.
RLE energy= -0.3292915350
DE(Corr)= -0.32929153 E(CORR)= -581.70980415 Delta=-3.82D-08
NORM(A)= 0.10860962D+01
CI/CC converged in 12 iterations to DelEn=-3.82D-08 Conv= 1.00D-07 ErrA1= 2.98D-06 Conv= 1.00D-05
Largest amplitude= 2.64D-02
Time for triples= 3054.27 seconds.
T4(CCSD)= -0.10649636D-01
T5(CCSD)= 0.23450960D-03
CCSD(T)= -0.58172021928D+03
Discarding MO integrals.
Leave Link 913 at Sat Mar 30 21:39:52 2019, MaxMem= 33554432 cpu: 4099.3
(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 (A1G) (A2U) (A1G) (A2U) (A1G) (EU) (EU) (EG) (EG)
(A2U) (A1G) (A2U) (EU) (EU) (EG) (EG) (A1G)
Virtual (A2U) (EU) (EU) (A1G) (EG) (EG) (A1G) (EU) (EU)
(A2U) (EG) (EG) (A2U) (EU) (EU) (EG) (EG) (A1G)
(EU) (EU) (A1G) (A2U) (EG) (EG) (A2U) (EG) (EG)
(A1G) (A2U) (EU) (EU) (A1U) (A1G) (A2G) (EG) (EG)
(EU) (EU) (A2U) (EG) (EG) (EU) (EU) (EU) (EU)
(A1G) (EG) (EG) (A1G) (A2U) (A1U) (EU) (EU) (A2U)
(EU) (EU) (EG) (EG) (A1G) (EG) (EG) (EG) (EG)
(A2U) (A2G) (EU) (EU) (A1G) (EG) (EG) (A2U) (EU)
(EU) (A2U) (A1G) (EU) (EU) (EG) (EG) (A1G) (A2U)
(A1G) (EU) (EU) (EG) (EG) (EU) (EU) (A1U) (A2G)
(EG) (EG) (A2U) (EG) (EG) (EU) (EU) (A1G) (A2U)
(EU) (EU) (EG) (EG) (A1G) (A1U) (EU) (EU) (A2U)
(EG) (EG) (EG) (EG) (A2G) (A1U) (EU) (EU) (A1G)
(A2U) (A2G) (EU) (EU) (EG) (EG) (EU) (EU) (A1G)
(EG) (EG) (A2U) (EG) (EG) (A2U) (A1G) (EU) (EU)
(A1U) (EG) (EG) (EU) (EU) (A1G) (EU) (EU) (A1G)
(A2G) (EG) (EG) (A2U) (A2U) (EG) (EG) (EU) (EU)
(EU) (EU) (EG) (EG) (A1G) (EG) (EG) (A2U) (EU)
(EU) (A2U) (EU) (EU) (A1G) (EG) (EG) (EG) (EG)
(A1U) (A1G) (EU) (EU) (A2G) (A2U) (A2G) (A1U)
(EG) (EG) (EU) (EU) (EG) (EG) (EU) (EU) (A1G)
(A2U) (A2U) (A1U) (A1G) (EG) (EG) (A2G) (EU) (EU)
(EU) (EU) (A2U) (EG) (EG) (A1G) (EU) (EU) (A2U)
(EG) (EG) (A1G) (EG) (EG) (EU) (EU) (EG) (EG)
(EU) (EU) (A1U) (A2G) (A1G) (A2U) (EG) (EG) (EU)
(EU) (A2U) (A1G) (EG) (EG) (EU) (EU) (EG) (EG)
(EU) (EU) (A1G) (A2U) (A1U) (EG) (EG) (A2G) (EU)
(EU) (A1U) (A2U) (EG) (EG) (EU) (EU) (EG) (EG)
(A2G) (A1G) (EU) (EU) (A1G) (A2U) (A1U) (EG) (EG)
(EU) (EU) (A2U) (A2G) (EU) (EU) (EG) (EG) (A1G)
(EG) (EG) (EU) (EU) (A1G) (A2U) (EG) (EG) (EU)
(EU) (A1G) (A2U)
The electronic state is 1-A1G.
Alpha occ. eigenvalues -- -68.77114 -68.77114 -6.12156 -6.12142 -4.22791
Alpha occ. eigenvalues -- -4.22760 -4.22760 -4.22752 -4.22752 -4.22723
Alpha occ. eigenvalues -- -0.75583 -0.67870 -0.49928 -0.49928 -0.47325
Alpha occ. eigenvalues -- -0.47325 -0.40488
Alpha virt. eigenvalues -- 0.09205 0.11878 0.11878 0.12094 0.13664
Alpha virt. eigenvalues -- 0.13664 0.16896 0.18641 0.18641 0.18708
Alpha virt. eigenvalues -- 0.21921 0.21921 0.24700 0.27089 0.27089
Alpha virt. eigenvalues -- 0.33608 0.33608 0.33931 0.34345 0.34345
Alpha virt. eigenvalues -- 0.36290 0.39773 0.42948 0.42948 0.46278
Alpha virt. eigenvalues -- 0.52173 0.52173 0.52574 0.56176 0.64156
Alpha virt. eigenvalues -- 0.64156 0.65427 0.67973 0.68740 0.74142
Alpha virt. eigenvalues -- 0.74142 0.76044 0.76044 0.80924 0.81394
Alpha virt. eigenvalues -- 0.81394 0.83001 0.83001 0.83829 0.83829
Alpha virt. eigenvalues -- 0.88986 0.89083 0.89083 0.93451 0.95463
Alpha virt. eigenvalues -- 0.95516 0.97238 0.97238 0.97364 1.03265
Alpha virt. eigenvalues -- 1.03265 1.05041 1.05041 1.05098 1.08105
Alpha virt. eigenvalues -- 1.08105 1.19266 1.19266 1.20406 1.22762
Alpha virt. eigenvalues -- 1.23671 1.23671 1.23807 1.25914 1.25914
Alpha virt. eigenvalues -- 1.26914 1.35233 1.35233 1.44257 1.44873
Alpha virt. eigenvalues -- 1.47652 1.47652 1.49323 1.49323 1.64079
Alpha virt. eigenvalues -- 1.70477 1.87317 1.89791 1.89791 1.90527
Alpha virt. eigenvalues -- 1.90527 1.95316 1.95316 1.95951 2.02014
Alpha virt. eigenvalues -- 2.02634 2.02634 2.11893 2.14345 2.14345
Alpha virt. eigenvalues -- 2.22035 2.22035 2.23653 2.24301 2.25222
Alpha virt. eigenvalues -- 2.25222 2.28104 2.28104 2.28104 2.28714
Alpha virt. eigenvalues -- 2.36872 2.36872 2.40808 2.41505 2.41505
Alpha virt. eigenvalues -- 2.44207 2.44207 2.45262 2.46405 2.47253
Alpha virt. eigenvalues -- 2.47253 2.48410 2.50066 2.56127 2.56676
Alpha virt. eigenvalues -- 2.56676 2.57807 2.57807 2.57979 2.57979
Alpha virt. eigenvalues -- 2.58647 2.63646 2.63646 2.65380 2.68814
Alpha virt. eigenvalues -- 2.68814 2.73418 2.73716 2.74632 2.74632
Alpha virt. eigenvalues -- 2.81089 2.84472 2.84472 2.85481 2.85481
Alpha virt. eigenvalues -- 2.87205 2.97013 2.97013 2.98284 3.00514
Alpha virt. eigenvalues -- 3.03310 3.03310 3.05434 3.10784 3.14574
Alpha virt. eigenvalues -- 3.14574 3.17718 3.17718 3.22294 3.22294
Alpha virt. eigenvalues -- 3.31358 3.31358 3.42857 3.47831 3.47831
Alpha virt. eigenvalues -- 3.50078 3.50836 3.50836 3.63230 3.64999
Alpha virt. eigenvalues -- 3.64999 3.68318 3.74094 3.74094 3.76994
Alpha virt. eigenvalues -- 3.76994 3.79926 3.83922 3.84598 3.84598
Alpha virt. eigenvalues -- 3.95412 4.13076 6.07821 6.07957 6.11320
Alpha virt. eigenvalues -- 6.11320 6.11586 6.11586 6.13956 6.13956
Alpha virt. eigenvalues -- 6.16360 6.16360 6.21297 6.22791 6.26954
Alpha virt. eigenvalues -- 6.31677 6.34918 6.37303 6.37303 6.39165
Alpha virt. eigenvalues -- 6.40547 6.40547 6.48979 6.48979 6.52011
Alpha virt. eigenvalues -- 6.54290 6.54290 6.56495 6.66185 6.66185
Alpha virt. eigenvalues -- 6.66773 6.68643 6.68643 6.70956 6.79415
Alpha virt. eigenvalues -- 6.79415 6.80156 6.80156 6.87361 6.87361
Alpha virt. eigenvalues -- 6.98264 6.98264 7.04840 7.08982 7.25812
Alpha virt. eigenvalues -- 7.59351 7.60045 7.60045 7.68878 7.68878
Alpha virt. eigenvalues -- 7.90891 7.96262 8.01176 8.01176 8.04404
Alpha virt. eigenvalues -- 8.04404 8.21340 8.21340 8.22174 8.22174
Alpha virt. eigenvalues -- 8.22647 8.23276 8.30680 8.33811 8.33811
Alpha virt. eigenvalues -- 8.35498 8.37486 8.37486 8.41661 8.44435
Alpha virt. eigenvalues -- 8.44501 8.44501 8.48705 8.48705 8.49024
Alpha virt. eigenvalues -- 8.49024 8.51269 8.52551 8.54571 8.54571
Alpha virt. eigenvalues -- 8.64969 8.66289 8.86932 8.94990 8.94990
Alpha virt. eigenvalues -- 9.02448 9.02448 9.06479 9.07951 9.11624
Alpha virt. eigenvalues -- 9.11624 9.12583 9.12583 9.15479 9.34238
Alpha virt. eigenvalues -- 9.34238 9.38263 9.38263 9.49857 9.52150
Alpha virt. eigenvalues -- 10.45715 10.45715 10.48452 10.48452 13.12729
Alpha virt. eigenvalues -- 13.40348
Molecular Orbital Coefficients:
1 2 3 4 5
(A1G)--O (A2U)--O (A1G)--O (A2U)--O (A1G)--O
Eigenvalues -- -68.77114 -68.77114 -6.12156 -6.12142 -4.22791
1 1 Si 1S 0.70742 0.70742 -0.18874 -0.18876 -0.00013
2 2S -0.00331 -0.00332 0.37027 0.37035 0.00027
3 3S -0.00181 -0.00182 -0.36708 -0.36713 -0.00034
4 4S -0.00059 -0.00070 0.02508 0.02604 -0.00102
5 5S 0.00008 0.00036 -0.01574 -0.01875 0.00212
6 6S -0.00012 0.00003 0.00219 0.00415 0.00055
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 0.00002 0.00002 -0.00006 -0.00005 0.75366
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 0.00002 0.00002 0.00016 0.00020 0.10621
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 -0.00004 -0.00002 -0.00079 -0.00094 0.01528
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 -0.00006 -0.00041 -0.00207 -0.00027 -0.00032
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 -0.00001 -0.00005 -0.00004 -0.00069 0.00004
22 12D 0 0.00002 0.00012 0.00088 0.00024 0.00036
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00004 0.00014 0.00105 0.00050 -0.00124
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 -0.00002 -0.00003 0.00007 0.00035
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15F 0 -0.00003 -0.00004 0.00053 0.00070 -0.00037
38 15F+1 0.00000 0.00000 0.00000 0.00000 0.00000
39 15F-1 0.00000 0.00000 0.00000 0.00000 0.00000
40 15F+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15F-2 0.00000 0.00000 0.00000 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.00001 0.00002 0.00111 0.00083 -0.00032
44 16F 0 0.00005 0.00004 0.00019 0.00026 0.00008
45 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
48 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00006 0.00006 0.00027 0.00040 -0.00015
51 17G 0 0.00002 0.00001 -0.00003 -0.00002 -0.00014
52 17G+1 0.00000 0.00000 0.00000 0.00000 0.00000
53 17G-1 0.00000 0.00000 0.00000 0.00000 0.00000
54 17G+2 0.00000 0.00000 0.00000 0.00000 0.00000
55 17G-2 0.00000 0.00000 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00002 0.00003 0.00022 0.00021 -0.00011
58 17G+4 0.00000 0.00000 0.00000 0.00000 0.00000
59 17G-4 0.00000 0.00000 0.00000 0.00000 0.00000
60 2 Si 1S 0.70742 -0.70742 -0.18874 0.18876 -0.00013
61 2S -0.00331 0.00332 0.37027 -0.37035 0.00027
62 3S -0.00181 0.00182 -0.36708 0.36713 -0.00034
63 4S -0.00059 0.00070 0.02508 -0.02604 -0.00102
64 5S 0.00008 -0.00036 -0.01574 0.01875 0.00212
65 6S -0.00012 -0.00003 0.00219 -0.00415 0.00055
66 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
67 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
68 7PZ -0.00002 0.00002 0.00006 -0.00005 -0.75366
69 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
70 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
71 8PZ -0.00002 0.00002 -0.00016 0.00020 -0.10621
72 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
73 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
74 9PZ 0.00004 -0.00002 0.00079 -0.00094 -0.01528
75 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
76 10PY 0.00000 0.00000 0.00000 0.00000 0.00000
77 10PZ 0.00006 -0.00041 0.00207 -0.00027 0.00032
78 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
79 11PY 0.00000 0.00000 0.00000 0.00000 0.00000
80 11PZ 0.00001 -0.00005 0.00004 -0.00069 -0.00004
81 12D 0 0.00002 -0.00012 0.00088 -0.00024 0.00036
82 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
83 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
84 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 13D 0 0.00004 -0.00014 0.00105 -0.00050 -0.00124
87 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
88 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
89 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
90 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
91 14D 0 0.00000 0.00002 -0.00003 -0.00007 0.00035
92 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
93 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
94 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
95 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
96 15F 0 0.00003 -0.00004 -0.00053 0.00070 0.00037
97 15F+1 0.00000 0.00000 0.00000 0.00000 0.00000
98 15F-1 0.00000 0.00000 0.00000 0.00000 0.00000
99 15F+2 0.00000 0.00000 0.00000 0.00000 0.00000
100 15F-2 0.00000 0.00000 0.00000 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00001 0.00002 -0.00111 0.00083 0.00032
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109 16F-3 -0.00006 0.00006 -0.00027 0.00040 0.00015
110 17G 0 0.00002 -0.00001 -0.00003 0.00002 -0.00014
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113 17G+2 0.00000 0.00000 0.00000 0.00000 0.00000
114 17G-2 0.00000 0.00000 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00002 -0.00003 0.00022 -0.00021 -0.00011
117 17G+4 0.00000 0.00000 0.00000 0.00000 0.00000
118 17G-4 0.00000 0.00000 0.00000 0.00000 0.00000
119 3 H 1S -0.00001 -0.00001 0.00005 0.00005 0.00007
120 2S 0.00001 0.00002 0.00006 0.00000 0.00030
121 3S 0.00008 0.00011 0.00362 0.00366 -0.00101
122 4S 0.00003 0.00003 -0.00034 -0.00028 -0.00010
123 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
124 5PY 0.00001 0.00001 0.00003 0.00004 -0.00005
125 5PZ 0.00000 0.00000 0.00002 0.00001 0.00000
126 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
127 6PY -0.00004 -0.00004 -0.00030 -0.00030 -0.00010
128 6PZ -0.00001 -0.00002 -0.00014 -0.00008 0.00000
129 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
130 7PY -0.00005 -0.00005 -0.00110 -0.00131 0.00054
131 7PZ -0.00002 -0.00001 -0.00044 -0.00064 0.00022
132 8D 0 0.00000 0.00000 -0.00002 -0.00002 -0.00003
133 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
134 8D-1 0.00000 0.00000 0.00003 0.00002 0.00001
135 8D+2 0.00000 0.00000 -0.00004 -0.00004 -0.00005
136 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
137 9D 0 -0.00001 -0.00001 -0.00006 -0.00006 0.00001
138 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
139 9D-1 0.00002 0.00002 0.00014 0.00019 -0.00002
140 9D+2 -0.00003 -0.00002 -0.00017 -0.00023 0.00003
141 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
142 10F 0 0.00000 0.00000 0.00004 0.00004 0.00001
143 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
144 10F-1 0.00000 0.00000 0.00002 0.00002 0.00002
145 10F+2 0.00000 0.00000 0.00006 0.00006 0.00000
146 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
147 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
148 10F-3 0.00000 0.00000 0.00006 0.00007 0.00002
149 4 H 1S -0.00001 -0.00001 0.00005 0.00005 0.00007
150 2S 0.00001 0.00002 0.00006 0.00000 0.00030
151 3S 0.00008 0.00011 0.00362 0.00366 -0.00101
152 4S 0.00003 0.00003 -0.00034 -0.00028 -0.00010
153 5PX -0.00001 -0.00001 -0.00003 -0.00003 0.00004
154 5PY 0.00000 0.00000 -0.00002 -0.00002 0.00002
155 5PZ 0.00000 0.00000 0.00002 0.00001 0.00000
156 6PX 0.00004 0.00004 0.00026 0.00026 0.00008
157 6PY 0.00002 0.00002 0.00015 0.00015 0.00005
158 6PZ -0.00001 -0.00002 -0.00014 -0.00008 0.00000
159 7PX 0.00005 0.00004 0.00095 0.00114 -0.00046
160 7PY 0.00003 0.00002 0.00055 0.00066 -0.00027
161 7PZ -0.00002 -0.00001 -0.00044 -0.00064 0.00022
162 8D 0 0.00000 0.00000 -0.00002 -0.00002 -0.00003
163 8D+1 0.00000 0.00000 -0.00003 -0.00002 -0.00001
164 8D-1 0.00000 0.00000 -0.00002 -0.00001 0.00000
165 8D+2 0.00000 0.00000 0.00002 0.00002 0.00003
166 8D-2 0.00000 0.00000 0.00004 0.00003 0.00005
167 9D 0 -0.00001 -0.00001 -0.00006 -0.00006 0.00001
168 9D+1 -0.00001 -0.00002 -0.00012 -0.00016 0.00002
169 9D-1 -0.00001 -0.00001 -0.00007 -0.00009 0.00001
170 9D+2 0.00001 0.00001 0.00009 0.00011 -0.00001
171 9D-2 0.00002 0.00002 0.00015 0.00020 -0.00002
172 10F 0 0.00000 0.00000 0.00004 0.00004 0.00001
173 10F+1 0.00000 0.00000 -0.00002 -0.00002 -0.00002
174 10F-1 0.00000 0.00000 -0.00001 -0.00001 -0.00001
175 10F+2 0.00000 0.00000 -0.00003 -0.00003 0.00000
176 10F-2 0.00000 0.00000 -0.00005 -0.00005 0.00000
177 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
178 10F-3 0.00000 0.00000 0.00006 0.00007 0.00002
179 5 H 1S -0.00001 -0.00001 0.00005 0.00005 0.00007
180 2S 0.00001 0.00002 0.00006 0.00000 0.00030
181 3S 0.00008 0.00011 0.00362 0.00366 -0.00101
182 4S 0.00003 0.00003 -0.00034 -0.00028 -0.00010
183 5PX 0.00001 0.00001 0.00003 0.00003 -0.00004
184 5PY 0.00000 0.00000 -0.00002 -0.00002 0.00002
185 5PZ 0.00000 0.00000 0.00002 0.00001 0.00000
186 6PX -0.00004 -0.00004 -0.00026 -0.00026 -0.00008
187 6PY 0.00002 0.00002 0.00015 0.00015 0.00005
188 6PZ -0.00001 -0.00002 -0.00014 -0.00008 0.00000
189 7PX -0.00005 -0.00004 -0.00095 -0.00114 0.00046
190 7PY 0.00003 0.00002 0.00055 0.00066 -0.00027
191 7PZ -0.00002 -0.00001 -0.00044 -0.00064 0.00022
192 8D 0 0.00000 0.00000 -0.00002 -0.00002 -0.00003
193 8D+1 0.00000 0.00000 0.00003 0.00002 0.00001
194 8D-1 0.00000 0.00000 -0.00002 -0.00001 0.00000
195 8D+2 0.00000 0.00000 0.00002 0.00002 0.00003
196 8D-2 0.00000 0.00000 -0.00004 -0.00003 -0.00005
197 9D 0 -0.00001 -0.00001 -0.00006 -0.00006 0.00001
198 9D+1 0.00001 0.00002 0.00012 0.00016 -0.00002
199 9D-1 -0.00001 -0.00001 -0.00007 -0.00009 0.00001
200 9D+2 0.00001 0.00001 0.00009 0.00011 -0.00001
201 9D-2 -0.00002 -0.00002 -0.00015 -0.00020 0.00002
202 10F 0 0.00000 0.00000 0.00004 0.00004 0.00001
203 10F+1 0.00000 0.00000 0.00002 0.00002 0.00002
204 10F-1 0.00000 0.00000 -0.00001 -0.00001 -0.00001
205 10F+2 0.00000 0.00000 -0.00003 -0.00003 0.00000
206 10F-2 0.00000 0.00000 0.00005 0.00005 0.00000
207 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
208 10F-3 0.00000 0.00000 0.00006 0.00007 0.00002
209 6 H 1S -0.00001 0.00001 0.00005 -0.00005 0.00007
210 2S 0.00001 -0.00002 0.00006 0.00000 0.00030
211 3S 0.00008 -0.00011 0.00362 -0.00366 -0.00101
212 4S 0.00003 -0.00003 -0.00034 0.00028 -0.00010
213 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
214 5PY -0.00001 0.00001 -0.00003 0.00004 0.00005
215 5PZ 0.00000 0.00000 -0.00002 0.00001 0.00000
216 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
217 6PY 0.00004 -0.00004 0.00030 -0.00030 0.00010
218 6PZ 0.00001 -0.00002 0.00014 -0.00008 0.00000
219 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
220 7PY 0.00005 -0.00005 0.00110 -0.00131 -0.00054
221 7PZ 0.00002 -0.00001 0.00044 -0.00064 -0.00022
222 8D 0 0.00000 0.00000 -0.00002 0.00002 -0.00003
223 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
224 8D-1 0.00000 0.00000 0.00003 -0.00002 0.00001
225 8D+2 0.00000 0.00000 -0.00004 0.00004 -0.00005
226 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
227 9D 0 -0.00001 0.00001 -0.00006 0.00006 0.00001
228 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
229 9D-1 0.00002 -0.00002 0.00014 -0.00019 -0.00002
230 9D+2 -0.00003 0.00002 -0.00017 0.00023 0.00003
231 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
232 10F 0 0.00000 0.00000 -0.00004 0.00004 -0.00001
233 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
234 10F-1 0.00000 0.00000 -0.00002 0.00002 -0.00002
235 10F+2 0.00000 0.00000 -0.00006 0.00006 0.00000
236 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
237 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
238 10F-3 0.00000 0.00000 -0.00006 0.00007 -0.00002
239 7 H 1S -0.00001 0.00001 0.00005 -0.00005 0.00007
240 2S 0.00001 -0.00002 0.00006 0.00000 0.00030
241 3S 0.00008 -0.00011 0.00362 -0.00366 -0.00101
242 4S 0.00003 -0.00003 -0.00034 0.00028 -0.00010
243 5PX -0.00001 0.00001 -0.00003 0.00003 0.00004
244 5PY 0.00000 0.00000 0.00002 -0.00002 -0.00002
245 5PZ 0.00000 0.00000 -0.00002 0.00001 0.00000
246 6PX 0.00004 -0.00004 0.00026 -0.00026 0.00008
247 6PY -0.00002 0.00002 -0.00015 0.00015 -0.00005
248 6PZ 0.00001 -0.00002 0.00014 -0.00008 0.00000
249 7PX 0.00005 -0.00004 0.00095 -0.00114 -0.00046
250 7PY -0.00003 0.00002 -0.00055 0.00066 0.00027
251 7PZ 0.00002 -0.00001 0.00044 -0.00064 -0.00022
252 8D 0 0.00000 0.00000 -0.00002 0.00002 -0.00003
253 8D+1 0.00000 0.00000 0.00003 -0.00002 0.00001
254 8D-1 0.00000 0.00000 -0.00002 0.00001 0.00000
255 8D+2 0.00000 0.00000 0.00002 -0.00002 0.00003
256 8D-2 0.00000 0.00000 -0.00004 0.00003 -0.00005
257 9D 0 -0.00001 0.00001 -0.00006 0.00006 0.00001
258 9D+1 0.00001 -0.00002 0.00012 -0.00016 -0.00002
259 9D-1 -0.00001 0.00001 -0.00007 0.00009 0.00001
260 9D+2 0.00001 -0.00001 0.00009 -0.00011 -0.00001
261 9D-2 -0.00002 0.00002 -0.00015 0.00020 0.00002
262 10F 0 0.00000 0.00000 -0.00004 0.00004 -0.00001
263 10F+1 0.00000 0.00000 -0.00002 0.00002 -0.00002
264 10F-1 0.00000 0.00000 0.00001 -0.00001 0.00001
265 10F+2 0.00000 0.00000 0.00003 -0.00003 0.00000
266 10F-2 0.00000 0.00000 -0.00005 0.00005 0.00000
267 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
268 10F-3 0.00000 0.00000 -0.00006 0.00007 -0.00002
269 8 H 1S -0.00001 0.00001 0.00005 -0.00005 0.00007
270 2S 0.00001 -0.00002 0.00006 0.00000 0.00030
271 3S 0.00008 -0.00011 0.00362 -0.00366 -0.00101
272 4S 0.00003 -0.00003 -0.00034 0.00028 -0.00010
273 5PX 0.00001 -0.00001 0.00003 -0.00003 -0.00004
274 5PY 0.00000 0.00000 0.00002 -0.00002 -0.00002
275 5PZ 0.00000 0.00000 -0.00002 0.00001 0.00000
276 6PX -0.00004 0.00004 -0.00026 0.00026 -0.00008
277 6PY -0.00002 0.00002 -0.00015 0.00015 -0.00005
278 6PZ 0.00001 -0.00002 0.00014 -0.00008 0.00000
279 7PX -0.00005 0.00004 -0.00095 0.00114 0.00046
280 7PY -0.00003 0.00002 -0.00055 0.00066 0.00027
281 7PZ 0.00002 -0.00001 0.00044 -0.00064 -0.00022
282 8D 0 0.00000 0.00000 -0.00002 0.00002 -0.00003
283 8D+1 0.00000 0.00000 -0.00003 0.00002 -0.00001
284 8D-1 0.00000 0.00000 -0.00002 0.00001 0.00000
285 8D+2 0.00000 0.00000 0.00002 -0.00002 0.00003
286 8D-2 0.00000 0.00000 0.00004 -0.00003 0.00005
287 9D 0 -0.00001 0.00001 -0.00006 0.00006 0.00001
288 9D+1 -0.00001 0.00002 -0.00012 0.00016 0.00002
289 9D-1 -0.00001 0.00001 -0.00007 0.00009 0.00001
290 9D+2 0.00001 -0.00001 0.00009 -0.00011 -0.00001
291 9D-2 0.00002 -0.00002 0.00015 -0.00020 -0.00002
292 10F 0 0.00000 0.00000 -0.00004 0.00004 -0.00001
293 10F+1 0.00000 0.00000 0.00002 -0.00002 0.00002
294 10F-1 0.00000 0.00000 0.00001 -0.00001 0.00001
295 10F+2 0.00000 0.00000 0.00003 -0.00003 0.00000
296 10F-2 0.00000 0.00000 0.00005 -0.00005 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 -0.00006 0.00007 -0.00002
6 7 8 9 10
(EU)--O (EU)--O (EG)--O (EG)--O (A2U)--O
Eigenvalues -- -4.22760 -4.22760 -4.22752 -4.22752 -4.22723
1 1 Si 1S 0.00000 0.00000 0.00000 0.00000 -0.00001
2 2S 0.00000 0.00000 0.00000 0.00000 0.00005
3 3S 0.00000 0.00000 0.00000 0.00000 0.00011
4 4S 0.00000 0.00000 0.00000 0.00000 0.00033
5 5S 0.00000 0.00000 0.00000 0.00000 -0.00030
6 6S 0.00000 0.00000 0.00000 0.00000 0.00285
7 7PX 0.00000 0.75389 0.00000 0.75396 0.00000
8 7PY 0.75389 0.00000 0.75396 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.75412
10 8PX 0.00000 0.10632 0.00000 0.10634 0.00000
11 8PY 0.10632 0.00000 0.10634 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.10624
13 9PX 0.00000 0.01482 0.00000 0.01481 0.00000
14 9PY 0.01482 0.00000 0.01481 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.01472
16 10PX 0.00000 0.00069 0.00000 -0.00027 0.00000
17 10PY 0.00069 0.00000 -0.00027 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 -0.00179
19 11PX 0.00000 0.00034 0.00000 0.00031 0.00000
20 11PY 0.00034 0.00000 0.00031 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.00054
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.00043
23 12D+1 0.00000 0.00028 0.00000 0.00074 0.00000
24 12D-1 0.00028 0.00000 0.00074 0.00000 0.00000
25 12D+2 -0.00036 0.00000 -0.00034 0.00000 0.00000
26 12D-2 0.00000 -0.00036 0.00000 -0.00034 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.00124
28 13D+1 0.00000 0.00080 0.00000 0.00088 0.00000
29 13D-1 0.00080 0.00000 0.00088 0.00000 0.00000
30 13D+2 -0.00131 0.00000 -0.00117 0.00000 0.00000
31 13D-2 0.00000 -0.00131 0.00000 -0.00117 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00053
33 14D+1 0.00000 -0.00044 0.00000 -0.00045 0.00000
34 14D-1 -0.00044 0.00000 -0.00045 0.00000 0.00000
35 14D+2 0.00051 0.00000 0.00050 0.00000 0.00000
36 14D-2 0.00000 0.00051 0.00000 0.00050 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00015
38 15F+1 0.00000 -0.00008 0.00000 -0.00034 0.00000
39 15F-1 -0.00008 0.00000 -0.00034 0.00000 0.00000
40 15F+2 -0.00048 0.00000 -0.00039 0.00000 0.00000
41 15F-2 0.00000 -0.00048 0.00000 -0.00039 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 -0.00022
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00009
45 16F+1 0.00000 0.00002 0.00000 0.00002 0.00000
46 16F-1 0.00002 0.00000 0.00002 0.00000 0.00000
47 16F+2 -0.00011 0.00000 -0.00009 0.00000 0.00000
48 16F-2 0.00000 -0.00011 0.00000 -0.00009 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 -0.00009
51 17G 0 0.00000 0.00000 0.00000 0.00000 -0.00004
52 17G+1 0.00000 -0.00013 0.00000 -0.00006 0.00000
53 17G-1 -0.00013 0.00000 -0.00006 0.00000 0.00000
54 17G+2 0.00001 0.00000 0.00000 0.00000 0.00000
55 17G-2 0.00000 0.00001 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 -0.00004
58 17G+4 0.00008 0.00000 0.00006 0.00000 0.00000
59 17G-4 0.00000 -0.00008 0.00000 -0.00006 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00001
61 2S 0.00000 0.00000 0.00000 0.00000 -0.00005
62 3S 0.00000 0.00000 0.00000 0.00000 -0.00011
63 4S 0.00000 0.00000 0.00000 0.00000 -0.00033
64 5S 0.00000 0.00000 0.00000 0.00000 0.00030
65 6S 0.00000 0.00000 0.00000 0.00000 -0.00285
66 7PX 0.00000 0.75389 0.00000 -0.75396 0.00000
67 7PY 0.75389 0.00000 -0.75396 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.75412
69 8PX 0.00000 0.10632 0.00000 -0.10634 0.00000
70 8PY 0.10632 0.00000 -0.10634 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.10624
72 9PX 0.00000 0.01482 0.00000 -0.01481 0.00000
73 9PY 0.01482 0.00000 -0.01481 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.01472
75 10PX 0.00000 0.00069 0.00000 0.00027 0.00000
76 10PY 0.00069 0.00000 0.00027 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 -0.00179
78 11PX 0.00000 0.00034 0.00000 -0.00031 0.00000
79 11PY 0.00034 0.00000 -0.00031 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 -0.00054
81 12D 0 0.00000 0.00000 0.00000 0.00000 -0.00043
82 12D+1 0.00000 -0.00028 0.00000 0.00074 0.00000
83 12D-1 -0.00028 0.00000 0.00074 0.00000 0.00000
84 12D+2 0.00036 0.00000 -0.00034 0.00000 0.00000
85 12D-2 0.00000 0.00036 0.00000 -0.00034 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00124
87 13D+1 0.00000 -0.00080 0.00000 0.00088 0.00000
88 13D-1 -0.00080 0.00000 0.00088 0.00000 0.00000
89 13D+2 0.00131 0.00000 -0.00117 0.00000 0.00000
90 13D-2 0.00000 0.00131 0.00000 -0.00117 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 -0.00053
92 14D+1 0.00000 0.00044 0.00000 -0.00045 0.00000
93 14D-1 0.00044 0.00000 -0.00045 0.00000 0.00000
94 14D+2 -0.00051 0.00000 0.00050 0.00000 0.00000
95 14D-2 0.00000 -0.00051 0.00000 0.00050 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00015
97 15F+1 0.00000 -0.00008 0.00000 0.00034 0.00000
98 15F-1 -0.00008 0.00000 0.00034 0.00000 0.00000
99 15F+2 -0.00048 0.00000 0.00039 0.00000 0.00000
100 15F-2 0.00000 -0.00048 0.00000 0.00039 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 -0.00022
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00009
104 16F+1 0.00000 0.00002 0.00000 -0.00002 0.00000
105 16F-1 0.00002 0.00000 -0.00002 0.00000 0.00000
106 16F+2 -0.00011 0.00000 0.00009 0.00000 0.00000
107 16F-2 0.00000 -0.00011 0.00000 0.00009 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 -0.00009
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00004
111 17G+1 0.00000 0.00013 0.00000 -0.00006 0.00000
112 17G-1 0.00013 0.00000 -0.00006 0.00000 0.00000
113 17G+2 -0.00001 0.00000 0.00000 0.00000 0.00000
114 17G-2 0.00000 -0.00001 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00004
117 17G+4 -0.00008 0.00000 0.00006 0.00000 0.00000
118 17G-4 0.00000 0.00008 0.00000 -0.00006 0.00000
119 3 H 1S 0.00021 0.00000 0.00021 0.00000 0.00008
120 2S 0.00065 0.00000 0.00063 0.00000 0.00021
121 3S -0.00160 0.00000 -0.00125 0.00000 -0.00017
122 4S -0.00039 0.00000 -0.00037 0.00000 -0.00018
123 5PX 0.00000 0.00001 0.00000 0.00001 0.00000
124 5PY -0.00010 0.00000 -0.00009 0.00000 -0.00004
125 5PZ -0.00004 0.00000 -0.00005 0.00000 -0.00001
126 6PX 0.00000 0.00006 0.00000 0.00006 0.00000
127 6PY -0.00021 0.00000 -0.00025 0.00000 -0.00009
128 6PZ -0.00010 0.00000 -0.00008 0.00000 0.00003
129 7PX 0.00000 0.00015 0.00000 0.00017 0.00000
130 7PY 0.00083 0.00000 0.00069 0.00000 0.00006
131 7PZ 0.00021 0.00000 0.00011 0.00000 0.00024
132 8D 0 -0.00004 0.00000 -0.00004 0.00000 -0.00002
133 8D+1 0.00000 -0.00001 0.00000 -0.00001 0.00000
134 8D-1 0.00008 0.00000 0.00008 0.00000 0.00001
135 8D+2 -0.00009 0.00000 -0.00009 0.00000 -0.00004
136 8D-2 0.00000 -0.00002 0.00000 -0.00002 0.00000
137 9D 0 0.00000 0.00000 0.00000 0.00000 -0.00006
138 9D+1 0.00000 0.00000 0.00000 -0.00002 0.00000
139 9D-1 0.00005 0.00000 0.00006 0.00000 -0.00003
140 9D+2 -0.00005 0.00000 -0.00007 0.00000 -0.00005
141 9D-2 0.00000 -0.00005 0.00000 -0.00005 0.00000
142 10F 0 0.00003 0.00000 0.00003 0.00000 0.00000
143 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
144 10F-1 0.00001 0.00000 0.00001 0.00000 0.00003
145 10F+2 0.00005 0.00000 0.00005 0.00000 0.00000
146 10F-2 0.00000 0.00002 0.00000 0.00002 0.00000
147 10F+3 0.00000 -0.00003 0.00000 -0.00003 0.00000
148 10F-3 0.00004 0.00000 0.00004 0.00000 0.00003
149 4 H 1S -0.00010 -0.00018 -0.00010 -0.00018 0.00008
150 2S -0.00032 -0.00056 -0.00032 -0.00055 0.00021
151 3S 0.00080 0.00139 0.00062 0.00108 -0.00017
152 4S 0.00020 0.00034 0.00019 0.00032 -0.00018
153 5PX -0.00005 -0.00007 -0.00004 -0.00007 0.00004
154 5PY -0.00002 -0.00005 -0.00002 -0.00004 0.00002
155 5PZ 0.00002 0.00004 0.00002 0.00004 -0.00001
156 6PX -0.00012 -0.00014 -0.00013 -0.00017 0.00008
157 6PY -0.00001 -0.00012 -0.00002 -0.00013 0.00005
158 6PZ 0.00005 0.00009 0.00004 0.00007 0.00003
159 7PX 0.00029 0.00066 0.00022 0.00056 -0.00005
160 7PY 0.00032 0.00029 0.00030 0.00022 -0.00003
161 7PZ -0.00010 -0.00018 -0.00005 -0.00009 0.00024
162 8D 0 0.00002 0.00003 0.00002 0.00003 -0.00002
163 8D+1 0.00004 0.00005 0.00004 0.00006 -0.00001
164 8D-1 0.00001 0.00004 0.00001 0.00004 0.00000
165 8D+2 -0.00004 -0.00003 -0.00004 -0.00003 0.00002
166 8D-2 -0.00003 -0.00007 -0.00003 -0.00007 0.00003
167 9D 0 0.00000 0.00000 0.00000 0.00000 -0.00006
168 9D+1 0.00002 0.00004 0.00004 0.00004 0.00003
169 9D-1 0.00001 0.00002 0.00000 0.00004 0.00002
170 9D+2 -0.00005 0.00000 -0.00006 -0.00001 0.00002
171 9D-2 0.00000 -0.00005 -0.00001 -0.00007 0.00004
172 10F 0 -0.00002 -0.00003 -0.00002 -0.00003 0.00000
173 10F+1 0.00000 0.00000 0.00000 0.00000 -0.00003
174 10F-1 0.00000 0.00000 0.00000 0.00000 -0.00002
175 10F+2 0.00002 0.00001 0.00003 0.00002 0.00000
176 10F-2 0.00001 0.00004 0.00002 0.00004 0.00000
177 10F+3 -0.00002 0.00001 -0.00003 0.00001 0.00000
178 10F-3 -0.00002 -0.00004 -0.00002 -0.00004 0.00003
179 5 H 1S -0.00010 0.00018 -0.00010 0.00018 0.00008
180 2S -0.00032 0.00056 -0.00032 0.00055 0.00021
181 3S 0.00080 -0.00139 0.00062 -0.00108 -0.00017
182 4S 0.00020 -0.00034 0.00019 -0.00032 -0.00018
183 5PX 0.00005 -0.00007 0.00004 -0.00007 -0.00004
184 5PY -0.00002 0.00005 -0.00002 0.00004 0.00002
185 5PZ 0.00002 -0.00004 0.00002 -0.00004 -0.00001
186 6PX 0.00012 -0.00014 0.00013 -0.00017 -0.00008
187 6PY -0.00001 0.00012 -0.00002 0.00013 0.00005
188 6PZ 0.00005 -0.00009 0.00004 -0.00007 0.00003
189 7PX -0.00029 0.00066 -0.00022 0.00056 0.00005
190 7PY 0.00032 -0.00029 0.00030 -0.00022 -0.00003
191 7PZ -0.00010 0.00018 -0.00005 0.00009 0.00024
192 8D 0 0.00002 -0.00003 0.00002 -0.00003 -0.00002
193 8D+1 -0.00004 0.00005 -0.00004 0.00006 0.00001
194 8D-1 0.00001 -0.00004 0.00001 -0.00004 0.00000
195 8D+2 -0.00004 0.00003 -0.00004 0.00003 0.00002
196 8D-2 0.00003 -0.00007 0.00003 -0.00007 -0.00003
197 9D 0 0.00000 0.00000 0.00000 0.00000 -0.00006
198 9D+1 -0.00002 0.00004 -0.00004 0.00004 -0.00003
199 9D-1 0.00001 -0.00002 0.00000 -0.00004 0.00002
200 9D+2 -0.00005 0.00000 -0.00006 0.00001 0.00002
201 9D-2 0.00000 -0.00005 0.00001 -0.00007 -0.00004
202 10F 0 -0.00002 0.00003 -0.00002 0.00003 0.00000
203 10F+1 0.00000 0.00000 0.00000 0.00000 0.00003
204 10F-1 0.00000 0.00000 0.00000 0.00000 -0.00002
205 10F+2 0.00002 -0.00001 0.00003 -0.00002 0.00000
206 10F-2 -0.00001 0.00004 -0.00002 0.00004 0.00000
207 10F+3 0.00002 0.00001 0.00003 0.00001 0.00000
208 10F-3 -0.00002 0.00004 -0.00002 0.00004 0.00003
209 6 H 1S -0.00021 0.00000 0.00021 0.00000 -0.00008
210 2S -0.00065 0.00000 0.00063 0.00000 -0.00021
211 3S 0.00160 0.00000 -0.00125 0.00000 0.00017
212 4S 0.00039 0.00000 -0.00037 0.00000 0.00018
213 5PX 0.00000 0.00001 0.00000 -0.00001 0.00000
214 5PY -0.00010 0.00000 0.00009 0.00000 -0.00004
215 5PZ -0.00004 0.00000 0.00005 0.00000 -0.00001
216 6PX 0.00000 0.00006 0.00000 -0.00006 0.00000
217 6PY -0.00021 0.00000 0.00025 0.00000 -0.00009
218 6PZ -0.00010 0.00000 0.00008 0.00000 0.00003
219 7PX 0.00000 0.00015 0.00000 -0.00017 0.00000
220 7PY 0.00083 0.00000 -0.00069 0.00000 0.00006
221 7PZ 0.00021 0.00000 -0.00011 0.00000 0.00024
222 8D 0 0.00004 0.00000 -0.00004 0.00000 0.00002
223 8D+1 0.00000 0.00001 0.00000 -0.00001 0.00000
224 8D-1 -0.00008 0.00000 0.00008 0.00000 -0.00001
225 8D+2 0.00009 0.00000 -0.00009 0.00000 0.00004
226 8D-2 0.00000 0.00002 0.00000 -0.00002 0.00000
227 9D 0 0.00000 0.00000 0.00000 0.00000 0.00006
228 9D+1 0.00000 0.00000 0.00000 -0.00002 0.00000
229 9D-1 -0.00005 0.00000 0.00006 0.00000 0.00003
230 9D+2 0.00005 0.00000 -0.00007 0.00000 0.00005
231 9D-2 0.00000 0.00005 0.00000 -0.00005 0.00000
232 10F 0 0.00003 0.00000 -0.00003 0.00000 0.00000
233 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
234 10F-1 0.00001 0.00000 -0.00001 0.00000 0.00003
235 10F+2 0.00005 0.00000 -0.00005 0.00000 0.00000
236 10F-2 0.00000 0.00002 0.00000 -0.00002 0.00000
237 10F+3 0.00000 -0.00003 0.00000 0.00003 0.00000
238 10F-3 0.00004 0.00000 -0.00004 0.00000 0.00003
239 7 H 1S 0.00010 -0.00018 -0.00010 0.00018 -0.00008
240 2S 0.00032 -0.00056 -0.00032 0.00055 -0.00021
241 3S -0.00080 0.00139 0.00062 -0.00108 0.00017
242 4S -0.00020 0.00034 0.00019 -0.00032 0.00018
243 5PX 0.00005 -0.00007 -0.00004 0.00007 -0.00004
244 5PY -0.00002 0.00005 0.00002 -0.00004 0.00002
245 5PZ 0.00002 -0.00004 -0.00002 0.00004 -0.00001
246 6PX 0.00012 -0.00014 -0.00013 0.00017 -0.00008
247 6PY -0.00001 0.00012 0.00002 -0.00013 0.00005
248 6PZ 0.00005 -0.00009 -0.00004 0.00007 0.00003
249 7PX -0.00029 0.00066 0.00022 -0.00056 0.00005
250 7PY 0.00032 -0.00029 -0.00030 0.00022 -0.00003
251 7PZ -0.00010 0.00018 0.00005 -0.00009 0.00024
252 8D 0 -0.00002 0.00003 0.00002 -0.00003 0.00002
253 8D+1 0.00004 -0.00005 -0.00004 0.00006 -0.00001
254 8D-1 -0.00001 0.00004 0.00001 -0.00004 0.00000
255 8D+2 0.00004 -0.00003 -0.00004 0.00003 -0.00002
256 8D-2 -0.00003 0.00007 0.00003 -0.00007 0.00003
257 9D 0 0.00000 0.00000 0.00000 0.00000 0.00006
258 9D+1 0.00002 -0.00004 -0.00004 0.00004 0.00003
259 9D-1 -0.00001 0.00002 0.00000 -0.00004 -0.00002
260 9D+2 0.00005 0.00000 -0.00006 0.00001 -0.00002
261 9D-2 0.00000 0.00005 0.00001 -0.00007 0.00004
262 10F 0 -0.00002 0.00003 0.00002 -0.00003 0.00000
263 10F+1 0.00000 0.00000 0.00000 0.00000 0.00003
264 10F-1 0.00000 0.00000 0.00000 0.00000 -0.00002
265 10F+2 0.00002 -0.00001 -0.00003 0.00002 0.00000
266 10F-2 -0.00001 0.00004 0.00002 -0.00004 0.00000
267 10F+3 0.00002 0.00001 -0.00003 -0.00001 0.00000
268 10F-3 -0.00002 0.00004 0.00002 -0.00004 0.00003
269 8 H 1S 0.00010 0.00018 -0.00010 -0.00018 -0.00008
270 2S 0.00032 0.00056 -0.00032 -0.00055 -0.00021
271 3S -0.00080 -0.00139 0.00062 0.00108 0.00017
272 4S -0.00020 -0.00034 0.00019 0.00032 0.00018
273 5PX -0.00005 -0.00007 0.00004 0.00007 0.00004
274 5PY -0.00002 -0.00005 0.00002 0.00004 0.00002
275 5PZ 0.00002 0.00004 -0.00002 -0.00004 -0.00001
276 6PX -0.00012 -0.00014 0.00013 0.00017 0.00008
277 6PY -0.00001 -0.00012 0.00002 0.00013 0.00005
278 6PZ 0.00005 0.00009 -0.00004 -0.00007 0.00003
279 7PX 0.00029 0.00066 -0.00022 -0.00056 -0.00005
280 7PY 0.00032 0.00029 -0.00030 -0.00022 -0.00003
281 7PZ -0.00010 -0.00018 0.00005 0.00009 0.00024
282 8D 0 -0.00002 -0.00003 0.00002 0.00003 0.00002
283 8D+1 -0.00004 -0.00005 0.00004 0.00006 0.00001
284 8D-1 -0.00001 -0.00004 0.00001 0.00004 0.00000
285 8D+2 0.00004 0.00003 -0.00004 -0.00003 -0.00002
286 8D-2 0.00003 0.00007 -0.00003 -0.00007 -0.00003
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00006
288 9D+1 -0.00002 -0.00004 0.00004 0.00004 -0.00003
289 9D-1 -0.00001 -0.00002 0.00000 0.00004 -0.00002
290 9D+2 0.00005 0.00000 -0.00006 -0.00001 -0.00002
291 9D-2 0.00000 0.00005 -0.00001 -0.00007 -0.00004
292 10F 0 -0.00002 -0.00003 0.00002 0.00003 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 -0.00003
294 10F-1 0.00000 0.00000 0.00000 0.00000 -0.00002
295 10F+2 0.00002 0.00001 -0.00003 -0.00002 0.00000
296 10F-2 0.00001 0.00004 -0.00002 -0.00004 0.00000
297 10F+3 -0.00002 0.00001 0.00003 -0.00001 0.00000
298 10F-3 -0.00002 -0.00004 0.00002 0.00004 0.00003
11 12 13 14 15
(A1G)--O (A2U)--O (EU)--O (EU)--O (EG)--O
Eigenvalues -- -0.75583 -0.67870 -0.49928 -0.49928 -0.47325
1 1 Si 1S 0.04161 0.03723 0.00000 0.00000 0.00000
2 2S -0.08828 -0.07915 0.00000 0.00000 0.00000
3 3S 0.21662 0.19568 0.00000 0.00000 0.00000
4 4S 0.12292 0.12024 0.00000 0.00000 0.00000
5 5S 0.36142 0.30703 0.00000 0.00000 0.00000
6 6S 0.06702 0.08353 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 0.12161 0.00000
8 7PY 0.00000 0.00000 -0.12161 0.00000 -0.11662
9 7PZ 0.01402 -0.04721 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 0.01069 0.00000
11 8PY 0.00000 0.00000 -0.01069 0.00000 -0.01008
12 8PZ 0.00144 -0.00450 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 -0.14014 0.00000
14 9PY 0.00000 0.00000 0.14014 0.00000 0.13698
15 9PZ -0.01378 0.05460 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 -0.16310 0.00000
17 10PY 0.00000 0.00000 0.16310 0.00000 0.16016
18 10PZ -0.02367 0.03632 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 -0.02741 0.00000
20 11PY 0.00000 0.00000 0.02741 0.00000 0.03081
21 11PZ -0.00325 -0.00334 0.00000 0.00000 0.00000
22 12D 0 0.00451 -0.00020 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 -0.00498 0.00000
24 12D-1 0.00000 0.00000 0.00498 0.00000 0.00916
25 12D+2 0.00000 0.00000 -0.01627 0.00000 -0.01828
26 12D-2 0.00000 0.00000 0.00000 0.01627 0.00000
27 13D 0 0.00419 -0.01186 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 -0.01286 0.00000
29 13D-1 0.00000 0.00000 0.01286 0.00000 0.02462
30 13D+2 0.00000 0.00000 -0.02709 0.00000 -0.03089
31 13D-2 0.00000 0.00000 0.00000 0.02709 0.00000
32 14D 0 0.00132 -0.01161 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 -0.01338 0.00000
34 14D-1 0.00000 0.00000 0.01338 0.00000 0.01918
35 14D+2 0.00000 0.00000 -0.02118 0.00000 -0.02334
36 14D-2 0.00000 0.00000 0.00000 0.02118 0.00000
37 15F 0 -0.01060 -0.00720 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.00000 0.00000 -0.00233 0.00000
39 15F-1 0.00000 0.00000 0.00233 0.00000 0.00035
40 15F+2 0.00000 0.00000 -0.00100 0.00000 0.00036
41 15F-2 0.00000 0.00000 0.00000 0.00100 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.00963 -0.00640 0.00000 0.00000 0.00000
44 16F 0 -0.00780 -0.00502 0.00000 0.00000 0.00000
45 16F+1 0.00000 0.00000 0.00000 0.00096 0.00000
46 16F-1 0.00000 0.00000 -0.00096 0.00000 -0.00373
47 16F+2 0.00000 0.00000 -0.00623 0.00000 -0.00657
48 16F-2 0.00000 0.00000 0.00000 0.00623 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 -0.00707 -0.00824 0.00000 0.00000 0.00000
51 17G 0 0.00142 0.00094 0.00000 0.00000 0.00000
52 17G+1 0.00000 0.00000 0.00000 0.00203 0.00000
53 17G-1 0.00000 0.00000 -0.00203 0.00000 -0.00123
54 17G+2 0.00000 0.00000 0.00018 0.00000 -0.00021
55 17G-2 0.00000 0.00000 0.00000 -0.00018 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.00341 -0.00287 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.00115 0.00000 0.00149
59 17G-4 0.00000 0.00000 0.00000 0.00115 0.00000
60 2 Si 1S 0.04161 -0.03723 0.00000 0.00000 0.00000
61 2S -0.08828 0.07915 0.00000 0.00000 0.00000
62 3S 0.21662 -0.19568 0.00000 0.00000 0.00000
63 4S 0.12292 -0.12024 0.00000 0.00000 0.00000
64 5S 0.36142 -0.30703 0.00000 0.00000 0.00000
65 6S 0.06702 -0.08353 0.00000 0.00000 0.00000
66 7PX 0.00000 0.00000 0.00000 0.12161 0.00000
67 7PY 0.00000 0.00000 -0.12161 0.00000 0.11662
68 7PZ -0.01402 -0.04721 0.00000 0.00000 0.00000
69 8PX 0.00000 0.00000 0.00000 0.01069 0.00000
70 8PY 0.00000 0.00000 -0.01069 0.00000 0.01008
71 8PZ -0.00144 -0.00450 0.00000 0.00000 0.00000
72 9PX 0.00000 0.00000 0.00000 -0.14014 0.00000
73 9PY 0.00000 0.00000 0.14014 0.00000 -0.13698
74 9PZ 0.01378 0.05460 0.00000 0.00000 0.00000
75 10PX 0.00000 0.00000 0.00000 -0.16310 0.00000
76 10PY 0.00000 0.00000 0.16310 0.00000 -0.16016
77 10PZ 0.02367 0.03632 0.00000 0.00000 0.00000
78 11PX 0.00000 0.00000 0.00000 -0.02741 0.00000
79 11PY 0.00000 0.00000 0.02741 0.00000 -0.03081
80 11PZ 0.00325 -0.00334 0.00000 0.00000 0.00000
81 12D 0 0.00451 0.00020 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.00000 0.00000 0.00498 0.00000
83 12D-1 0.00000 0.00000 -0.00498 0.00000 0.00916
84 12D+2 0.00000 0.00000 0.01627 0.00000 -0.01828
85 12D-2 0.00000 0.00000 0.00000 -0.01627 0.00000
86 13D 0 0.00419 0.01186 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.00000 0.00000 0.01286 0.00000
88 13D-1 0.00000 0.00000 -0.01286 0.00000 0.02462
89 13D+2 0.00000 0.00000 0.02709 0.00000 -0.03089
90 13D-2 0.00000 0.00000 0.00000 -0.02709 0.00000
91 14D 0 0.00132 0.01161 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.00000 0.00000 0.01338 0.00000
93 14D-1 0.00000 0.00000 -0.01338 0.00000 0.01918
94 14D+2 0.00000 0.00000 0.02118 0.00000 -0.02334
95 14D-2 0.00000 0.00000 0.00000 -0.02118 0.00000
96 15F 0 0.01060 -0.00720 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.00000 0.00000 -0.00233 0.00000
98 15F-1 0.00000 0.00000 0.00233 0.00000 -0.00035
99 15F+2 0.00000 0.00000 -0.00100 0.00000 -0.00036
100 15F-2 0.00000 0.00000 0.00000 0.00100 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00963 -0.00640 0.00000 0.00000 0.00000
103 16F 0 0.00780 -0.00502 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.00000 0.00000 0.00096 0.00000
105 16F-1 0.00000 0.00000 -0.00096 0.00000 0.00373
106 16F+2 0.00000 0.00000 -0.00623 0.00000 0.00657
107 16F-2 0.00000 0.00000 0.00000 0.00623 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00707 -0.00824 0.00000 0.00000 0.00000
110 17G 0 0.00142 -0.00094 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.00000 0.00000 -0.00203 0.00000
112 17G-1 0.00000 0.00000 0.00203 0.00000 -0.00123
113 17G+2 0.00000 0.00000 -0.00018 0.00000 -0.00021
114 17G-2 0.00000 0.00000 0.00000 0.00018 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 -0.00341 0.00287 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 -0.00115 0.00000 0.00149
118 17G-4 0.00000 0.00000 0.00000 -0.00115 0.00000
119 3 H 1S 0.01929 0.02444 0.04100 0.00000 0.04348
120 2S 0.04917 0.06252 0.10756 0.00000 0.11433
121 3S 0.06264 0.09722 0.19225 0.00000 0.20443
122 4S 0.01720 0.03126 0.08992 0.00000 0.10433
123 5PX 0.00000 0.00000 0.00000 -0.00032 0.00000
124 5PY -0.00109 -0.00128 -0.00153 0.00000 -0.00170
125 5PZ -0.00047 -0.00042 -0.00074 0.00000 -0.00074
126 6PX 0.00000 0.00000 0.00000 -0.00184 0.00000
127 6PY -0.00405 -0.00528 -0.00617 0.00000 -0.00611
128 6PZ -0.00178 -0.00126 -0.00328 0.00000 -0.00292
129 7PX 0.00000 0.00000 0.00000 -0.00247 0.00000
130 7PY -0.00223 -0.00819 -0.01412 0.00000 -0.01415
131 7PZ -0.00125 -0.00272 -0.00717 0.00000 -0.00599
132 8D 0 -0.00006 -0.00009 -0.00014 0.00000 -0.00019
133 8D+1 0.00000 0.00000 0.00000 0.00001 0.00000
134 8D-1 0.00014 0.00016 0.00033 0.00000 0.00036
135 8D+2 -0.00019 -0.00021 -0.00040 0.00000 -0.00049
136 8D-2 0.00000 0.00000 0.00000 0.00006 0.00000
137 9D 0 -0.00013 -0.00060 0.00005 0.00000 0.00004
138 9D+1 0.00000 0.00000 0.00000 0.00012 0.00000
139 9D-1 0.00045 0.00038 0.00065 0.00000 0.00039
140 9D+2 -0.00041 -0.00086 -0.00051 0.00000 -0.00014
141 9D-2 0.00000 0.00000 0.00000 0.00079 0.00000
142 10F 0 0.00003 0.00004 -0.00004 0.00000 -0.00008
143 10F+1 0.00000 0.00000 0.00000 0.00006 0.00000
144 10F-1 0.00001 0.00008 -0.00012 0.00000 -0.00012
145 10F+2 0.00003 0.00000 -0.00010 0.00000 -0.00017
146 10F-2 0.00000 0.00000 0.00000 -0.00001 0.00000
147 10F+3 0.00000 0.00000 0.00000 0.00018 0.00000
148 10F-3 0.00002 0.00002 -0.00007 0.00000 -0.00015
149 4 H 1S 0.01929 0.02444 -0.02050 0.03551 -0.02174
150 2S 0.04917 0.06252 -0.05378 0.09315 -0.05717
151 3S 0.06264 0.09722 -0.09613 0.16649 -0.10221
152 4S 0.01720 0.03126 -0.04496 0.07788 -0.05217
153 5PX 0.00094 0.00111 -0.00080 0.00106 -0.00088
154 5PY 0.00055 0.00064 -0.00014 0.00080 -0.00018
155 5PZ -0.00047 -0.00042 0.00037 -0.00064 0.00037
156 6PX 0.00351 0.00458 -0.00347 0.00417 -0.00335
157 6PY 0.00202 0.00264 -0.00016 0.00347 -0.00030
158 6PZ -0.00178 -0.00126 0.00164 -0.00284 0.00146
159 7PX 0.00193 0.00709 -0.00718 0.00997 -0.00701
160 7PY 0.00112 0.00410 -0.00168 0.00718 -0.00200
161 7PZ -0.00125 -0.00272 0.00359 -0.00621 0.00299
162 8D 0 -0.00006 -0.00009 0.00007 -0.00012 0.00009
163 8D+1 -0.00012 -0.00014 0.00015 -0.00025 0.00015
164 8D-1 -0.00007 -0.00008 0.00007 -0.00015 0.00009
165 8D+2 0.00009 0.00011 -0.00015 0.00015 -0.00018
166 8D-2 0.00016 0.00019 -0.00015 0.00032 -0.00018
167 9D 0 -0.00013 -0.00060 -0.00002 0.00004 -0.00002
168 9D+1 -0.00039 -0.00033 0.00034 -0.00046 0.00017
169 9D-1 -0.00022 -0.00019 0.00007 -0.00034 0.00009
170 9D+2 0.00020 0.00043 -0.00072 -0.00012 -0.00052
171 9D-2 0.00035 0.00075 0.00012 0.00058 0.00022
172 10F 0 0.00003 0.00004 0.00002 -0.00004 0.00004
173 10F+1 0.00000 -0.00007 -0.00002 0.00011 -0.00002
174 10F-1 0.00000 -0.00004 -0.00008 0.00002 -0.00009
175 10F+2 -0.00002 0.00000 -0.00002 0.00005 -0.00006
176 10F-2 -0.00003 0.00000 -0.00005 0.00007 -0.00006
177 10F+3 0.00000 0.00000 -0.00016 -0.00009 -0.00016
178 10F-3 0.00002 0.00002 0.00003 -0.00006 0.00008
179 5 H 1S 0.01929 0.02444 -0.02050 -0.03551 -0.02174
180 2S 0.04917 0.06252 -0.05378 -0.09315 -0.05717
181 3S 0.06264 0.09722 -0.09613 -0.16649 -0.10221
182 4S 0.01720 0.03126 -0.04496 -0.07788 -0.05217
183 5PX -0.00094 -0.00111 0.00080 0.00106 0.00088
184 5PY 0.00055 0.00064 -0.00014 -0.00080 -0.00018
185 5PZ -0.00047 -0.00042 0.00037 0.00064 0.00037
186 6PX -0.00351 -0.00458 0.00347 0.00417 0.00335
187 6PY 0.00202 0.00264 -0.00016 -0.00347 -0.00030
188 6PZ -0.00178 -0.00126 0.00164 0.00284 0.00146
189 7PX -0.00193 -0.00709 0.00718 0.00997 0.00701
190 7PY 0.00112 0.00410 -0.00168 -0.00718 -0.00200
191 7PZ -0.00125 -0.00272 0.00359 0.00621 0.00299
192 8D 0 -0.00006 -0.00009 0.00007 0.00012 0.00009
193 8D+1 0.00012 0.00014 -0.00015 -0.00025 -0.00015
194 8D-1 -0.00007 -0.00008 0.00007 0.00015 0.00009
195 8D+2 0.00009 0.00011 -0.00015 -0.00015 -0.00018
196 8D-2 -0.00016 -0.00019 0.00015 0.00032 0.00018
197 9D 0 -0.00013 -0.00060 -0.00002 -0.00004 -0.00002
198 9D+1 0.00039 0.00033 -0.00034 -0.00046 -0.00017
199 9D-1 -0.00022 -0.00019 0.00007 0.00034 0.00009
200 9D+2 0.00020 0.00043 -0.00072 0.00012 -0.00052
201 9D-2 -0.00035 -0.00075 -0.00012 0.00058 -0.00022
202 10F 0 0.00003 0.00004 0.00002 0.00004 0.00004
203 10F+1 0.00000 0.00007 0.00002 0.00011 0.00002
204 10F-1 0.00000 -0.00004 -0.00008 -0.00002 -0.00009
205 10F+2 -0.00002 0.00000 -0.00002 -0.00005 -0.00006
206 10F-2 0.00003 0.00000 0.00005 0.00007 0.00006
207 10F+3 0.00000 0.00000 0.00016 -0.00009 0.00016
208 10F-3 0.00002 0.00002 0.00003 0.00006 0.00008
209 6 H 1S 0.01929 -0.02444 -0.04100 0.00000 0.04348
210 2S 0.04917 -0.06252 -0.10756 0.00000 0.11433
211 3S 0.06264 -0.09722 -0.19225 0.00000 0.20443
212 4S 0.01720 -0.03126 -0.08992 0.00000 0.10433
213 5PX 0.00000 0.00000 0.00000 -0.00032 0.00000
214 5PY 0.00109 -0.00128 -0.00153 0.00000 0.00170
215 5PZ 0.00047 -0.00042 -0.00074 0.00000 0.00074
216 6PX 0.00000 0.00000 0.00000 -0.00184 0.00000
217 6PY 0.00405 -0.00528 -0.00617 0.00000 0.00611
218 6PZ 0.00178 -0.00126 -0.00328 0.00000 0.00292
219 7PX 0.00000 0.00000 0.00000 -0.00247 0.00000
220 7PY 0.00223 -0.00819 -0.01412 0.00000 0.01415
221 7PZ 0.00125 -0.00272 -0.00717 0.00000 0.00599
222 8D 0 -0.00006 0.00009 0.00014 0.00000 -0.00019
223 8D+1 0.00000 0.00000 0.00000 -0.00001 0.00000
224 8D-1 0.00014 -0.00016 -0.00033 0.00000 0.00036
225 8D+2 -0.00019 0.00021 0.00040 0.00000 -0.00049
226 8D-2 0.00000 0.00000 0.00000 -0.00006 0.00000
227 9D 0 -0.00013 0.00060 -0.00005 0.00000 0.00004
228 9D+1 0.00000 0.00000 0.00000 -0.00012 0.00000
229 9D-1 0.00045 -0.00038 -0.00065 0.00000 0.00039
230 9D+2 -0.00041 0.00086 0.00051 0.00000 -0.00014
231 9D-2 0.00000 0.00000 0.00000 -0.00079 0.00000
232 10F 0 -0.00003 0.00004 -0.00004 0.00000 0.00008
233 10F+1 0.00000 0.00000 0.00000 0.00006 0.00000
234 10F-1 -0.00001 0.00008 -0.00012 0.00000 0.00012
235 10F+2 -0.00003 0.00000 -0.00010 0.00000 0.00017
236 10F-2 0.00000 0.00000 0.00000 -0.00001 0.00000
237 10F+3 0.00000 0.00000 0.00000 0.00018 0.00000
238 10F-3 -0.00002 0.00002 -0.00007 0.00000 0.00015
239 7 H 1S 0.01929 -0.02444 0.02050 0.03551 -0.02174
240 2S 0.04917 -0.06252 0.05378 0.09315 -0.05717
241 3S 0.06264 -0.09722 0.09613 0.16649 -0.10221
242 4S 0.01720 -0.03126 0.04496 0.07788 -0.05217
243 5PX 0.00094 -0.00111 0.00080 0.00106 -0.00088
244 5PY -0.00055 0.00064 -0.00014 -0.00080 0.00018
245 5PZ 0.00047 -0.00042 0.00037 0.00064 -0.00037
246 6PX 0.00351 -0.00458 0.00347 0.00417 -0.00335
247 6PY -0.00202 0.00264 -0.00016 -0.00347 0.00030
248 6PZ 0.00178 -0.00126 0.00164 0.00284 -0.00146
249 7PX 0.00193 -0.00709 0.00718 0.00997 -0.00701
250 7PY -0.00112 0.00410 -0.00168 -0.00718 0.00200
251 7PZ 0.00125 -0.00272 0.00359 0.00621 -0.00299
252 8D 0 -0.00006 0.00009 -0.00007 -0.00012 0.00009
253 8D+1 0.00012 -0.00014 0.00015 0.00025 -0.00015
254 8D-1 -0.00007 0.00008 -0.00007 -0.00015 0.00009
255 8D+2 0.00009 -0.00011 0.00015 0.00015 -0.00018
256 8D-2 -0.00016 0.00019 -0.00015 -0.00032 0.00018
257 9D 0 -0.00013 0.00060 0.00002 0.00004 -0.00002
258 9D+1 0.00039 -0.00033 0.00034 0.00046 -0.00017
259 9D-1 -0.00022 0.00019 -0.00007 -0.00034 0.00009
260 9D+2 0.00020 -0.00043 0.00072 -0.00012 -0.00052
261 9D-2 -0.00035 0.00075 0.00012 -0.00058 -0.00022
262 10F 0 -0.00003 0.00004 0.00002 0.00004 -0.00004
263 10F+1 0.00000 0.00007 0.00002 0.00011 -0.00002
264 10F-1 0.00000 -0.00004 -0.00008 -0.00002 0.00009
265 10F+2 0.00002 0.00000 -0.00002 -0.00005 0.00006
266 10F-2 -0.00003 0.00000 0.00005 0.00007 -0.00006
267 10F+3 0.00000 0.00000 0.00016 -0.00009 -0.00016
268 10F-3 -0.00002 0.00002 0.00003 0.00006 -0.00008
269 8 H 1S 0.01929 -0.02444 0.02050 -0.03551 -0.02174
270 2S 0.04917 -0.06252 0.05378 -0.09315 -0.05717
271 3S 0.06264 -0.09722 0.09613 -0.16649 -0.10221
272 4S 0.01720 -0.03126 0.04496 -0.07788 -0.05217
273 5PX -0.00094 0.00111 -0.00080 0.00106 0.00088
274 5PY -0.00055 0.00064 -0.00014 0.00080 0.00018
275 5PZ 0.00047 -0.00042 0.00037 -0.00064 -0.00037
276 6PX -0.00351 0.00458 -0.00347 0.00417 0.00335
277 6PY -0.00202 0.00264 -0.00016 0.00347 0.00030
278 6PZ 0.00178 -0.00126 0.00164 -0.00284 -0.00146
279 7PX -0.00193 0.00709 -0.00718 0.00997 0.00701
280 7PY -0.00112 0.00410 -0.00168 0.00718 0.00200
281 7PZ 0.00125 -0.00272 0.00359 -0.00621 -0.00299
282 8D 0 -0.00006 0.00009 -0.00007 0.00012 0.00009
283 8D+1 -0.00012 0.00014 -0.00015 0.00025 0.00015
284 8D-1 -0.00007 0.00008 -0.00007 0.00015 0.00009
285 8D+2 0.00009 -0.00011 0.00015 -0.00015 -0.00018
286 8D-2 0.00016 -0.00019 0.00015 -0.00032 -0.00018
287 9D 0 -0.00013 0.00060 0.00002 -0.00004 -0.00002
288 9D+1 -0.00039 0.00033 -0.00034 0.00046 0.00017
289 9D-1 -0.00022 0.00019 -0.00007 0.00034 0.00009
290 9D+2 0.00020 -0.00043 0.00072 0.00012 -0.00052
291 9D-2 0.00035 -0.00075 -0.00012 -0.00058 0.00022
292 10F 0 -0.00003 0.00004 0.00002 -0.00004 -0.00004
293 10F+1 0.00000 -0.00007 -0.00002 0.00011 0.00002
294 10F-1 0.00000 -0.00004 -0.00008 0.00002 0.00009
295 10F+2 0.00002 0.00000 -0.00002 0.00005 0.00006
296 10F-2 0.00003 0.00000 -0.00005 0.00007 0.00006
297 10F+3 0.00000 0.00000 -0.00016 -0.00009 0.00016
298 10F-3 -0.00002 0.00002 0.00003 -0.00006 -0.00008
16 17 18 19 20
(EG)--O (A1G)--O (A2U)--V (EU)--V (EU)--V
Eigenvalues -- -0.47325 -0.40488 0.09205 0.11878 0.11878
1 1 Si 1S 0.00000 -0.00795 0.01691 0.00000 0.00000
2 2S 0.00000 0.01769 -0.04316 0.00000 0.00000
3 3S 0.00000 -0.04217 0.08678 0.00000 0.00000
4 4S 0.00000 -0.00223 -0.06805 0.00000 0.00000
5 5S 0.00000 -0.13357 -0.04676 0.00000 0.00000
6 6S 0.00000 -0.06804 4.99783 0.00000 0.00000
7 7PX 0.11662 0.00000 0.00000 0.00000 -0.03863
8 7PY 0.00000 0.00000 0.00000 0.03863 0.00000
9 7PZ 0.00000 -0.16252 0.01989 0.00000 0.00000
10 8PX 0.01008 0.00000 0.00000 0.00000 -0.00497
11 8PY 0.00000 0.00000 0.00000 0.00497 0.00000
12 8PZ 0.00000 -0.01429 -0.01029 0.00000 0.00000
13 9PX -0.13698 0.00000 0.00000 0.00000 0.05045
14 9PY 0.00000 0.00000 0.00000 -0.05045 0.00000
15 9PZ 0.00000 0.18907 0.11467 0.00000 0.00000
16 10PX -0.16016 0.00000 0.00000 0.00000 0.20094
17 10PY 0.00000 0.00000 0.00000 -0.20094 0.00000
18 10PZ 0.00000 0.26447 -1.26335 0.00000 0.00000
19 11PX -0.03081 0.00000 0.00000 0.00000 1.23200
20 11PY 0.00000 0.00000 0.00000 -1.23200 0.00000
21 11PZ 0.00000 0.06379 -2.81915 0.00000 0.00000
22 12D 0 0.00000 -0.03657 0.85864 0.00000 0.00000
23 12D+1 -0.00916 0.00000 0.00000 0.00000 0.06103
24 12D-1 0.00000 0.00000 0.00000 -0.06103 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.19644 0.00000
26 12D-2 0.01828 0.00000 0.00000 0.00000 -0.19644
27 13D 0 0.00000 -0.04719 0.07067 0.00000 0.00000
28 13D+1 -0.02462 0.00000 0.00000 0.00000 -0.06835
29 13D-1 0.00000 0.00000 0.00000 0.06835 0.00000
30 13D+2 0.00000 0.00000 0.00000 -0.04828 0.00000
31 13D-2 0.03089 0.00000 0.00000 0.00000 0.04828
32 14D 0 0.00000 -0.02645 -0.03416 0.00000 0.00000
33 14D+1 -0.01918 0.00000 0.00000 0.00000 -0.02832
34 14D-1 0.00000 0.00000 0.00000 0.02832 0.00000
35 14D+2 0.00000 0.00000 0.00000 -0.01995 0.00000
36 14D-2 0.02334 0.00000 0.00000 0.00000 0.01995
37 15F 0 0.00000 0.00989 -0.18116 0.00000 0.00000
38 15F+1 -0.00035 0.00000 0.00000 0.00000 -0.00271
39 15F-1 0.00000 0.00000 0.00000 0.00271 0.00000
40 15F+2 0.00000 0.00000 0.00000 0.02802 0.00000
41 15F-2 -0.00036 0.00000 0.00000 0.00000 -0.02802
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00102 0.01138 0.00000 0.00000
44 16F 0 0.00000 0.00317 0.00946 0.00000 0.00000
45 16F+1 0.00373 0.00000 0.00000 0.00000 0.00678
46 16F-1 0.00000 0.00000 0.00000 -0.00678 0.00000
47 16F+2 0.00000 0.00000 0.00000 -0.01001 0.00000
48 16F-2 0.00657 0.00000 0.00000 0.00000 0.01001
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 -0.00509 0.00103 0.00000 0.00000
51 17G 0 0.00000 -0.00183 0.02277 0.00000 0.00000
52 17G+1 0.00123 0.00000 0.00000 0.00000 0.00076
53 17G-1 0.00000 0.00000 0.00000 -0.00076 0.00000
54 17G+2 0.00000 0.00000 0.00000 0.00067 0.00000
55 17G-2 0.00021 0.00000 0.00000 0.00000 -0.00067
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 -0.00064 0.00400 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.00000 0.00494 0.00000
59 17G-4 0.00149 0.00000 0.00000 0.00000 0.00494
60 2 Si 1S 0.00000 -0.00795 -0.01691 0.00000 0.00000
61 2S 0.00000 0.01769 0.04316 0.00000 0.00000
62 3S 0.00000 -0.04217 -0.08678 0.00000 0.00000
63 4S 0.00000 -0.00223 0.06805 0.00000 0.00000
64 5S 0.00000 -0.13357 0.04676 0.00000 0.00000
65 6S 0.00000 -0.06804 -4.99783 0.00000 0.00000
66 7PX -0.11662 0.00000 0.00000 0.00000 -0.03863
67 7PY 0.00000 0.00000 0.00000 0.03863 0.00000
68 7PZ 0.00000 0.16252 0.01989 0.00000 0.00000
69 8PX -0.01008 0.00000 0.00000 0.00000 -0.00497
70 8PY 0.00000 0.00000 0.00000 0.00497 0.00000
71 8PZ 0.00000 0.01429 -0.01029 0.00000 0.00000
72 9PX 0.13698 0.00000 0.00000 0.00000 0.05045
73 9PY 0.00000 0.00000 0.00000 -0.05045 0.00000
74 9PZ 0.00000 -0.18907 0.11467 0.00000 0.00000
75 10PX 0.16016 0.00000 0.00000 0.00000 0.20094
76 10PY 0.00000 0.00000 0.00000 -0.20094 0.00000
77 10PZ 0.00000 -0.26447 -1.26335 0.00000 0.00000
78 11PX 0.03081 0.00000 0.00000 0.00000 1.23200
79 11PY 0.00000 0.00000 0.00000 -1.23200 0.00000
80 11PZ 0.00000 -0.06379 -2.81915 0.00000 0.00000
81 12D 0 0.00000 -0.03657 -0.85864 0.00000 0.00000
82 12D+1 -0.00916 0.00000 0.00000 0.00000 -0.06103
83 12D-1 0.00000 0.00000 0.00000 0.06103 0.00000
84 12D+2 0.00000 0.00000 0.00000 -0.19644 0.00000
85 12D-2 0.01828 0.00000 0.00000 0.00000 0.19644
86 13D 0 0.00000 -0.04719 -0.07067 0.00000 0.00000
87 13D+1 -0.02462 0.00000 0.00000 0.00000 0.06835
88 13D-1 0.00000 0.00000 0.00000 -0.06835 0.00000
89 13D+2 0.00000 0.00000 0.00000 0.04828 0.00000
90 13D-2 0.03089 0.00000 0.00000 0.00000 -0.04828
91 14D 0 0.00000 -0.02645 0.03416 0.00000 0.00000
92 14D+1 -0.01918 0.00000 0.00000 0.00000 0.02832
93 14D-1 0.00000 0.00000 0.00000 -0.02832 0.00000
94 14D+2 0.00000 0.00000 0.00000 0.01995 0.00000
95 14D-2 0.02334 0.00000 0.00000 0.00000 -0.01995
96 15F 0 0.00000 -0.00989 -0.18116 0.00000 0.00000
97 15F+1 0.00035 0.00000 0.00000 0.00000 -0.00271
98 15F-1 0.00000 0.00000 0.00000 0.00271 0.00000
99 15F+2 0.00000 0.00000 0.00000 0.02802 0.00000
100 15F-2 0.00036 0.00000 0.00000 0.00000 -0.02802
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 -0.00102 0.01138 0.00000 0.00000
103 16F 0 0.00000 -0.00317 0.00946 0.00000 0.00000
104 16F+1 -0.00373 0.00000 0.00000 0.00000 0.00678
105 16F-1 0.00000 0.00000 0.00000 -0.00678 0.00000
106 16F+2 0.00000 0.00000 0.00000 -0.01001 0.00000
107 16F-2 -0.00657 0.00000 0.00000 0.00000 0.01001
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00509 0.00103 0.00000 0.00000
110 17G 0 0.00000 -0.00183 -0.02277 0.00000 0.00000
111 17G+1 0.00123 0.00000 0.00000 0.00000 -0.00076
112 17G-1 0.00000 0.00000 0.00000 0.00076 0.00000
113 17G+2 0.00000 0.00000 0.00000 -0.00067 0.00000
114 17G-2 0.00021 0.00000 0.00000 0.00000 0.00067
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 -0.00064 -0.00400 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.00000 -0.00494 0.00000
118 17G-4 0.00149 0.00000 0.00000 0.00000 -0.00494
119 3 H 1S 0.00000 0.01742 0.00102 0.02231 0.00000
120 2S 0.00000 0.04545 -0.00127 0.05379 0.00000
121 3S 0.00000 0.09354 0.04046 0.20494 0.00000
122 4S 0.00000 0.06038 -0.07260 1.29144 0.00000
123 5PX -0.00033 0.00000 0.00000 0.00000 0.00134
124 5PY 0.00000 -0.00073 0.00051 -0.00316 0.00000
125 5PZ 0.00000 0.00031 -0.00085 -0.00056 0.00000
126 6PX -0.00164 0.00000 0.00000 0.00000 0.00206
127 6PY 0.00000 -0.00280 -0.00710 0.01254 0.00000
128 6PZ 0.00000 0.00176 -0.00429 0.00986 0.00000
129 7PX -0.00204 0.00000 0.00000 0.00000 0.03400
130 7PY 0.00000 -0.01210 -0.00214 -0.06271 0.00000
131 7PZ 0.00000 0.00091 -0.01756 -0.01538 0.00000
132 8D 0 0.00000 -0.00009 0.00006 -0.00041 0.00000
133 8D+1 -0.00001 0.00000 0.00000 0.00000 0.00024
134 8D-1 0.00000 -0.00001 0.00029 0.00022 0.00000
135 8D+2 0.00000 -0.00010 0.00012 -0.00023 0.00000
136 8D-2 0.00008 0.00000 0.00000 0.00000 0.00038
137 9D 0 0.00000 -0.00117 -0.00159 0.00061 0.00000
138 9D+1 0.00001 0.00000 0.00000 0.00000 -0.00259
139 9D-1 0.00000 -0.00034 -0.00103 -0.00177 0.00000
140 9D+2 0.00000 -0.00083 -0.00321 0.00048 0.00000
141 9D-2 0.00065 0.00000 0.00000 0.00000 -0.00340
142 10F 0 0.00000 0.00000 -0.00039 0.00012 0.00000
143 10F+1 0.00008 0.00000 0.00000 0.00000 0.00004
144 10F-1 0.00000 0.00018 0.00033 -0.00002 0.00000
145 10F+2 0.00000 -0.00008 -0.00064 -0.00028 0.00000
146 10F-2 0.00003 0.00000 0.00000 0.00000 0.00002
147 10F+3 0.00019 0.00000 0.00000 0.00000 0.00017
148 10F-3 0.00000 -0.00001 0.00033 -0.00018 0.00000
149 4 H 1S 0.03765 0.01742 0.00102 -0.01115 0.01932
150 2S 0.09902 0.04545 -0.00127 -0.02689 0.04658
151 3S 0.17704 0.09354 0.04046 -0.10247 0.17748
152 4S 0.09035 0.06038 -0.07260 -0.64572 1.11842
153 5PX 0.00120 0.00063 -0.00044 -0.00079 0.00270
154 5PY 0.00088 0.00036 -0.00025 -0.00179 0.00079
155 5PZ -0.00064 0.00031 -0.00085 0.00028 -0.00048
156 6PX 0.00417 0.00243 0.00615 0.00632 -0.00889
157 6PY 0.00335 0.00140 0.00355 0.00159 -0.00632
158 6PZ -0.00253 0.00176 -0.00429 -0.00493 0.00854
159 7PX 0.01010 0.01048 0.00185 -0.01243 0.05553
160 7PY 0.00701 0.00605 0.00107 -0.04118 0.01243
161 7PZ -0.00518 0.00091 -0.01756 0.00769 -0.01332
162 8D 0 -0.00016 -0.00009 0.00006 0.00020 -0.00035
163 8D+1 -0.00027 0.00001 -0.00025 0.00020 -0.00011
164 8D-1 -0.00015 0.00001 -0.00014 -0.00013 -0.00020
165 8D+2 0.00018 0.00005 -0.00006 -0.00035 -0.00007
166 8D-2 0.00038 0.00009 -0.00010 0.00007 0.00027
167 9D 0 0.00003 -0.00117 -0.00159 -0.00031 0.00053
168 9D+1 -0.00029 0.00029 0.00089 -0.00189 0.00068
169 9D-1 -0.00017 0.00017 0.00051 0.00150 0.00189
170 9D+2 -0.00022 0.00042 0.00161 0.00267 0.00127
171 9D-2 0.00027 0.00072 0.00278 -0.00127 -0.00121
172 10F 0 -0.00007 0.00000 -0.00039 -0.00006 0.00010
173 10F+1 0.00011 -0.00016 -0.00028 0.00001 0.00002
174 10F-1 0.00002 -0.00009 -0.00016 -0.00004 -0.00001
175 10F+2 0.00006 0.00004 0.00032 -0.00009 0.00011
176 10F-2 0.00013 0.00007 0.00055 -0.00011 0.00021
177 10F+3 -0.00009 0.00000 0.00000 -0.00015 -0.00009
178 10F-3 -0.00013 -0.00001 0.00033 0.00009 -0.00016
179 5 H 1S -0.03765 0.01742 0.00102 -0.01115 -0.01932
180 2S -0.09902 0.04545 -0.00127 -0.02689 -0.04658
181 3S -0.17704 0.09354 0.04046 -0.10247 -0.17748
182 4S -0.09035 0.06038 -0.07260 -0.64572 -1.11842
183 5PX 0.00120 -0.00063 0.00044 0.00079 0.00270
184 5PY -0.00088 0.00036 -0.00025 -0.00179 -0.00079
185 5PZ 0.00064 0.00031 -0.00085 0.00028 0.00048
186 6PX 0.00417 -0.00243 -0.00615 -0.00632 -0.00889
187 6PY -0.00335 0.00140 0.00355 0.00159 0.00632
188 6PZ 0.00253 0.00176 -0.00429 -0.00493 -0.00854
189 7PX 0.01010 -0.01048 -0.00185 0.01243 0.05553
190 7PY -0.00701 0.00605 0.00107 -0.04118 -0.01243
191 7PZ 0.00518 0.00091 -0.01756 0.00769 0.01332
192 8D 0 0.00016 -0.00009 0.00006 0.00020 0.00035
193 8D+1 -0.00027 -0.00001 0.00025 -0.00020 -0.00011
194 8D-1 0.00015 0.00001 -0.00014 -0.00013 0.00020
195 8D+2 -0.00018 0.00005 -0.00006 -0.00035 0.00007
196 8D-2 0.00038 -0.00009 0.00010 -0.00007 0.00027
197 9D 0 -0.00003 -0.00117 -0.00159 -0.00031 -0.00053
198 9D+1 -0.00029 -0.00029 -0.00089 0.00189 0.00068
199 9D-1 0.00017 0.00017 0.00051 0.00150 -0.00189
200 9D+2 0.00022 0.00042 0.00161 0.00267 -0.00127
201 9D-2 0.00027 -0.00072 -0.00278 0.00127 -0.00121
202 10F 0 0.00007 0.00000 -0.00039 -0.00006 -0.00010
203 10F+1 0.00011 0.00016 0.00028 -0.00001 0.00002
204 10F-1 -0.00002 -0.00009 -0.00016 -0.00004 0.00001
205 10F+2 -0.00006 0.00004 0.00032 -0.00009 -0.00011
206 10F-2 0.00013 -0.00007 -0.00055 0.00011 0.00021
207 10F+3 -0.00009 0.00000 0.00000 0.00015 -0.00009
208 10F-3 0.00013 -0.00001 0.00033 0.00009 0.00016
209 6 H 1S 0.00000 0.01742 -0.00102 -0.02231 0.00000
210 2S 0.00000 0.04545 0.00127 -0.05379 0.00000
211 3S 0.00000 0.09354 -0.04046 -0.20494 0.00000
212 4S 0.00000 0.06038 0.07260 -1.29144 0.00000
213 5PX 0.00033 0.00000 0.00000 0.00000 0.00134
214 5PY 0.00000 0.00073 0.00051 -0.00316 0.00000
215 5PZ 0.00000 -0.00031 -0.00085 -0.00056 0.00000
216 6PX 0.00164 0.00000 0.00000 0.00000 0.00206
217 6PY 0.00000 0.00280 -0.00710 0.01254 0.00000
218 6PZ 0.00000 -0.00176 -0.00429 0.00986 0.00000
219 7PX 0.00204 0.00000 0.00000 0.00000 0.03400
220 7PY 0.00000 0.01210 -0.00214 -0.06271 0.00000
221 7PZ 0.00000 -0.00091 -0.01756 -0.01538 0.00000
222 8D 0 0.00000 -0.00009 -0.00006 0.00041 0.00000
223 8D+1 -0.00001 0.00000 0.00000 0.00000 -0.00024
224 8D-1 0.00000 -0.00001 -0.00029 -0.00022 0.00000
225 8D+2 0.00000 -0.00010 -0.00012 0.00023 0.00000
226 8D-2 0.00008 0.00000 0.00000 0.00000 -0.00038
227 9D 0 0.00000 -0.00117 0.00159 -0.00061 0.00000
228 9D+1 0.00001 0.00000 0.00000 0.00000 0.00259
229 9D-1 0.00000 -0.00034 0.00103 0.00177 0.00000
230 9D+2 0.00000 -0.00083 0.00321 -0.00048 0.00000
231 9D-2 0.00065 0.00000 0.00000 0.00000 0.00340
232 10F 0 0.00000 0.00000 -0.00039 0.00012 0.00000
233 10F+1 -0.00008 0.00000 0.00000 0.00000 0.00004
234 10F-1 0.00000 -0.00018 0.00033 -0.00002 0.00000
235 10F+2 0.00000 0.00008 -0.00064 -0.00028 0.00000
236 10F-2 -0.00003 0.00000 0.00000 0.00000 0.00002
237 10F+3 -0.00019 0.00000 0.00000 0.00000 0.00017
238 10F-3 0.00000 0.00001 0.00033 -0.00018 0.00000
239 7 H 1S -0.03765 0.01742 -0.00102 0.01115 0.01932
240 2S -0.09902 0.04545 0.00127 0.02689 0.04658
241 3S -0.17704 0.09354 -0.04046 0.10247 0.17748
242 4S -0.09035 0.06038 0.07260 0.64572 1.11842
243 5PX -0.00120 0.00063 0.00044 0.00079 0.00270
244 5PY 0.00088 -0.00036 -0.00025 -0.00179 -0.00079
245 5PZ -0.00064 -0.00031 -0.00085 0.00028 0.00048
246 6PX -0.00417 0.00243 -0.00615 -0.00632 -0.00889
247 6PY 0.00335 -0.00140 0.00355 0.00159 0.00632
248 6PZ -0.00253 -0.00176 -0.00429 -0.00493 -0.00854
249 7PX -0.01010 0.01048 -0.00185 0.01243 0.05553
250 7PY 0.00701 -0.00605 0.00107 -0.04118 -0.01243
251 7PZ -0.00518 -0.00091 -0.01756 0.00769 0.01332
252 8D 0 0.00016 -0.00009 -0.00006 -0.00020 -0.00035
253 8D+1 -0.00027 -0.00001 -0.00025 0.00020 0.00011
254 8D-1 0.00015 0.00001 0.00014 0.00013 -0.00020
255 8D+2 -0.00018 0.00005 0.00006 0.00035 -0.00007
256 8D-2 0.00038 -0.00009 -0.00010 0.00007 -0.00027
257 9D 0 -0.00003 -0.00117 0.00159 0.00031 0.00053
258 9D+1 -0.00029 -0.00029 0.00089 -0.00189 -0.00068
259 9D-1 0.00017 0.00017 -0.00051 -0.00150 0.00189
260 9D+2 0.00022 0.00042 -0.00161 -0.00267 0.00127
261 9D-2 0.00027 -0.00072 0.00278 -0.00127 0.00121
262 10F 0 -0.00007 0.00000 -0.00039 -0.00006 -0.00010
263 10F+1 -0.00011 -0.00016 0.00028 -0.00001 0.00002
264 10F-1 0.00002 0.00009 -0.00016 -0.00004 0.00001
265 10F+2 0.00006 -0.00004 0.00032 -0.00009 -0.00011
266 10F-2 -0.00013 0.00007 -0.00055 0.00011 0.00021
267 10F+3 0.00009 0.00000 0.00000 0.00015 -0.00009
268 10F-3 -0.00013 0.00001 0.00033 0.00009 0.00016
269 8 H 1S 0.03765 0.01742 -0.00102 0.01115 -0.01932
270 2S 0.09902 0.04545 0.00127 0.02689 -0.04658
271 3S 0.17704 0.09354 -0.04046 0.10247 -0.17748
272 4S 0.09035 0.06038 0.07260 0.64572 -1.11842
273 5PX -0.00120 -0.00063 -0.00044 -0.00079 0.00270
274 5PY -0.00088 -0.00036 -0.00025 -0.00179 0.00079
275 5PZ 0.00064 -0.00031 -0.00085 0.00028 -0.00048
276 6PX -0.00417 -0.00243 0.00615 0.00632 -0.00889
277 6PY -0.00335 -0.00140 0.00355 0.00159 -0.00632
278 6PZ 0.00253 -0.00176 -0.00429 -0.00493 0.00854
279 7PX -0.01010 -0.01048 0.00185 -0.01243 0.05553
280 7PY -0.00701 -0.00605 0.00107 -0.04118 0.01243
281 7PZ 0.00518 -0.00091 -0.01756 0.00769 -0.01332
282 8D 0 -0.00016 -0.00009 -0.00006 -0.00020 0.00035
283 8D+1 -0.00027 0.00001 0.00025 -0.00020 0.00011
284 8D-1 -0.00015 0.00001 0.00014 0.00013 0.00020
285 8D+2 0.00018 0.00005 0.00006 0.00035 0.00007
286 8D-2 0.00038 0.00009 0.00010 -0.00007 -0.00027
287 9D 0 0.00003 -0.00117 0.00159 0.00031 -0.00053
288 9D+1 -0.00029 0.00029 -0.00089 0.00189 -0.00068
289 9D-1 -0.00017 0.00017 -0.00051 -0.00150 -0.00189
290 9D+2 -0.00022 0.00042 -0.00161 -0.00267 -0.00127
291 9D-2 0.00027 0.00072 -0.00278 0.00127 0.00121
292 10F 0 0.00007 0.00000 -0.00039 -0.00006 0.00010
293 10F+1 -0.00011 0.00016 -0.00028 0.00001 0.00002
294 10F-1 -0.00002 0.00009 -0.00016 -0.00004 -0.00001
295 10F+2 -0.00006 -0.00004 0.00032 -0.00009 0.00011
296 10F-2 -0.00013 -0.00007 0.00055 -0.00011 0.00021
297 10F+3 0.00009 0.00000 0.00000 -0.00015 -0.00009
298 10F-3 0.00013 0.00001 0.00033 0.00009 -0.00016
21 22 23 24 25
(A1G)--V (EG)--V (EG)--V (A1G)--V (EU)--V
Eigenvalues -- 0.12094 0.13664 0.13664 0.16896 0.18641
1 1 Si 1S 0.01799 0.00000 0.00000 -0.01100 0.00000
2 2S -0.04116 0.00000 0.00000 0.02624 0.00000
3 3S 0.09994 0.00000 0.00000 -0.06004 0.00000
4 4S -0.16510 0.00000 0.00000 0.21078 0.00000
5 5S 1.06354 0.00000 0.00000 -0.95508 0.00000
6 6S 2.15048 0.00000 0.00000 0.10473 0.00000
7 7PX 0.00000 0.00000 -0.03338 0.00000 0.00000
8 7PY 0.00000 -0.03338 0.00000 0.00000 -0.09640
9 7PZ -0.01784 0.00000 0.00000 0.05497 0.00000
10 8PX 0.00000 0.00000 -0.00555 0.00000 0.00000
11 8PY 0.00000 -0.00555 0.00000 0.00000 -0.00988
12 8PZ -0.00130 0.00000 0.00000 0.00329 0.00000
13 9PX 0.00000 0.00000 0.05755 0.00000 0.00000
14 9PY 0.00000 0.05755 0.00000 0.00000 0.07834
15 9PZ 0.02366 0.00000 0.00000 -0.06215 0.00000
16 10PX 0.00000 0.00000 0.20368 0.00000 0.00000
17 10PY 0.00000 0.20368 0.00000 0.00000 1.48291
18 10PZ 0.09612 0.00000 0.00000 -0.87265 0.00000
19 11PX 0.00000 0.00000 2.70696 0.00000 0.00000
20 11PY 0.00000 2.70696 0.00000 0.00000 -0.59409
21 11PZ 1.12555 0.00000 0.00000 1.06068 0.00000
22 12D 0 -0.22938 0.00000 0.00000 -0.27198 0.00000
23 12D+1 0.00000 0.00000 0.05096 0.00000 0.00000
24 12D-1 0.00000 0.05096 0.00000 0.00000 -0.08621
25 12D+2 0.00000 -0.18501 0.00000 0.00000 -0.16440
26 12D-2 0.00000 0.00000 -0.18501 0.00000 0.00000
27 13D 0 0.03321 0.00000 0.00000 0.17925 0.00000
28 13D+1 0.00000 0.00000 0.02194 0.00000 0.00000
29 13D-1 0.00000 0.02194 0.00000 0.00000 0.18339
30 13D+2 0.00000 0.04899 0.00000 0.00000 -0.24237
31 13D-2 0.00000 0.00000 0.04899 0.00000 0.00000
32 14D 0 0.02023 0.00000 0.00000 0.00587 0.00000
33 14D+1 0.00000 0.00000 0.00206 0.00000 0.00000
34 14D-1 0.00000 0.00206 0.00000 0.00000 -0.04909
35 14D+2 0.00000 0.02094 0.00000 0.00000 0.02015
36 14D-2 0.00000 0.00000 0.02094 0.00000 0.00000
37 15F 0 0.02696 0.00000 0.00000 0.11976 0.00000
38 15F+1 0.00000 0.00000 0.00736 0.00000 0.00000
39 15F-1 0.00000 0.00736 0.00000 0.00000 -0.05658
40 15F+2 0.00000 -0.04559 0.00000 0.00000 -0.07353
41 15F-2 0.00000 0.00000 -0.04559 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.06946 0.00000 0.00000 -0.02374 0.00000
44 16F 0 -0.02201 0.00000 0.00000 0.00113 0.00000
45 16F+1 0.00000 0.00000 -0.00265 0.00000 0.00000
46 16F-1 0.00000 -0.00265 0.00000 0.00000 -0.00224
47 16F+2 0.00000 0.00968 0.00000 0.00000 -0.02826
48 16F-2 0.00000 0.00000 0.00968 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 -0.00471 0.00000 0.00000 0.04390 0.00000
51 17G 0 -0.00184 0.00000 0.00000 0.00177 0.00000
52 17G+1 0.00000 0.00000 0.00203 0.00000 0.00000
53 17G-1 0.00000 0.00203 0.00000 0.00000 -0.02391
54 17G+2 0.00000 0.00030 0.00000 0.00000 0.00576
55 17G-2 0.00000 0.00000 0.00030 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00174 0.00000 0.00000 0.01324 0.00000
58 17G+4 0.00000 -0.00315 0.00000 0.00000 0.02697
59 17G-4 0.00000 0.00000 0.00315 0.00000 0.00000
60 2 Si 1S 0.01799 0.00000 0.00000 -0.01100 0.00000
61 2S -0.04116 0.00000 0.00000 0.02624 0.00000
62 3S 0.09994 0.00000 0.00000 -0.06004 0.00000
63 4S -0.16510 0.00000 0.00000 0.21078 0.00000
64 5S 1.06354 0.00000 0.00000 -0.95508 0.00000
65 6S 2.15048 0.00000 0.00000 0.10473 0.00000
66 7PX 0.00000 0.00000 0.03338 0.00000 0.00000
67 7PY 0.00000 0.03338 0.00000 0.00000 -0.09640
68 7PZ 0.01784 0.00000 0.00000 -0.05497 0.00000
69 8PX 0.00000 0.00000 0.00555 0.00000 0.00000
70 8PY 0.00000 0.00555 0.00000 0.00000 -0.00988
71 8PZ 0.00130 0.00000 0.00000 -0.00329 0.00000
72 9PX 0.00000 0.00000 -0.05755 0.00000 0.00000
73 9PY 0.00000 -0.05755 0.00000 0.00000 0.07834
74 9PZ -0.02366 0.00000 0.00000 0.06215 0.00000
75 10PX 0.00000 0.00000 -0.20368 0.00000 0.00000
76 10PY 0.00000 -0.20368 0.00000 0.00000 1.48291
77 10PZ -0.09612 0.00000 0.00000 0.87265 0.00000
78 11PX 0.00000 0.00000 -2.70696 0.00000 0.00000
79 11PY 0.00000 -2.70696 0.00000 0.00000 -0.59409
80 11PZ -1.12555 0.00000 0.00000 -1.06068 0.00000
81 12D 0 -0.22938 0.00000 0.00000 -0.27198 0.00000
82 12D+1 0.00000 0.00000 0.05096 0.00000 0.00000
83 12D-1 0.00000 0.05096 0.00000 0.00000 0.08621
84 12D+2 0.00000 -0.18501 0.00000 0.00000 0.16440
85 12D-2 0.00000 0.00000 -0.18501 0.00000 0.00000
86 13D 0 0.03321 0.00000 0.00000 0.17925 0.00000
87 13D+1 0.00000 0.00000 0.02194 0.00000 0.00000
88 13D-1 0.00000 0.02194 0.00000 0.00000 -0.18339
89 13D+2 0.00000 0.04899 0.00000 0.00000 0.24237
90 13D-2 0.00000 0.00000 0.04899 0.00000 0.00000
91 14D 0 0.02023 0.00000 0.00000 0.00587 0.00000
92 14D+1 0.00000 0.00000 0.00206 0.00000 0.00000
93 14D-1 0.00000 0.00206 0.00000 0.00000 0.04909
94 14D+2 0.00000 0.02094 0.00000 0.00000 -0.02015
95 14D-2 0.00000 0.00000 0.02094 0.00000 0.00000
96 15F 0 -0.02696 0.00000 0.00000 -0.11976 0.00000
97 15F+1 0.00000 0.00000 -0.00736 0.00000 0.00000
98 15F-1 0.00000 -0.00736 0.00000 0.00000 -0.05658
99 15F+2 0.00000 0.04559 0.00000 0.00000 -0.07353
100 15F-2 0.00000 0.00000 0.04559 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.06946 0.00000 0.00000 0.02374 0.00000
103 16F 0 0.02201 0.00000 0.00000 -0.00113 0.00000
104 16F+1 0.00000 0.00000 0.00265 0.00000 0.00000
105 16F-1 0.00000 0.00265 0.00000 0.00000 -0.00224
106 16F+2 0.00000 -0.00968 0.00000 0.00000 -0.02826
107 16F-2 0.00000 0.00000 -0.00968 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00471 0.00000 0.00000 -0.04390 0.00000
110 17G 0 -0.00184 0.00000 0.00000 0.00177 0.00000
111 17G+1 0.00000 0.00000 0.00203 0.00000 0.00000
112 17G-1 0.00000 0.00203 0.00000 0.00000 0.02391
113 17G+2 0.00000 0.00030 0.00000 0.00000 -0.00576
114 17G-2 0.00000 0.00000 0.00030 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00174 0.00000 0.00000 0.01324 0.00000
117 17G+4 0.00000 -0.00315 0.00000 0.00000 -0.02697
118 17G-4 0.00000 0.00000 0.00315 0.00000 0.00000
119 3 H 1S -0.00380 -0.00770 0.00000 -0.00895 0.00187
120 2S -0.01659 -0.03155 0.00000 -0.00316 -0.00331
121 3S -0.11932 -0.04867 0.00000 0.03176 -0.57100
122 4S -1.14284 -1.99439 0.00000 0.38819 -0.49162
123 5PX 0.00000 0.00000 0.00047 0.00000 0.00000
124 5PY 0.00181 0.00305 0.00000 -0.00026 -0.00349
125 5PZ 0.00147 0.00438 0.00000 -0.00046 -0.00272
126 6PX 0.00000 0.00000 0.01112 0.00000 0.00000
127 6PY -0.02067 -0.01842 0.00000 0.01073 0.01080
128 6PZ -0.00379 -0.01834 0.00000 0.00651 0.00435
129 7PX 0.00000 0.00000 0.01709 0.00000 0.00000
130 7PY 0.12772 0.08719 0.00000 -0.18233 0.30660
131 7PZ 0.07607 0.07075 0.00000 -0.02696 0.11952
132 8D 0 -0.00029 -0.00018 0.00000 0.00228 -0.00122
133 8D+1 0.00000 0.00000 0.00013 0.00000 0.00000
134 8D-1 0.00132 0.00008 0.00000 -0.00096 0.00304
135 8D+2 -0.00146 -0.00056 0.00000 0.00260 -0.00256
136 8D-2 0.00000 0.00000 0.00029 0.00000 0.00000
137 9D 0 0.00175 0.00036 0.00000 -0.01464 0.01423
138 9D+1 0.00000 0.00000 -0.00125 0.00000 0.00000
139 9D-1 -0.00938 -0.00045 0.00000 0.01076 -0.02748
140 9D+2 0.00967 0.00355 0.00000 -0.01942 0.03045
141 9D-2 0.00000 0.00000 -0.00322 0.00000 0.00000
142 10F 0 -0.00002 -0.00021 0.00000 0.00107 -0.00034
143 10F+1 0.00000 0.00000 0.00006 0.00000 0.00000
144 10F-1 -0.00026 0.00030 0.00000 -0.00019 -0.00066
145 10F+2 -0.00008 -0.00015 0.00000 0.00152 -0.00031
146 10F-2 0.00000 0.00000 -0.00027 0.00000 0.00000
147 10F+3 0.00000 0.00000 0.00050 0.00000 0.00000
148 10F-3 -0.00055 -0.00008 0.00000 -0.00003 -0.00068
149 4 H 1S -0.00380 0.00385 0.00667 -0.00895 -0.00093
150 2S -0.01659 0.01578 0.02732 -0.00316 0.00166
151 3S -0.11932 0.02434 0.04215 0.03176 0.28550
152 4S -1.14284 0.99719 1.72719 0.38819 0.24581
153 5PX -0.00157 0.00112 0.00241 0.00023 -0.00221
154 5PY -0.00091 0.00111 0.00112 0.00013 0.00034
155 5PZ 0.00147 -0.00219 -0.00379 -0.00046 0.00136
156 6PX 0.01790 -0.01279 -0.01104 -0.00929 0.00734
157 6PY 0.01033 0.00374 -0.01279 -0.00536 -0.00191
158 6PZ -0.00379 0.00917 0.01588 0.00651 -0.00217
159 7PX -0.11061 0.03035 0.06966 0.15790 0.13199
160 7PY -0.06386 0.03462 0.03035 0.09117 0.07799
161 7PZ 0.07607 -0.03538 -0.06127 -0.02696 -0.05976
162 8D 0 -0.00029 0.00009 0.00016 0.00228 0.00061
163 8D+1 -0.00114 -0.00002 0.00009 0.00083 0.00163
164 8D-1 -0.00066 0.00012 -0.00002 0.00048 0.00021
165 8D+2 0.00073 0.00008 -0.00036 -0.00130 -0.00147
166 8D-2 0.00126 -0.00036 -0.00034 -0.00225 -0.00063
167 9D 0 0.00175 -0.00018 -0.00031 -0.01464 -0.00711
168 9D+1 0.00812 0.00035 -0.00065 -0.00932 -0.01353
169 9D-1 0.00469 -0.00105 0.00035 -0.00538 -0.00404
170 9D+2 -0.00483 -0.00153 0.00293 0.00971 0.01280
171 9D-2 -0.00837 0.00293 0.00186 0.01682 0.01019
172 10F 0 -0.00002 0.00010 0.00018 0.00107 0.00017
173 10F+1 0.00023 0.00010 0.00024 0.00016 -0.00034
174 10F-1 0.00013 0.00012 0.00010 0.00009 -0.00007
175 10F+2 0.00004 -0.00024 0.00005 -0.00076 -0.00009
176 10F-2 0.00007 0.00005 -0.00018 -0.00131 -0.00013
177 10F+3 0.00000 0.00044 -0.00025 0.00000 0.00000
178 10F-3 -0.00055 0.00004 0.00007 -0.00003 0.00034
179 5 H 1S -0.00380 0.00385 -0.00667 -0.00895 -0.00093
180 2S -0.01659 0.01578 -0.02732 -0.00316 0.00166
181 3S -0.11932 0.02434 -0.04215 0.03176 0.28550
182 4S -1.14284 0.99719 -1.72719 0.38819 0.24581
183 5PX 0.00157 -0.00112 0.00241 -0.00023 0.00221
184 5PY -0.00091 0.00111 -0.00112 0.00013 0.00034
185 5PZ 0.00147 -0.00219 0.00379 -0.00046 0.00136
186 6PX -0.01790 0.01279 -0.01104 0.00929 -0.00734
187 6PY 0.01033 0.00374 0.01279 -0.00536 -0.00191
188 6PZ -0.00379 0.00917 -0.01588 0.00651 -0.00217
189 7PX 0.11061 -0.03035 0.06966 -0.15790 -0.13199
190 7PY -0.06386 0.03462 -0.03035 0.09117 0.07799
191 7PZ 0.07607 -0.03538 0.06127 -0.02696 -0.05976
192 8D 0 -0.00029 0.00009 -0.00016 0.00228 0.00061
193 8D+1 0.00114 0.00002 0.00009 -0.00083 -0.00163
194 8D-1 -0.00066 0.00012 0.00002 0.00048 0.00021
195 8D+2 0.00073 0.00008 0.00036 -0.00130 -0.00147
196 8D-2 -0.00126 0.00036 -0.00034 0.00225 0.00063
197 9D 0 0.00175 -0.00018 0.00031 -0.01464 -0.00711
198 9D+1 -0.00812 -0.00035 -0.00065 0.00932 0.01353
199 9D-1 0.00469 -0.00105 -0.00035 -0.00538 -0.00404
200 9D+2 -0.00483 -0.00153 -0.00293 0.00971 0.01280
201 9D-2 0.00837 -0.00293 0.00186 -0.01682 -0.01019
202 10F 0 -0.00002 0.00010 -0.00018 0.00107 0.00017
203 10F+1 -0.00023 -0.00010 0.00024 -0.00016 0.00034
204 10F-1 0.00013 0.00012 -0.00010 0.00009 -0.00007
205 10F+2 0.00004 -0.00024 -0.00005 -0.00076 -0.00009
206 10F-2 -0.00007 -0.00005 -0.00018 0.00131 0.00013
207 10F+3 0.00000 -0.00044 -0.00025 0.00000 0.00000
208 10F-3 -0.00055 0.00004 -0.00007 -0.00003 0.00034
209 6 H 1S -0.00380 -0.00770 0.00000 -0.00895 -0.00187
210 2S -0.01659 -0.03155 0.00000 -0.00316 0.00331
211 3S -0.11932 -0.04867 0.00000 0.03176 0.57100
212 4S -1.14284 -1.99439 0.00000 0.38819 0.49162
213 5PX 0.00000 0.00000 -0.00047 0.00000 0.00000
214 5PY -0.00181 -0.00305 0.00000 0.00026 -0.00349
215 5PZ -0.00147 -0.00438 0.00000 0.00046 -0.00272
216 6PX 0.00000 0.00000 -0.01112 0.00000 0.00000
217 6PY 0.02067 0.01842 0.00000 -0.01073 0.01080
218 6PZ 0.00379 0.01834 0.00000 -0.00651 0.00435
219 7PX 0.00000 0.00000 -0.01709 0.00000 0.00000
220 7PY -0.12772 -0.08719 0.00000 0.18233 0.30660
221 7PZ -0.07607 -0.07075 0.00000 0.02696 0.11952
222 8D 0 -0.00029 -0.00018 0.00000 0.00228 0.00122
223 8D+1 0.00000 0.00000 0.00013 0.00000 0.00000
224 8D-1 0.00132 0.00008 0.00000 -0.00096 -0.00304
225 8D+2 -0.00146 -0.00056 0.00000 0.00260 0.00256
226 8D-2 0.00000 0.00000 0.00029 0.00000 0.00000
227 9D 0 0.00175 0.00036 0.00000 -0.01464 -0.01423
228 9D+1 0.00000 0.00000 -0.00125 0.00000 0.00000
229 9D-1 -0.00938 -0.00045 0.00000 0.01076 0.02748
230 9D+2 0.00967 0.00355 0.00000 -0.01942 -0.03045
231 9D-2 0.00000 0.00000 -0.00322 0.00000 0.00000
232 10F 0 0.00002 0.00021 0.00000 -0.00107 -0.00034
233 10F+1 0.00000 0.00000 -0.00006 0.00000 0.00000
234 10F-1 0.00026 -0.00030 0.00000 0.00019 -0.00066
235 10F+2 0.00008 0.00015 0.00000 -0.00152 -0.00031
236 10F-2 0.00000 0.00000 0.00027 0.00000 0.00000
237 10F+3 0.00000 0.00000 -0.00050 0.00000 0.00000
238 10F-3 0.00055 0.00008 0.00000 0.00003 -0.00068
239 7 H 1S -0.00380 0.00385 -0.00667 -0.00895 0.00093
240 2S -0.01659 0.01578 -0.02732 -0.00316 -0.00166
241 3S -0.11932 0.02434 -0.04215 0.03176 -0.28550
242 4S -1.14284 0.99719 -1.72719 0.38819 -0.24581
243 5PX -0.00157 0.00112 -0.00241 0.00023 0.00221
244 5PY 0.00091 -0.00111 0.00112 -0.00013 0.00034
245 5PZ -0.00147 0.00219 -0.00379 0.00046 0.00136
246 6PX 0.01790 -0.01279 0.01104 -0.00929 -0.00734
247 6PY -0.01033 -0.00374 -0.01279 0.00536 -0.00191
248 6PZ 0.00379 -0.00917 0.01588 -0.00651 -0.00217
249 7PX -0.11061 0.03035 -0.06966 0.15790 -0.13199
250 7PY 0.06386 -0.03462 0.03035 -0.09117 0.07799
251 7PZ -0.07607 0.03538 -0.06127 0.02696 -0.05976
252 8D 0 -0.00029 0.00009 -0.00016 0.00228 -0.00061
253 8D+1 0.00114 0.00002 0.00009 -0.00083 0.00163
254 8D-1 -0.00066 0.00012 0.00002 0.00048 -0.00021
255 8D+2 0.00073 0.00008 0.00036 -0.00130 0.00147
256 8D-2 -0.00126 0.00036 -0.00034 0.00225 -0.00063
257 9D 0 0.00175 -0.00018 0.00031 -0.01464 0.00711
258 9D+1 -0.00812 -0.00035 -0.00065 0.00932 -0.01353
259 9D-1 0.00469 -0.00105 -0.00035 -0.00538 0.00404
260 9D+2 -0.00483 -0.00153 -0.00293 0.00971 -0.01280
261 9D-2 0.00837 -0.00293 0.00186 -0.01682 0.01019
262 10F 0 0.00002 -0.00010 0.00018 -0.00107 0.00017
263 10F+1 0.00023 0.00010 -0.00024 0.00016 0.00034
264 10F-1 -0.00013 -0.00012 0.00010 -0.00009 -0.00007
265 10F+2 -0.00004 0.00024 0.00005 0.00076 -0.00009
266 10F-2 0.00007 0.00005 0.00018 -0.00131 0.00013
267 10F+3 0.00000 0.00044 0.00025 0.00000 0.00000
268 10F-3 0.00055 -0.00004 0.00007 0.00003 0.00034
269 8 H 1S -0.00380 0.00385 0.00667 -0.00895 0.00093
270 2S -0.01659 0.01578 0.02732 -0.00316 -0.00166
271 3S -0.11932 0.02434 0.04215 0.03176 -0.28550
272 4S -1.14284 0.99719 1.72719 0.38819 -0.24581
273 5PX 0.00157 -0.00112 -0.00241 -0.00023 -0.00221
274 5PY 0.00091 -0.00111 -0.00112 -0.00013 0.00034
275 5PZ -0.00147 0.00219 0.00379 0.00046 0.00136
276 6PX -0.01790 0.01279 0.01104 0.00929 0.00734
277 6PY -0.01033 -0.00374 0.01279 0.00536 -0.00191
278 6PZ 0.00379 -0.00917 -0.01588 -0.00651 -0.00217
279 7PX 0.11061 -0.03035 -0.06966 -0.15790 0.13199
280 7PY 0.06386 -0.03462 -0.03035 -0.09117 0.07799
281 7PZ -0.07607 0.03538 0.06127 0.02696 -0.05976
282 8D 0 -0.00029 0.00009 0.00016 0.00228 -0.00061
283 8D+1 -0.00114 -0.00002 0.00009 0.00083 -0.00163
284 8D-1 -0.00066 0.00012 -0.00002 0.00048 -0.00021
285 8D+2 0.00073 0.00008 -0.00036 -0.00130 0.00147
286 8D-2 0.00126 -0.00036 -0.00034 -0.00225 0.00063
287 9D 0 0.00175 -0.00018 -0.00031 -0.01464 0.00711
288 9D+1 0.00812 0.00035 -0.00065 -0.00932 0.01353
289 9D-1 0.00469 -0.00105 0.00035 -0.00538 0.00404
290 9D+2 -0.00483 -0.00153 0.00293 0.00971 -0.01280
291 9D-2 -0.00837 0.00293 0.00186 0.01682 -0.01019
292 10F 0 0.00002 -0.00010 -0.00018 -0.00107 0.00017
293 10F+1 -0.00023 -0.00010 -0.00024 -0.00016 -0.00034
294 10F-1 -0.00013 -0.00012 -0.00010 -0.00009 -0.00007
295 10F+2 -0.00004 0.00024 -0.00005 0.00076 -0.00009
296 10F-2 -0.00007 -0.00005 0.00018 0.00131 -0.00013
297 10F+3 0.00000 -0.00044 0.00025 0.00000 0.00000
298 10F-3 0.00055 -0.00004 -0.00007 0.00003 0.00034
26 27 28 29 30
(EU)--V (A2U)--V (EG)--V (EG)--V (A2U)--V
Eigenvalues -- 0.18641 0.18708 0.21921 0.21921 0.24700
1 1 Si 1S 0.00000 0.01437 0.00000 0.00000 -0.02641
2 2S 0.00000 -0.03270 0.00000 0.00000 0.04308
3 3S 0.00000 0.08021 0.00000 0.00000 -0.17423
4 4S 0.00000 -0.20217 0.00000 0.00000 -0.18493
5 5S 0.00000 0.68923 0.00000 0.00000 -0.95350
6 6S 0.00000 4.17853 0.00000 0.00000 4.20939
7 7PX -0.09640 0.00000 0.00000 -0.09829 0.00000
8 7PY 0.00000 0.00000 -0.09829 0.00000 0.00000
9 7PZ 0.00000 -0.07689 0.00000 0.00000 -0.12517
10 8PX -0.00988 0.00000 0.00000 -0.01478 0.00000
11 8PY 0.00000 0.00000 -0.01478 0.00000 0.00000
12 8PZ 0.00000 -0.01299 0.00000 0.00000 -0.02254
13 9PX 0.07834 0.00000 0.00000 0.10052 0.00000
14 9PY 0.00000 0.00000 0.10052 0.00000 0.00000
15 9PZ 0.00000 0.15032 0.00000 0.00000 0.37390
16 10PX 1.48291 0.00000 0.00000 1.81638 0.00000
17 10PY 0.00000 0.00000 1.81638 0.00000 0.00000
18 10PZ 0.00000 0.11564 0.00000 0.00000 -1.89381
19 11PX -0.59409 0.00000 0.00000 -0.70291 0.00000
20 11PY 0.00000 0.00000 -0.70291 0.00000 0.00000
21 11PZ 0.00000 0.45728 0.00000 0.00000 -3.56740
22 12D 0 0.00000 0.20865 0.00000 0.00000 1.84102
23 12D+1 -0.08621 0.00000 0.00000 0.58145 0.00000
24 12D-1 0.00000 0.00000 0.58145 0.00000 0.00000
25 12D+2 0.00000 0.00000 -0.23233 0.00000 0.00000
26 12D-2 -0.16440 0.00000 0.00000 -0.23233 0.00000
27 13D 0 0.00000 -0.00400 0.00000 0.00000 0.22340
28 13D+1 0.18339 0.00000 0.00000 0.20531 0.00000
29 13D-1 0.00000 0.00000 0.20531 0.00000 0.00000
30 13D+2 0.00000 0.00000 -0.33469 0.00000 0.00000
31 13D-2 -0.24237 0.00000 0.00000 -0.33469 0.00000
32 14D 0 0.00000 0.01867 0.00000 0.00000 -0.00043
33 14D+1 -0.04909 0.00000 0.00000 -0.00360 0.00000
34 14D-1 0.00000 0.00000 -0.00360 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.03385 0.00000 0.00000
36 14D-2 0.02015 0.00000 0.00000 0.03385 0.00000
37 15F 0 0.00000 -0.10949 0.00000 0.00000 -0.25554
38 15F+1 -0.05658 0.00000 0.00000 -0.11196 0.00000
39 15F-1 0.00000 0.00000 -0.11196 0.00000 0.00000
40 15F+2 0.00000 0.00000 -0.13500 0.00000 0.00000
41 15F-2 -0.07353 0.00000 0.00000 -0.13500 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 -0.08757 0.00000 0.00000 0.11681
44 16F 0 0.00000 -0.00476 0.00000 0.00000 0.01480
45 16F+1 -0.00224 0.00000 0.00000 -0.00583 0.00000
46 16F-1 0.00000 0.00000 -0.00583 0.00000 0.00000
47 16F+2 0.00000 0.00000 -0.02972 0.00000 0.00000
48 16F-2 -0.02826 0.00000 0.00000 -0.02972 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 -0.00586 0.00000 0.00000 0.00726
51 17G 0 0.00000 0.00596 0.00000 0.00000 0.03471
52 17G+1 -0.02391 0.00000 0.00000 -0.02115 0.00000
53 17G-1 0.00000 0.00000 -0.02115 0.00000 0.00000
54 17G+2 0.00000 0.00000 0.00330 0.00000 0.00000
55 17G-2 0.00576 0.00000 0.00000 0.00330 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 -0.00786 0.00000 0.00000 0.01580
58 17G+4 0.00000 0.00000 0.02882 0.00000 0.00000
59 17G-4 -0.02697 0.00000 0.00000 -0.02882 0.00000
60 2 Si 1S 0.00000 -0.01437 0.00000 0.00000 0.02641
61 2S 0.00000 0.03270 0.00000 0.00000 -0.04308
62 3S 0.00000 -0.08021 0.00000 0.00000 0.17423
63 4S 0.00000 0.20217 0.00000 0.00000 0.18493
64 5S 0.00000 -0.68923 0.00000 0.00000 0.95350
65 6S 0.00000 -4.17853 0.00000 0.00000 -4.20939
66 7PX -0.09640 0.00000 0.00000 0.09829 0.00000
67 7PY 0.00000 0.00000 0.09829 0.00000 0.00000
68 7PZ 0.00000 -0.07689 0.00000 0.00000 -0.12517
69 8PX -0.00988 0.00000 0.00000 0.01478 0.00000
70 8PY 0.00000 0.00000 0.01478 0.00000 0.00000
71 8PZ 0.00000 -0.01299 0.00000 0.00000 -0.02254
72 9PX 0.07834 0.00000 0.00000 -0.10052 0.00000
73 9PY 0.00000 0.00000 -0.10052 0.00000 0.00000
74 9PZ 0.00000 0.15032 0.00000 0.00000 0.37390
75 10PX 1.48291 0.00000 0.00000 -1.81638 0.00000
76 10PY 0.00000 0.00000 -1.81638 0.00000 0.00000
77 10PZ 0.00000 0.11564 0.00000 0.00000 -1.89381
78 11PX -0.59409 0.00000 0.00000 0.70291 0.00000
79 11PY 0.00000 0.00000 0.70291 0.00000 0.00000
80 11PZ 0.00000 0.45728 0.00000 0.00000 -3.56740
81 12D 0 0.00000 -0.20865 0.00000 0.00000 -1.84102
82 12D+1 0.08621 0.00000 0.00000 0.58145 0.00000
83 12D-1 0.00000 0.00000 0.58145 0.00000 0.00000
84 12D+2 0.00000 0.00000 -0.23233 0.00000 0.00000
85 12D-2 0.16440 0.00000 0.00000 -0.23233 0.00000
86 13D 0 0.00000 0.00400 0.00000 0.00000 -0.22340
87 13D+1 -0.18339 0.00000 0.00000 0.20531 0.00000
88 13D-1 0.00000 0.00000 0.20531 0.00000 0.00000
89 13D+2 0.00000 0.00000 -0.33469 0.00000 0.00000
90 13D-2 0.24237 0.00000 0.00000 -0.33469 0.00000
91 14D 0 0.00000 -0.01867 0.00000 0.00000 0.00043
92 14D+1 0.04909 0.00000 0.00000 -0.00360 0.00000
93 14D-1 0.00000 0.00000 -0.00360 0.00000 0.00000
94 14D+2 0.00000 0.00000 0.03385 0.00000 0.00000
95 14D-2 -0.02015 0.00000 0.00000 0.03385 0.00000
96 15F 0 0.00000 -0.10949 0.00000 0.00000 -0.25554
97 15F+1 -0.05658 0.00000 0.00000 0.11196 0.00000
98 15F-1 0.00000 0.00000 0.11196 0.00000 0.00000
99 15F+2 0.00000 0.00000 0.13500 0.00000 0.00000
100 15F-2 -0.07353 0.00000 0.00000 0.13500 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 -0.08757 0.00000 0.00000 0.11681
103 16F 0 0.00000 -0.00476 0.00000 0.00000 0.01480
104 16F+1 -0.00224 0.00000 0.00000 0.00583 0.00000
105 16F-1 0.00000 0.00000 0.00583 0.00000 0.00000
106 16F+2 0.00000 0.00000 0.02972 0.00000 0.00000
107 16F-2 -0.02826 0.00000 0.00000 0.02972 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 -0.00586 0.00000 0.00000 0.00726
110 17G 0 0.00000 -0.00596 0.00000 0.00000 -0.03471
111 17G+1 0.02391 0.00000 0.00000 -0.02115 0.00000
112 17G-1 0.00000 0.00000 -0.02115 0.00000 0.00000
113 17G+2 0.00000 0.00000 0.00330 0.00000 0.00000
114 17G-2 -0.00576 0.00000 0.00000 0.00330 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00786 0.00000 0.00000 -0.01580
117 17G+4 0.00000 0.00000 0.02882 0.00000 0.00000
118 17G-4 0.02697 0.00000 0.00000 -0.02882 0.00000
119 3 H 1S 0.00000 -0.00674 0.00843 0.00000 0.00736
120 2S 0.00000 -0.02758 0.02687 0.00000 0.00650
121 3S 0.00000 -0.19937 -0.76012 0.00000 0.31698
122 4S 0.00000 -1.58497 -1.21791 0.00000 0.99432
123 5PX 0.00162 0.00000 0.00000 0.00100 0.00000
124 5PY 0.00000 0.00149 -0.00050 0.00000 0.00043
125 5PZ 0.00000 0.00162 -0.00356 0.00000 0.00102
126 6PX -0.00615 0.00000 0.00000 0.00152 0.00000
127 6PY 0.00000 -0.02184 -0.01125 0.00000 0.00043
128 6PZ 0.00000 -0.00285 0.01052 0.00000 0.00853
129 7PX 0.00178 0.00000 0.00000 -0.00327 0.00000
130 7PY 0.00000 0.16525 0.47583 0.00000 -0.13046
131 7PZ 0.00000 0.07364 0.14083 0.00000 -0.06064
132 8D 0 0.00000 -0.00075 -0.00143 0.00000 0.00033
133 8D+1 -0.00073 0.00000 0.00000 0.00009 0.00000
134 8D-1 0.00000 0.00101 0.00398 0.00000 -0.00102
135 8D+2 0.00000 -0.00150 -0.00379 0.00000 0.00115
136 8D-2 -0.00111 0.00000 0.00000 -0.00129 0.00000
137 9D 0 0.00000 0.00467 0.01468 0.00000 -0.00616
138 9D+1 0.00377 0.00000 0.00000 -0.00011 0.00000
139 9D-1 0.00000 -0.01044 -0.03660 0.00000 0.00327
140 9D+2 0.00000 0.01080 0.03891 0.00000 -0.01452
141 9D-2 0.00692 0.00000 0.00000 0.00465 0.00000
142 10F 0 0.00000 -0.00037 -0.00077 0.00000 -0.00037
143 10F+1 0.00013 0.00000 0.00000 -0.00020 0.00000
144 10F-1 0.00000 -0.00013 -0.00025 0.00000 0.00095
145 10F+2 0.00000 -0.00074 -0.00117 0.00000 -0.00032
146 10F-2 -0.00001 0.00000 0.00000 0.00005 0.00000
147 10F+3 0.00000 0.00000 0.00000 -0.00081 0.00000
148 10F-3 0.00000 -0.00034 -0.00144 0.00000 0.00152
149 4 H 1S -0.00162 -0.00674 -0.00422 -0.00730 0.00736
150 2S 0.00287 -0.02758 -0.01343 -0.02327 0.00650
151 3S 0.49450 -0.19937 0.38006 0.65828 0.31698
152 4S 0.42575 -1.58497 0.60896 1.05474 0.99432
153 5PX -0.00222 -0.00129 -0.00065 -0.00013 -0.00038
154 5PY -0.00221 -0.00074 0.00063 -0.00065 -0.00022
155 5PZ 0.00236 0.00162 0.00178 0.00308 0.00102
156 6PX 0.00656 0.01892 -0.00553 -0.00805 -0.00037
157 6PY 0.00734 0.01092 -0.00167 -0.00553 -0.00022
158 6PZ -0.00376 -0.00285 -0.00526 -0.00911 0.00853
159 7PX 0.23039 -0.14311 0.20746 0.35605 0.11298
160 7PY 0.13199 -0.08262 0.11650 0.20746 0.06523
161 7PZ -0.10351 0.07364 -0.07042 -0.12197 -0.06064
162 8D 0 0.00106 -0.00075 0.00072 0.00124 0.00033
163 8D+1 0.00210 -0.00087 0.00169 0.00301 0.00088
164 8D-1 0.00163 -0.00051 0.00106 0.00169 0.00051
165 8D+2 -0.00063 0.00075 -0.00191 -0.00108 -0.00058
166 8D-2 -0.00220 0.00130 -0.00108 -0.00316 -0.00100
167 9D 0 -0.01232 0.00467 -0.00734 -0.01271 -0.00616
168 9D+1 -0.01967 0.00904 -0.01580 -0.02748 -0.00283
169 9D-1 -0.01353 0.00522 -0.00923 -0.01580 -0.00164
170 9D+2 0.01019 -0.00540 0.01322 0.01483 0.00726
171 9D-2 0.02457 -0.00935 0.01483 0.03034 0.01257
172 10F 0 0.00029 -0.00037 0.00039 0.00067 -0.00037
173 10F+1 -0.00046 0.00011 -0.00002 -0.00023 -0.00083
174 10F-1 -0.00034 0.00006 -0.00021 -0.00002 -0.00048
175 10F+2 -0.00013 0.00037 -0.00026 -0.00053 0.00016
176 10F-2 -0.00023 0.00064 -0.00053 -0.00087 0.00028
177 10F+3 0.00000 0.00000 -0.00070 0.00040 0.00000
178 10F-3 0.00059 -0.00034 0.00072 0.00125 0.00152
179 5 H 1S 0.00162 -0.00674 -0.00422 0.00730 0.00736
180 2S -0.00287 -0.02758 -0.01343 0.02327 0.00650
181 3S -0.49450 -0.19937 0.38006 -0.65828 0.31698
182 4S -0.42575 -1.58497 0.60896 -1.05474 0.99432
183 5PX -0.00222 0.00129 0.00065 -0.00013 0.00038
184 5PY 0.00221 -0.00074 0.00063 0.00065 -0.00022
185 5PZ -0.00236 0.00162 0.00178 -0.00308 0.00102
186 6PX 0.00656 -0.01892 0.00553 -0.00805 0.00037
187 6PY -0.00734 0.01092 -0.00167 0.00553 -0.00022
188 6PZ 0.00376 -0.00285 -0.00526 0.00911 0.00853
189 7PX 0.23039 0.14311 -0.20746 0.35605 -0.11298
190 7PY -0.13199 -0.08262 0.11650 -0.20746 0.06523
191 7PZ 0.10351 0.07364 -0.07042 0.12197 -0.06064
192 8D 0 -0.00106 -0.00075 0.00072 -0.00124 0.00033
193 8D+1 0.00210 0.00087 -0.00169 0.00301 -0.00088
194 8D-1 -0.00163 -0.00051 0.00106 -0.00169 0.00051
195 8D+2 0.00063 0.00075 -0.00191 0.00108 -0.00058
196 8D-2 -0.00220 -0.00130 0.00108 -0.00316 0.00100
197 9D 0 0.01232 0.00467 -0.00734 0.01271 -0.00616
198 9D+1 -0.01967 -0.00904 0.01580 -0.02748 0.00283
199 9D-1 0.01353 0.00522 -0.00923 0.01580 -0.00164
200 9D+2 -0.01019 -0.00540 0.01322 -0.01483 0.00726
201 9D-2 0.02457 0.00935 -0.01483 0.03034 -0.01257
202 10F 0 -0.00029 -0.00037 0.00039 -0.00067 -0.00037
203 10F+1 -0.00046 -0.00011 0.00002 -0.00023 0.00083
204 10F-1 0.00034 0.00006 -0.00021 0.00002 -0.00048
205 10F+2 0.00013 0.00037 -0.00026 0.00053 0.00016
206 10F-2 -0.00023 -0.00064 0.00053 -0.00087 -0.00028
207 10F+3 0.00000 0.00000 0.00070 0.00040 0.00000
208 10F-3 -0.00059 -0.00034 0.00072 -0.00125 0.00152
209 6 H 1S 0.00000 0.00674 0.00843 0.00000 -0.00736
210 2S 0.00000 0.02758 0.02687 0.00000 -0.00650
211 3S 0.00000 0.19937 -0.76012 0.00000 -0.31698
212 4S 0.00000 1.58497 -1.21791 0.00000 -0.99432
213 5PX 0.00162 0.00000 0.00000 -0.00100 0.00000
214 5PY 0.00000 0.00149 0.00050 0.00000 0.00043
215 5PZ 0.00000 0.00162 0.00356 0.00000 0.00102
216 6PX -0.00615 0.00000 0.00000 -0.00152 0.00000
217 6PY 0.00000 -0.02184 0.01125 0.00000 0.00043
218 6PZ 0.00000 -0.00285 -0.01052 0.00000 0.00853
219 7PX 0.00178 0.00000 0.00000 0.00327 0.00000
220 7PY 0.00000 0.16525 -0.47583 0.00000 -0.13046
221 7PZ 0.00000 0.07364 -0.14083 0.00000 -0.06064
222 8D 0 0.00000 0.00075 -0.00143 0.00000 -0.00033
223 8D+1 0.00073 0.00000 0.00000 0.00009 0.00000
224 8D-1 0.00000 -0.00101 0.00398 0.00000 0.00102
225 8D+2 0.00000 0.00150 -0.00379 0.00000 -0.00115
226 8D-2 0.00111 0.00000 0.00000 -0.00129 0.00000
227 9D 0 0.00000 -0.00467 0.01468 0.00000 0.00616
228 9D+1 -0.00377 0.00000 0.00000 -0.00011 0.00000
229 9D-1 0.00000 0.01044 -0.03660 0.00000 -0.00327
230 9D+2 0.00000 -0.01080 0.03891 0.00000 0.01452
231 9D-2 -0.00692 0.00000 0.00000 0.00465 0.00000
232 10F 0 0.00000 -0.00037 0.00077 0.00000 -0.00037
233 10F+1 0.00013 0.00000 0.00000 0.00020 0.00000
234 10F-1 0.00000 -0.00013 0.00025 0.00000 0.00095
235 10F+2 0.00000 -0.00074 0.00117 0.00000 -0.00032
236 10F-2 -0.00001 0.00000 0.00000 -0.00005 0.00000
237 10F+3 0.00000 0.00000 0.00000 0.00081 0.00000
238 10F-3 0.00000 -0.00034 0.00144 0.00000 0.00152
239 7 H 1S -0.00162 0.00674 -0.00422 0.00730 -0.00736
240 2S 0.00287 0.02758 -0.01343 0.02327 -0.00650
241 3S 0.49450 0.19937 0.38006 -0.65828 -0.31698
242 4S 0.42575 1.58497 0.60896 -1.05474 -0.99432
243 5PX -0.00222 0.00129 -0.00065 0.00013 0.00038
244 5PY 0.00221 -0.00074 -0.00063 -0.00065 -0.00022
245 5PZ -0.00236 0.00162 -0.00178 0.00308 0.00102
246 6PX 0.00656 -0.01892 -0.00553 0.00805 0.00037
247 6PY -0.00734 0.01092 0.00167 -0.00553 -0.00022
248 6PZ 0.00376 -0.00285 0.00526 -0.00911 0.00853
249 7PX 0.23039 0.14311 0.20746 -0.35605 -0.11298
250 7PY -0.13199 -0.08262 -0.11650 0.20746 0.06523
251 7PZ 0.10351 0.07364 0.07042 -0.12197 -0.06064
252 8D 0 0.00106 0.00075 0.00072 -0.00124 -0.00033
253 8D+1 -0.00210 -0.00087 -0.00169 0.00301 0.00088
254 8D-1 0.00163 0.00051 0.00106 -0.00169 -0.00051
255 8D+2 -0.00063 -0.00075 -0.00191 0.00108 0.00058
256 8D-2 0.00220 0.00130 0.00108 -0.00316 -0.00100
257 9D 0 -0.01232 -0.00467 -0.00734 0.01271 0.00616
258 9D+1 0.01967 0.00904 0.01580 -0.02748 -0.00283
259 9D-1 -0.01353 -0.00522 -0.00923 0.01580 0.00164
260 9D+2 0.01019 0.00540 0.01322 -0.01483 -0.00726
261 9D-2 -0.02457 -0.00935 -0.01483 0.03034 0.01257
262 10F 0 -0.00029 -0.00037 -0.00039 0.00067 -0.00037
263 10F+1 -0.00046 -0.00011 -0.00002 0.00023 0.00083
264 10F-1 0.00034 0.00006 0.00021 -0.00002 -0.00048
265 10F+2 0.00013 0.00037 0.00026 -0.00053 0.00016
266 10F-2 -0.00023 -0.00064 -0.00053 0.00087 -0.00028
267 10F+3 0.00000 0.00000 -0.00070 -0.00040 0.00000
268 10F-3 -0.00059 -0.00034 -0.00072 0.00125 0.00152
269 8 H 1S 0.00162 0.00674 -0.00422 -0.00730 -0.00736
270 2S -0.00287 0.02758 -0.01343 -0.02327 -0.00650
271 3S -0.49450 0.19937 0.38006 0.65828 -0.31698
272 4S -0.42575 1.58497 0.60896 1.05474 -0.99432
273 5PX -0.00222 -0.00129 0.00065 0.00013 -0.00038
274 5PY -0.00221 -0.00074 -0.00063 0.00065 -0.00022
275 5PZ 0.00236 0.00162 -0.00178 -0.00308 0.00102
276 6PX 0.00656 0.01892 0.00553 0.00805 -0.00037
277 6PY 0.00734 0.01092 0.00167 0.00553 -0.00022
278 6PZ -0.00376 -0.00285 0.00526 0.00911 0.00853
279 7PX 0.23039 -0.14311 -0.20746 -0.35605 0.11298
280 7PY 0.13199 -0.08262 -0.11650 -0.20746 0.06523
281 7PZ -0.10351 0.07364 0.07042 0.12197 -0.06064
282 8D 0 -0.00106 0.00075 0.00072 0.00124 -0.00033
283 8D+1 -0.00210 0.00087 0.00169 0.00301 -0.00088
284 8D-1 -0.00163 0.00051 0.00106 0.00169 -0.00051
285 8D+2 0.00063 -0.00075 -0.00191 -0.00108 0.00058
286 8D-2 0.00220 -0.00130 -0.00108 -0.00316 0.00100
287 9D 0 0.01232 -0.00467 -0.00734 -0.01271 0.00616
288 9D+1 0.01967 -0.00904 -0.01580 -0.02748 0.00283
289 9D-1 0.01353 -0.00522 -0.00923 -0.01580 0.00164
290 9D+2 -0.01019 0.00540 0.01322 0.01483 -0.00726
291 9D-2 -0.02457 0.00935 0.01483 0.03034 -0.01257
292 10F 0 0.00029 -0.00037 -0.00039 -0.00067 -0.00037
293 10F+1 -0.00046 0.00011 0.00002 0.00023 -0.00083
294 10F-1 -0.00034 0.00006 0.00021 0.00002 -0.00048
295 10F+2 -0.00013 0.00037 0.00026 0.00053 0.00016
296 10F-2 -0.00023 0.00064 0.00053 0.00087 0.00028
297 10F+3 0.00000 0.00000 0.00070 -0.00040 0.00000
298 10F-3 0.00059 -0.00034 -0.00072 -0.00125 0.00152
31 32 33 34 35
(EU)--V (EU)--V (EG)--V (EG)--V (A1G)--V
Eigenvalues -- 0.27089 0.27089 0.33608 0.33608 0.33931
1 1 Si 1S 0.00000 0.00000 0.00000 0.00000 -0.00675
2 2S 0.00000 0.00000 0.00000 0.00000 0.02825
3 3S 0.00000 0.00000 0.00000 0.00000 -0.02759
4 4S 0.00000 0.00000 0.00000 0.00000 -0.53961
5 5S 0.00000 0.00000 0.00000 0.00000 0.63066
6 6S 0.00000 0.00000 0.00000 0.00000 7.12061
7 7PX 0.00000 -0.04347 0.00000 0.01287 0.00000
8 7PY 0.04347 0.00000 -0.01287 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.04548
10 8PX 0.00000 -0.01549 0.00000 -0.01891 0.00000
11 8PY 0.01549 0.00000 0.01891 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 -0.01097
13 9PX 0.00000 0.03788 0.00000 0.00603 0.00000
14 9PY -0.03788 0.00000 -0.00603 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.04837
16 10PX 0.00000 1.81095 0.00000 1.41361 0.00000
17 10PY -1.81095 0.00000 -1.41361 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 1.29522
19 11PX 0.00000 1.20776 0.00000 3.79379 0.00000
20 11PY -1.20776 0.00000 -3.79379 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 1.02526
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.85610
23 12D+1 0.00000 1.03196 0.00000 0.55785 0.00000
24 12D-1 -1.03196 0.00000 -0.55785 0.00000 0.00000
25 12D+2 0.50487 0.00000 1.66265 0.00000 0.00000
26 12D-2 0.00000 -0.50487 0.00000 -1.66265 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.24337
28 13D+1 0.00000 0.16682 0.00000 0.25564 0.00000
29 13D-1 -0.16682 0.00000 -0.25564 0.00000 0.00000
30 13D+2 0.32090 0.00000 0.26740 0.00000 0.00000
31 13D-2 0.00000 -0.32090 0.00000 -0.26740 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 -0.01027
33 14D+1 0.00000 0.05883 0.00000 -0.02206 0.00000
34 14D-1 -0.05883 0.00000 0.02206 0.00000 0.00000
35 14D+2 -0.04793 0.00000 0.05610 0.00000 0.00000
36 14D-2 0.00000 0.04793 0.00000 -0.05610 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 -0.29464
38 15F+1 0.00000 -0.05673 0.00000 -0.06937 0.00000
39 15F-1 0.05673 0.00000 0.06937 0.00000 0.00000
40 15F+2 0.21906 0.00000 0.29335 0.00000 0.00000
41 15F-2 0.00000 -0.21906 0.00000 -0.29335 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 -0.51956
44 16F 0 0.00000 0.00000 0.00000 0.00000 -0.00103
45 16F+1 0.00000 -0.01176 0.00000 -0.00478 0.00000
46 16F-1 0.01176 0.00000 0.00478 0.00000 0.00000
47 16F+2 0.01926 0.00000 0.00307 0.00000 0.00000
48 16F-2 0.00000 -0.01926 0.00000 -0.00307 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 -0.01323
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00880
52 17G+1 0.00000 -0.01850 0.00000 -0.02156 0.00000
53 17G-1 0.01850 0.00000 0.02156 0.00000 0.00000
54 17G+2 -0.00550 0.00000 0.00719 0.00000 0.00000
55 17G-2 0.00000 0.00550 0.00000 -0.00719 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 -0.04987
58 17G+4 -0.02267 0.00000 -0.01410 0.00000 0.00000
59 17G-4 0.00000 -0.02267 0.00000 -0.01410 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 -0.00675
61 2S 0.00000 0.00000 0.00000 0.00000 0.02825
62 3S 0.00000 0.00000 0.00000 0.00000 -0.02759
63 4S 0.00000 0.00000 0.00000 0.00000 -0.53961
64 5S 0.00000 0.00000 0.00000 0.00000 0.63066
65 6S 0.00000 0.00000 0.00000 0.00000 7.12061
66 7PX 0.00000 -0.04347 0.00000 -0.01287 0.00000
67 7PY 0.04347 0.00000 0.01287 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.04548
69 8PX 0.00000 -0.01549 0.00000 0.01891 0.00000
70 8PY 0.01549 0.00000 -0.01891 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.01097
72 9PX 0.00000 0.03788 0.00000 -0.00603 0.00000
73 9PY -0.03788 0.00000 0.00603 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 -0.04837
75 10PX 0.00000 1.81095 0.00000 -1.41361 0.00000
76 10PY -1.81095 0.00000 1.41361 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 -1.29522
78 11PX 0.00000 1.20776 0.00000 -3.79379 0.00000
79 11PY -1.20776 0.00000 3.79379 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 -1.02526
81 12D 0 0.00000 0.00000 0.00000 0.00000 -0.85610
82 12D+1 0.00000 -1.03196 0.00000 0.55785 0.00000
83 12D-1 1.03196 0.00000 -0.55785 0.00000 0.00000
84 12D+2 -0.50487 0.00000 1.66265 0.00000 0.00000
85 12D-2 0.00000 0.50487 0.00000 -1.66265 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 -0.24337
87 13D+1 0.00000 -0.16682 0.00000 0.25564 0.00000
88 13D-1 0.16682 0.00000 -0.25564 0.00000 0.00000
89 13D+2 -0.32090 0.00000 0.26740 0.00000 0.00000
90 13D-2 0.00000 0.32090 0.00000 -0.26740 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 -0.01027
92 14D+1 0.00000 -0.05883 0.00000 -0.02206 0.00000
93 14D-1 0.05883 0.00000 0.02206 0.00000 0.00000
94 14D+2 0.04793 0.00000 0.05610 0.00000 0.00000
95 14D-2 0.00000 -0.04793 0.00000 -0.05610 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.29464
97 15F+1 0.00000 -0.05673 0.00000 0.06937 0.00000
98 15F-1 0.05673 0.00000 -0.06937 0.00000 0.00000
99 15F+2 0.21906 0.00000 -0.29335 0.00000 0.00000
100 15F-2 0.00000 -0.21906 0.00000 0.29335 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.51956
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00103
104 16F+1 0.00000 -0.01176 0.00000 0.00478 0.00000
105 16F-1 0.01176 0.00000 -0.00478 0.00000 0.00000
106 16F+2 0.01926 0.00000 -0.00307 0.00000 0.00000
107 16F-2 0.00000 -0.01926 0.00000 0.00307 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.01323
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00880
111 17G+1 0.00000 0.01850 0.00000 -0.02156 0.00000
112 17G-1 -0.01850 0.00000 0.02156 0.00000 0.00000
113 17G+2 0.00550 0.00000 0.00719 0.00000 0.00000
114 17G-2 0.00000 -0.00550 0.00000 -0.00719 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 -0.04987
117 17G+4 0.02267 0.00000 -0.01410 0.00000 0.00000
118 17G-4 0.00000 0.02267 0.00000 -0.01410 0.00000
119 3 H 1S -0.00562 0.00000 -0.00962 0.00000 -0.01034
120 2S -0.06417 0.00000 -0.08840 0.00000 0.03023
121 3S 1.02630 0.00000 1.07394 0.00000 -1.21686
122 4S 2.35412 0.00000 3.97554 0.00000 -2.36056
123 5PX 0.00000 0.00177 0.00000 -0.00084 0.00000
124 5PY 0.00053 0.00000 -0.00247 0.00000 0.00059
125 5PZ -0.00007 0.00000 -0.00232 0.00000 -0.00080
126 6PX 0.00000 0.00601 0.00000 -0.01255 0.00000
127 6PY 0.01335 0.00000 0.02053 0.00000 -0.00590
128 6PZ -0.00782 0.00000 0.01993 0.00000 -0.00182
129 7PX 0.00000 0.04649 0.00000 0.07304 0.00000
130 7PY -0.50832 0.00000 -0.57084 0.00000 0.44594
131 7PZ -0.17176 0.00000 -0.19837 0.00000 0.19963
132 8D 0 0.00216 0.00000 0.00114 0.00000 -0.00003
133 8D+1 0.00000 0.00029 0.00000 0.00019 0.00000
134 8D-1 -0.00236 0.00000 -0.00180 0.00000 0.00181
135 8D+2 0.00344 0.00000 0.00411 0.00000 -0.00179
136 8D-2 0.00000 0.00002 0.00000 0.00223 0.00000
137 9D 0 -0.01447 0.00000 -0.01766 0.00000 0.00602
138 9D+1 0.00000 -0.00058 0.00000 0.00349 0.00000
139 9D-1 0.03053 0.00000 0.01915 0.00000 -0.02196
140 9D+2 -0.03544 0.00000 -0.03934 0.00000 0.02650
141 9D-2 0.00000 -0.00545 0.00000 -0.00704 0.00000
142 10F 0 0.00197 0.00000 0.00205 0.00000 -0.00026
143 10F+1 0.00000 -0.00067 0.00000 -0.00027 0.00000
144 10F-1 -0.00126 0.00000 0.00173 0.00000 -0.00079
145 10F+2 0.00223 0.00000 0.00141 0.00000 -0.00207
146 10F-2 0.00000 0.00025 0.00000 -0.00148 0.00000
147 10F+3 0.00000 -0.00118 0.00000 0.00119 0.00000
148 10F-3 0.00176 0.00000 0.00292 0.00000 -0.00197
149 4 H 1S 0.00281 -0.00487 0.00481 -0.00833 -0.01034
150 2S 0.03209 -0.05558 0.04420 -0.07656 0.03023
151 3S -0.51315 0.88880 -0.53697 0.93006 -1.21686
152 4S -1.17706 2.03873 -1.98777 3.44292 -2.36056
153 5PX 0.00100 0.00004 -0.00143 0.00165 -0.00051
154 5PY -0.00120 -0.00100 0.00001 0.00143 -0.00030
155 5PZ 0.00003 -0.00006 0.00116 -0.00201 -0.00080
156 6PX 0.00838 -0.00851 0.00345 -0.01853 0.00511
157 6PY -0.00117 -0.00838 0.01455 -0.00345 0.00295
158 6PZ 0.00391 -0.00677 -0.00997 0.01726 -0.00182
159 7PX -0.19998 0.39286 -0.21555 0.44639 -0.38620
160 7PY -0.16195 0.19998 -0.19749 0.21555 -0.22297
161 7PZ 0.08588 -0.14874 0.09919 -0.17179 0.19963
162 8D 0 -0.00108 0.00187 -0.00057 0.00099 -0.00003
163 8D+1 -0.00089 0.00184 -0.00070 0.00140 -0.00157
164 8D-1 -0.00081 0.00089 -0.00059 0.00070 -0.00090
165 8D+2 0.00084 -0.00150 -0.00065 -0.00274 0.00090
166 8D-2 0.00150 -0.00257 0.00274 -0.00252 0.00155
167 9D 0 0.00724 -0.01253 0.00883 -0.01529 0.00602
168 9D+1 0.01297 -0.02304 0.00980 -0.01349 0.01902
169 9D-1 0.00807 -0.01297 0.00217 -0.00980 0.01098
170 9D+2 -0.00477 0.01770 -0.00456 0.02008 -0.01325
171 9D-2 -0.01770 0.02522 -0.02008 0.02774 -0.02295
172 10F 0 -0.00098 0.00171 -0.00103 0.00178 -0.00026
173 10F+1 -0.00084 0.00078 0.00063 -0.00136 0.00068
174 10F-1 0.00018 0.00084 0.00064 -0.00063 0.00039
175 10F+2 0.00037 -0.00107 0.00146 0.00003 0.00103
176 10F-2 0.00107 -0.00161 -0.00003 -0.00142 0.00179
177 10F+3 0.00102 0.00059 -0.00103 -0.00059 0.00000
178 10F-3 -0.00088 0.00152 -0.00146 0.00252 -0.00197
179 5 H 1S 0.00281 0.00487 0.00481 0.00833 -0.01034
180 2S 0.03209 0.05558 0.04420 0.07656 0.03023
181 3S -0.51315 -0.88880 -0.53697 -0.93006 -1.21686
182 4S -1.17706 -2.03873 -1.98777 -3.44292 -2.36056
183 5PX -0.00100 0.00004 0.00143 0.00165 0.00051
184 5PY -0.00120 0.00100 0.00001 -0.00143 -0.00030
185 5PZ 0.00003 0.00006 0.00116 0.00201 -0.00080
186 6PX -0.00838 -0.00851 -0.00345 -0.01853 -0.00511
187 6PY -0.00117 0.00838 0.01455 0.00345 0.00295
188 6PZ 0.00391 0.00677 -0.00997 -0.01726 -0.00182
189 7PX 0.19998 0.39286 0.21555 0.44639 0.38620
190 7PY -0.16195 -0.19998 -0.19749 -0.21555 -0.22297
191 7PZ 0.08588 0.14874 0.09919 0.17179 0.19963
192 8D 0 -0.00108 -0.00187 -0.00057 -0.00099 -0.00003
193 8D+1 0.00089 0.00184 0.00070 0.00140 0.00157
194 8D-1 -0.00081 -0.00089 -0.00059 -0.00070 -0.00090
195 8D+2 0.00084 0.00150 -0.00065 0.00274 0.00090
196 8D-2 -0.00150 -0.00257 -0.00274 -0.00252 -0.00155
197 9D 0 0.00724 0.01253 0.00883 0.01529 0.00602
198 9D+1 -0.01297 -0.02304 -0.00980 -0.01349 -0.01902
199 9D-1 0.00807 0.01297 0.00217 0.00980 0.01098
200 9D+2 -0.00477 -0.01770 -0.00456 -0.02008 -0.01325
201 9D-2 0.01770 0.02522 0.02008 0.02774 0.02295
202 10F 0 -0.00098 -0.00171 -0.00103 -0.00178 -0.00026
203 10F+1 0.00084 0.00078 -0.00063 -0.00136 -0.00068
204 10F-1 0.00018 -0.00084 0.00064 0.00063 0.00039
205 10F+2 0.00037 0.00107 0.00146 -0.00003 0.00103
206 10F-2 -0.00107 -0.00161 0.00003 -0.00142 -0.00179
207 10F+3 -0.00102 0.00059 0.00103 -0.00059 0.00000
208 10F-3 -0.00088 -0.00152 -0.00146 -0.00252 -0.00197
209 6 H 1S 0.00562 0.00000 -0.00962 0.00000 -0.01034
210 2S 0.06417 0.00000 -0.08840 0.00000 0.03023
211 3S -1.02630 0.00000 1.07394 0.00000 -1.21686
212 4S -2.35412 0.00000 3.97554 0.00000 -2.36056
213 5PX 0.00000 0.00177 0.00000 0.00084 0.00000
214 5PY 0.00053 0.00000 0.00247 0.00000 -0.00059
215 5PZ -0.00007 0.00000 0.00232 0.00000 0.00080
216 6PX 0.00000 0.00601 0.00000 0.01255 0.00000
217 6PY 0.01335 0.00000 -0.02053 0.00000 0.00590
218 6PZ -0.00782 0.00000 -0.01993 0.00000 0.00182
219 7PX 0.00000 0.04649 0.00000 -0.07304 0.00000
220 7PY -0.50832 0.00000 0.57084 0.00000 -0.44594
221 7PZ -0.17176 0.00000 0.19837 0.00000 -0.19963
222 8D 0 -0.00216 0.00000 0.00114 0.00000 -0.00003
223 8D+1 0.00000 -0.00029 0.00000 0.00019 0.00000
224 8D-1 0.00236 0.00000 -0.00180 0.00000 0.00181
225 8D+2 -0.00344 0.00000 0.00411 0.00000 -0.00179
226 8D-2 0.00000 -0.00002 0.00000 0.00223 0.00000
227 9D 0 0.01447 0.00000 -0.01766 0.00000 0.00602
228 9D+1 0.00000 0.00058 0.00000 0.00349 0.00000
229 9D-1 -0.03053 0.00000 0.01915 0.00000 -0.02196
230 9D+2 0.03544 0.00000 -0.03934 0.00000 0.02650
231 9D-2 0.00000 0.00545 0.00000 -0.00704 0.00000
232 10F 0 0.00197 0.00000 -0.00205 0.00000 0.00026
233 10F+1 0.00000 -0.00067 0.00000 0.00027 0.00000
234 10F-1 -0.00126 0.00000 -0.00173 0.00000 0.00079
235 10F+2 0.00223 0.00000 -0.00141 0.00000 0.00207
236 10F-2 0.00000 0.00025 0.00000 0.00148 0.00000
237 10F+3 0.00000 -0.00118 0.00000 -0.00119 0.00000
238 10F-3 0.00176 0.00000 -0.00292 0.00000 0.00197
239 7 H 1S -0.00281 -0.00487 0.00481 0.00833 -0.01034
240 2S -0.03209 -0.05558 0.04420 0.07656 0.03023
241 3S 0.51315 0.88880 -0.53697 -0.93006 -1.21686
242 4S 1.17706 2.03873 -1.98777 -3.44292 -2.36056
243 5PX -0.00100 0.00004 -0.00143 -0.00165 -0.00051
244 5PY -0.00120 0.00100 -0.00001 0.00143 0.00030
245 5PZ 0.00003 0.00006 -0.00116 -0.00201 0.00080
246 6PX -0.00838 -0.00851 0.00345 0.01853 0.00511
247 6PY -0.00117 0.00838 -0.01455 -0.00345 -0.00295
248 6PZ 0.00391 0.00677 0.00997 0.01726 0.00182
249 7PX 0.19998 0.39286 -0.21555 -0.44639 -0.38620
250 7PY -0.16195 -0.19998 0.19749 0.21555 0.22297
251 7PZ 0.08588 0.14874 -0.09919 -0.17179 -0.19963
252 8D 0 0.00108 0.00187 -0.00057 -0.00099 -0.00003
253 8D+1 -0.00089 -0.00184 0.00070 0.00140 0.00157
254 8D-1 0.00081 0.00089 -0.00059 -0.00070 -0.00090
255 8D+2 -0.00084 -0.00150 -0.00065 0.00274 0.00090
256 8D-2 0.00150 0.00257 -0.00274 -0.00252 -0.00155
257 9D 0 -0.00724 -0.01253 0.00883 0.01529 0.00602
258 9D+1 0.01297 0.02304 -0.00980 -0.01349 -0.01902
259 9D-1 -0.00807 -0.01297 0.00217 0.00980 0.01098
260 9D+2 0.00477 0.01770 -0.00456 -0.02008 -0.01325
261 9D-2 -0.01770 -0.02522 0.02008 0.02774 0.02295
262 10F 0 -0.00098 -0.00171 0.00103 0.00178 0.00026
263 10F+1 0.00084 0.00078 0.00063 0.00136 0.00068
264 10F-1 0.00018 -0.00084 -0.00064 -0.00063 -0.00039
265 10F+2 0.00037 0.00107 -0.00146 0.00003 -0.00103
266 10F-2 -0.00107 -0.00161 -0.00003 0.00142 0.00179
267 10F+3 -0.00102 0.00059 -0.00103 0.00059 0.00000
268 10F-3 -0.00088 -0.00152 0.00146 0.00252 0.00197
269 8 H 1S -0.00281 0.00487 0.00481 -0.00833 -0.01034
270 2S -0.03209 0.05558 0.04420 -0.07656 0.03023
271 3S 0.51315 -0.88880 -0.53697 0.93006 -1.21686
272 4S 1.17706 -2.03873 -1.98777 3.44292 -2.36056
273 5PX 0.00100 0.00004 0.00143 -0.00165 0.00051
274 5PY -0.00120 -0.00100 -0.00001 -0.00143 0.00030
275 5PZ 0.00003 -0.00006 -0.00116 0.00201 0.00080
276 6PX 0.00838 -0.00851 -0.00345 0.01853 -0.00511
277 6PY -0.00117 -0.00838 -0.01455 0.00345 -0.00295
278 6PZ 0.00391 -0.00677 0.00997 -0.01726 0.00182
279 7PX -0.19998 0.39286 0.21555 -0.44639 0.38620
280 7PY -0.16195 0.19998 0.19749 -0.21555 0.22297
281 7PZ 0.08588 -0.14874 -0.09919 0.17179 -0.19963
282 8D 0 0.00108 -0.00187 -0.00057 0.00099 -0.00003
283 8D+1 0.00089 -0.00184 -0.00070 0.00140 -0.00157
284 8D-1 0.00081 -0.00089 -0.00059 0.00070 -0.00090
285 8D+2 -0.00084 0.00150 -0.00065 -0.00274 0.00090
286 8D-2 -0.00150 0.00257 0.00274 -0.00252 0.00155
287 9D 0 -0.00724 0.01253 0.00883 -0.01529 0.00602
288 9D+1 -0.01297 0.02304 0.00980 -0.01349 0.01902
289 9D-1 -0.00807 0.01297 0.00217 -0.00980 0.01098
290 9D+2 0.00477 -0.01770 -0.00456 0.02008 -0.01325
291 9D-2 0.01770 -0.02522 -0.02008 0.02774 -0.02295
292 10F 0 -0.00098 0.00171 0.00103 -0.00178 0.00026
293 10F+1 -0.00084 0.00078 -0.00063 0.00136 -0.00068
294 10F-1 0.00018 0.00084 -0.00064 0.00063 -0.00039
295 10F+2 0.00037 -0.00107 -0.00146 -0.00003 -0.00103
296 10F-2 0.00107 -0.00161 0.00003 0.00142 -0.00179
297 10F+3 0.00102 0.00059 0.00103 0.00059 0.00000
298 10F-3 -0.00088 0.00152 0.00146 -0.00252 0.00197
36 37 38 39 40
(EU)--V (EU)--V (A1G)--V (A2U)--V (EG)--V
Eigenvalues -- 0.34345 0.34345 0.36290 0.39773 0.42948
1 1 Si 1S 0.00000 0.00000 -0.01082 -0.02101 0.00000
2 2S 0.00000 0.00000 0.01388 0.06815 0.00000
3 3S 0.00000 0.00000 -0.08051 -0.09813 0.00000
4 4S 0.00000 0.00000 -0.94264 -0.07984 0.00000
5 5S 0.00000 0.00000 3.10272 -1.96947 0.00000
6 6S 0.00000 0.00000 2.23100 12.36074 0.00000
7 7PX 0.00000 0.01710 0.00000 0.00000 0.04544
8 7PY -0.01710 0.00000 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.04371 -0.00760 0.00000
10 8PX 0.00000 -0.01689 0.00000 0.00000 -0.01082
11 8PY 0.01689 0.00000 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00090 -0.01960 0.00000
13 9PX 0.00000 -0.00220 0.00000 0.00000 -0.01833
14 9PY 0.00220 0.00000 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 -0.05538 0.17204 0.00000
16 10PX 0.00000 1.41702 0.00000 0.00000 0.00324
17 10PY -1.41702 0.00000 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 -0.29489 -0.74022 0.00000
19 11PX 0.00000 2.31335 0.00000 0.00000 -0.84482
20 11PY -2.31335 0.00000 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 1.80473 -1.34165 0.00000
22 12D 0 0.00000 0.00000 -1.64103 -0.04323 0.00000
23 12D+1 0.00000 0.65331 0.00000 0.00000 2.14469
24 12D-1 -0.65331 0.00000 0.00000 0.00000 0.00000
25 12D+2 1.75065 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 -1.75065 0.00000 0.00000 -0.26375
27 13D 0 0.00000 0.00000 -0.03436 0.05592 0.00000
28 13D+1 0.00000 0.17738 0.00000 0.00000 -0.03493
29 13D-1 -0.17738 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.20983 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 -0.20983 0.00000 0.00000 -0.14661
32 14D 0 0.00000 0.00000 -0.07063 -0.04246 0.00000
33 14D+1 0.00000 0.00035 0.00000 0.00000 0.06893
34 14D-1 -0.00035 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.06155 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 -0.06155 0.00000 0.00000 0.02899
37 15F 0 0.00000 0.00000 0.09777 -0.35171 0.00000
38 15F+1 0.00000 -0.12870 0.00000 0.00000 -0.26676
39 15F-1 0.12870 0.00000 0.00000 0.00000 0.00000
40 15F+2 0.22391 0.00000 0.00000 0.00000 0.00000
41 15F-2 0.00000 -0.22391 0.00000 0.00000 -0.17896
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 -0.37775 -0.28694 0.00000
44 16F 0 0.00000 0.00000 -0.07459 0.00218 0.00000
45 16F+1 0.00000 0.00369 0.00000 0.00000 0.03685
46 16F-1 -0.00369 0.00000 0.00000 0.00000 0.00000
47 16F+2 0.01665 0.00000 0.00000 0.00000 0.00000
48 16F-2 0.00000 -0.01665 0.00000 0.00000 0.00992
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 -0.02728 0.00641 0.00000
51 17G 0 0.00000 0.00000 -0.01177 0.03622 0.00000
52 17G+1 0.00000 -0.01795 0.00000 0.00000 0.01572
53 17G-1 0.01795 0.00000 0.00000 0.00000 0.00000
54 17G+2 -0.00601 0.00000 0.00000 0.00000 0.00000
55 17G-2 0.00000 0.00601 0.00000 0.00000 -0.00290
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 -0.01673 -0.01431 0.00000
58 17G+4 -0.01331 0.00000 0.00000 0.00000 0.00000
59 17G-4 0.00000 -0.01331 0.00000 0.00000 -0.00850
60 2 Si 1S 0.00000 0.00000 -0.01082 0.02101 0.00000
61 2S 0.00000 0.00000 0.01388 -0.06815 0.00000
62 3S 0.00000 0.00000 -0.08051 0.09813 0.00000
63 4S 0.00000 0.00000 -0.94264 0.07984 0.00000
64 5S 0.00000 0.00000 3.10272 1.96947 0.00000
65 6S 0.00000 0.00000 2.23100 -12.36074 0.00000
66 7PX 0.00000 0.01710 0.00000 0.00000 -0.04544
67 7PY -0.01710 0.00000 0.00000 0.00000 0.00000
68 7PZ 0.00000 0.00000 -0.04371 -0.00760 0.00000
69 8PX 0.00000 -0.01689 0.00000 0.00000 0.01082
70 8PY 0.01689 0.00000 0.00000 0.00000 0.00000
71 8PZ 0.00000 0.00000 -0.00090 -0.01960 0.00000
72 9PX 0.00000 -0.00220 0.00000 0.00000 0.01833
73 9PY 0.00220 0.00000 0.00000 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.05538 0.17204 0.00000
75 10PX 0.00000 1.41702 0.00000 0.00000 -0.00324
76 10PY -1.41702 0.00000 0.00000 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.29489 -0.74022 0.00000
78 11PX 0.00000 2.31335 0.00000 0.00000 0.84482
79 11PY -2.31335 0.00000 0.00000 0.00000 0.00000
80 11PZ 0.00000 0.00000 -1.80473 -1.34165 0.00000
81 12D 0 0.00000 0.00000 -1.64103 0.04323 0.00000
82 12D+1 0.00000 -0.65331 0.00000 0.00000 2.14469
83 12D-1 0.65331 0.00000 0.00000 0.00000 0.00000
84 12D+2 -1.75065 0.00000 0.00000 0.00000 0.00000
85 12D-2 0.00000 1.75065 0.00000 0.00000 -0.26375
86 13D 0 0.00000 0.00000 -0.03436 -0.05592 0.00000
87 13D+1 0.00000 -0.17738 0.00000 0.00000 -0.03493
88 13D-1 0.17738 0.00000 0.00000 0.00000 0.00000
89 13D+2 -0.20983 0.00000 0.00000 0.00000 0.00000
90 13D-2 0.00000 0.20983 0.00000 0.00000 -0.14661
91 14D 0 0.00000 0.00000 -0.07063 0.04246 0.00000
92 14D+1 0.00000 -0.00035 0.00000 0.00000 0.06893
93 14D-1 0.00035 0.00000 0.00000 0.00000 0.00000
94 14D+2 -0.06155 0.00000 0.00000 0.00000 0.00000
95 14D-2 0.00000 0.06155 0.00000 0.00000 0.02899
96 15F 0 0.00000 0.00000 -0.09777 -0.35171 0.00000
97 15F+1 0.00000 -0.12870 0.00000 0.00000 0.26676
98 15F-1 0.12870 0.00000 0.00000 0.00000 0.00000
99 15F+2 0.22391 0.00000 0.00000 0.00000 0.00000
100 15F-2 0.00000 -0.22391 0.00000 0.00000 0.17896
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.37775 -0.28694 0.00000
103 16F 0 0.00000 0.00000 0.07459 0.00218 0.00000
104 16F+1 0.00000 0.00369 0.00000 0.00000 -0.03685
105 16F-1 -0.00369 0.00000 0.00000 0.00000 0.00000
106 16F+2 0.01665 0.00000 0.00000 0.00000 0.00000
107 16F-2 0.00000 -0.01665 0.00000 0.00000 -0.00992
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.02728 0.00641 0.00000
110 17G 0 0.00000 0.00000 -0.01177 -0.03622 0.00000
111 17G+1 0.00000 0.01795 0.00000 0.00000 0.01572
112 17G-1 -0.01795 0.00000 0.00000 0.00000 0.00000
113 17G+2 0.00601 0.00000 0.00000 0.00000 0.00000
114 17G-2 0.00000 -0.00601 0.00000 0.00000 -0.00290
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 -0.01673 0.01431 0.00000
117 17G+4 0.01331 0.00000 0.00000 0.00000 0.00000
118 17G-4 0.00000 0.01331 0.00000 0.00000 -0.00850
119 3 H 1S -0.01765 0.00000 0.01836 -0.00188 0.00000
120 2S -0.10143 0.00000 0.07934 0.05984 0.00000
121 3S 0.89228 0.00000 -0.51692 -0.65228 0.00000
122 4S 3.71080 0.00000 -1.25720 -2.09482 0.00000
123 5PX 0.00000 0.00041 0.00000 0.00000 -0.00224
124 5PY -0.00526 0.00000 0.00224 0.00561 0.00000
125 5PZ -0.00220 0.00000 0.00077 0.00584 0.00000
126 6PX 0.00000 -0.02058 0.00000 0.00000 0.01187
127 6PY 0.03436 0.00000 -0.00844 -0.02359 0.00000
128 6PZ 0.02208 0.00000 -0.01756 -0.02841 0.00000
129 7PX 0.00000 0.08186 0.00000 0.00000 -0.01292
130 7PY -0.53225 0.00000 0.33944 0.26103 0.00000
131 7PZ -0.23167 0.00000 0.23834 0.20202 0.00000
132 8D 0 0.00041 0.00000 0.00111 0.00101 0.00000
133 8D+1 0.00000 0.00102 0.00000 0.00000 0.00073
134 8D-1 -0.00280 0.00000 0.00386 0.00152 0.00000
135 8D+2 0.00312 0.00000 -0.00270 0.00025 0.00000
136 8D-2 0.00000 0.00154 0.00000 0.00000 0.00088
137 9D 0 -0.00935 0.00000 -0.00146 -0.00506 0.00000
138 9D+1 0.00000 -0.00189 0.00000 0.00000 -0.00016
139 9D-1 0.02522 0.00000 -0.02414 -0.01339 0.00000
140 9D+2 -0.02909 0.00000 0.02955 0.00452 0.00000
141 9D-2 0.00000 -0.00303 0.00000 0.00000 -0.00989
142 10F 0 0.00244 0.00000 0.00042 -0.00098 0.00000
143 10F+1 0.00000 0.00002 0.00000 0.00000 -0.00029
144 10F-1 0.00168 0.00000 -0.00124 -0.00054 0.00000
145 10F+2 0.00186 0.00000 -0.00021 -0.00221 0.00000
146 10F-2 0.00000 -0.00110 0.00000 0.00000 -0.00081
147 10F+3 0.00000 0.00115 0.00000 0.00000 -0.00158
148 10F-3 0.00274 0.00000 -0.00320 -0.00151 0.00000
149 4 H 1S 0.00883 -0.01529 0.01836 -0.00188 -0.00267
150 2S 0.05072 -0.08784 0.07934 0.05984 -0.05429
151 3S -0.44614 0.77274 -0.51692 -0.65228 0.60823
152 4S -1.85540 3.21365 -1.25720 -2.09482 0.26065
153 5PX -0.00210 0.00405 -0.00194 -0.00486 -0.00013
154 5PY -0.00162 0.00210 -0.00112 -0.00281 0.00121
155 5PZ 0.00110 -0.00191 0.00077 0.00584 -0.00130
156 6PX 0.00597 -0.03092 0.00731 0.02043 -0.00552
157 6PY 0.02403 -0.00597 0.00422 0.01180 -0.01004
158 6PZ -0.01104 0.01912 -0.01756 -0.02841 -0.01708
159 7PX -0.19502 0.41966 -0.29397 -0.22606 0.12639
160 7PY -0.19446 0.19502 -0.16972 -0.13052 0.08043
161 7PZ 0.11584 -0.20064 0.23834 0.20202 -0.04225
162 8D 0 -0.00020 0.00035 0.00111 0.00101 0.00207
163 8D+1 -0.00077 0.00236 -0.00335 -0.00132 0.00068
164 8D-1 -0.00147 0.00077 -0.00193 -0.00076 -0.00003
165 8D+2 -0.00037 -0.00202 0.00135 -0.00012 0.00022
166 8D-2 0.00202 -0.00195 0.00234 -0.00021 0.00126
167 9D 0 0.00467 -0.00810 -0.00146 -0.00506 -0.00768
168 9D+1 0.01011 -0.01939 0.02091 0.01160 -0.00779
169 9D-1 0.00772 -0.01011 0.01207 0.00670 -0.00441
170 9D+2 -0.00500 0.01391 -0.01477 -0.00226 0.00139
171 9D-2 -0.01391 0.02106 -0.02559 -0.00391 -0.00748
172 10F 0 -0.00122 0.00211 0.00042 -0.00098 0.00062
173 10F+1 0.00074 -0.00126 0.00107 0.00047 0.00121
174 10F-1 0.00041 -0.00074 0.00062 0.00027 0.00086
175 10F+2 0.00129 -0.00033 0.00010 0.00110 0.00004
176 10F-2 0.00033 -0.00167 0.00018 0.00191 -0.00075
177 10F+3 -0.00100 -0.00058 0.00000 0.00000 0.00079
178 10F-3 -0.00137 0.00238 -0.00320 -0.00151 0.00069
179 5 H 1S 0.00883 0.01529 0.01836 -0.00188 0.00267
180 2S 0.05072 0.08784 0.07934 0.05984 0.05429
181 3S -0.44614 -0.77274 -0.51692 -0.65228 -0.60823
182 4S -1.85540 -3.21365 -1.25720 -2.09482 -0.26065
183 5PX 0.00210 0.00405 0.00194 0.00486 -0.00013
184 5PY -0.00162 -0.00210 -0.00112 -0.00281 -0.00121
185 5PZ 0.00110 0.00191 0.00077 0.00584 0.00130
186 6PX -0.00597 -0.03092 -0.00731 -0.02043 -0.00552
187 6PY 0.02403 0.00597 0.00422 0.01180 0.01004
188 6PZ -0.01104 -0.01912 -0.01756 -0.02841 0.01708
189 7PX 0.19502 0.41966 0.29397 0.22606 0.12639
190 7PY -0.19446 -0.19502 -0.16972 -0.13052 -0.08043
191 7PZ 0.11584 0.20064 0.23834 0.20202 0.04225
192 8D 0 -0.00020 -0.00035 0.00111 0.00101 -0.00207
193 8D+1 0.00077 0.00236 0.00335 0.00132 0.00068
194 8D-1 -0.00147 -0.00077 -0.00193 -0.00076 0.00003
195 8D+2 -0.00037 0.00202 0.00135 -0.00012 -0.00022
196 8D-2 -0.00202 -0.00195 -0.00234 0.00021 0.00126
197 9D 0 0.00467 0.00810 -0.00146 -0.00506 0.00768
198 9D+1 -0.01011 -0.01939 -0.02091 -0.01160 -0.00779
199 9D-1 0.00772 0.01011 0.01207 0.00670 0.00441
200 9D+2 -0.00500 -0.01391 -0.01477 -0.00226 -0.00139
201 9D-2 0.01391 0.02106 0.02559 0.00391 -0.00748
202 10F 0 -0.00122 -0.00211 0.00042 -0.00098 -0.00062
203 10F+1 -0.00074 -0.00126 -0.00107 -0.00047 0.00121
204 10F-1 0.00041 0.00074 0.00062 0.00027 -0.00086
205 10F+2 0.00129 0.00033 0.00010 0.00110 -0.00004
206 10F-2 -0.00033 -0.00167 -0.00018 -0.00191 -0.00075
207 10F+3 0.00100 -0.00058 0.00000 0.00000 0.00079
208 10F-3 -0.00137 -0.00238 -0.00320 -0.00151 -0.00069
209 6 H 1S 0.01765 0.00000 0.01836 0.00188 0.00000
210 2S 0.10143 0.00000 0.07934 -0.05984 0.00000
211 3S -0.89228 0.00000 -0.51692 0.65228 0.00000
212 4S -3.71080 0.00000 -1.25720 2.09482 0.00000
213 5PX 0.00000 0.00041 0.00000 0.00000 0.00224
214 5PY -0.00526 0.00000 -0.00224 0.00561 0.00000
215 5PZ -0.00220 0.00000 -0.00077 0.00584 0.00000
216 6PX 0.00000 -0.02058 0.00000 0.00000 -0.01187
217 6PY 0.03436 0.00000 0.00844 -0.02359 0.00000
218 6PZ 0.02208 0.00000 0.01756 -0.02841 0.00000
219 7PX 0.00000 0.08186 0.00000 0.00000 0.01292
220 7PY -0.53225 0.00000 -0.33944 0.26103 0.00000
221 7PZ -0.23167 0.00000 -0.23834 0.20202 0.00000
222 8D 0 -0.00041 0.00000 0.00111 -0.00101 0.00000
223 8D+1 0.00000 -0.00102 0.00000 0.00000 0.00073
224 8D-1 0.00280 0.00000 0.00386 -0.00152 0.00000
225 8D+2 -0.00312 0.00000 -0.00270 -0.00025 0.00000
226 8D-2 0.00000 -0.00154 0.00000 0.00000 0.00088
227 9D 0 0.00935 0.00000 -0.00146 0.00506 0.00000
228 9D+1 0.00000 0.00189 0.00000 0.00000 -0.00016
229 9D-1 -0.02522 0.00000 -0.02414 0.01339 0.00000
230 9D+2 0.02909 0.00000 0.02955 -0.00452 0.00000
231 9D-2 0.00000 0.00303 0.00000 0.00000 -0.00989
232 10F 0 0.00244 0.00000 -0.00042 -0.00098 0.00000
233 10F+1 0.00000 0.00002 0.00000 0.00000 0.00029
234 10F-1 0.00168 0.00000 0.00124 -0.00054 0.00000
235 10F+2 0.00186 0.00000 0.00021 -0.00221 0.00000
236 10F-2 0.00000 -0.00110 0.00000 0.00000 0.00081
237 10F+3 0.00000 0.00115 0.00000 0.00000 0.00158
238 10F-3 0.00274 0.00000 0.00320 -0.00151 0.00000
239 7 H 1S -0.00883 -0.01529 0.01836 0.00188 0.00267
240 2S -0.05072 -0.08784 0.07934 -0.05984 0.05429
241 3S 0.44614 0.77274 -0.51692 0.65228 -0.60823
242 4S 1.85540 3.21365 -1.25720 2.09482 -0.26065
243 5PX 0.00210 0.00405 -0.00194 0.00486 0.00013
244 5PY -0.00162 -0.00210 0.00112 -0.00281 0.00121
245 5PZ 0.00110 0.00191 -0.00077 0.00584 -0.00130
246 6PX -0.00597 -0.03092 0.00731 -0.02043 0.00552
247 6PY 0.02403 0.00597 -0.00422 0.01180 -0.01004
248 6PZ -0.01104 -0.01912 0.01756 -0.02841 -0.01708
249 7PX 0.19502 0.41966 -0.29397 0.22606 -0.12639
250 7PY -0.19446 -0.19502 0.16972 -0.13052 0.08043
251 7PZ 0.11584 0.20064 -0.23834 0.20202 -0.04225
252 8D 0 0.00020 0.00035 0.00111 -0.00101 -0.00207
253 8D+1 -0.00077 -0.00236 0.00335 -0.00132 0.00068
254 8D-1 0.00147 0.00077 -0.00193 0.00076 0.00003
255 8D+2 0.00037 -0.00202 0.00135 0.00012 -0.00022
256 8D-2 0.00202 0.00195 -0.00234 -0.00021 0.00126
257 9D 0 -0.00467 -0.00810 -0.00146 0.00506 0.00768
258 9D+1 0.01011 0.01939 -0.02091 0.01160 -0.00779
259 9D-1 -0.00772 -0.01011 0.01207 -0.00670 0.00441
260 9D+2 0.00500 0.01391 -0.01477 0.00226 -0.00139
261 9D-2 -0.01391 -0.02106 0.02559 -0.00391 -0.00748
262 10F 0 -0.00122 -0.00211 -0.00042 -0.00098 0.00062
263 10F+1 -0.00074 -0.00126 0.00107 -0.00047 -0.00121
264 10F-1 0.00041 0.00074 -0.00062 0.00027 0.00086
265 10F+2 0.00129 0.00033 -0.00010 0.00110 0.00004
266 10F-2 -0.00033 -0.00167 0.00018 -0.00191 0.00075
267 10F+3 0.00100 -0.00058 0.00000 0.00000 -0.00079
268 10F-3 -0.00137 -0.00238 0.00320 -0.00151 0.00069
269 8 H 1S -0.00883 0.01529 0.01836 0.00188 -0.00267
270 2S -0.05072 0.08784 0.07934 -0.05984 -0.05429
271 3S 0.44614 -0.77274 -0.51692 0.65228 0.60823
272 4S 1.85540 -3.21365 -1.25720 2.09482 0.26065
273 5PX -0.00210 0.00405 0.00194 -0.00486 0.00013
274 5PY -0.00162 0.00210 0.00112 -0.00281 -0.00121
275 5PZ 0.00110 -0.00191 -0.00077 0.00584 0.00130
276 6PX 0.00597 -0.03092 -0.00731 0.02043 0.00552
277 6PY 0.02403 -0.00597 -0.00422 0.01180 0.01004
278 6PZ -0.01104 0.01912 0.01756 -0.02841 0.01708
279 7PX -0.19502 0.41966 0.29397 -0.22606 -0.12639
280 7PY -0.19446 0.19502 0.16972 -0.13052 -0.08043
281 7PZ 0.11584 -0.20064 -0.23834 0.20202 0.04225
282 8D 0 0.00020 -0.00035 0.00111 -0.00101 0.00207
283 8D+1 0.00077 -0.00236 -0.00335 0.00132 0.00068
284 8D-1 0.00147 -0.00077 -0.00193 0.00076 -0.00003
285 8D+2 0.00037 0.00202 0.00135 0.00012 0.00022
286 8D-2 -0.00202 0.00195 0.00234 0.00021 0.00126
287 9D 0 -0.00467 0.00810 -0.00146 0.00506 -0.00768
288 9D+1 -0.01011 0.01939 0.02091 -0.01160 -0.00779
289 9D-1 -0.00772 0.01011 0.01207 -0.00670 -0.00441
290 9D+2 0.00500 -0.01391 -0.01477 0.00226 0.00139
291 9D-2 0.01391 -0.02106 -0.02559 0.00391 -0.00748
292 10F 0 -0.00122 0.00211 -0.00042 -0.00098 -0.00062
293 10F+1 0.00074 -0.00126 -0.00107 0.00047 -0.00121
294 10F-1 0.00041 -0.00074 -0.00062 0.00027 -0.00086
295 10F+2 0.00129 -0.00033 -0.00010 0.00110 -0.00004
296 10F-2 0.00033 -0.00167 -0.00018 0.00191 0.00075
297 10F+3 -0.00100 -0.00058 0.00000 0.00000 -0.00079
298 10F-3 -0.00137 0.00238 0.00320 -0.00151 -0.00069
41 42 43 44 45
(EG)--V (A2U)--V (EG)--V (EG)--V (A1G)--V
Eigenvalues -- 0.42948 0.46278 0.52173 0.52173 0.52574
1 1 Si 1S 0.00000 0.02314 0.00000 0.00000 0.02334
2 2S 0.00000 -0.05112 0.00000 0.00000 -0.07312
3 3S 0.00000 0.14009 0.00000 0.00000 0.10561
4 4S 0.00000 0.72527 0.00000 0.00000 -0.83679
5 5S 0.00000 -2.40294 0.00000 0.00000 3.72160
6 6S 0.00000 3.24195 0.00000 0.00000 -2.12169
7 7PX 0.00000 0.00000 -0.09087 0.00000 0.00000
8 7PY 0.04544 0.00000 0.00000 0.09087 0.00000
9 7PZ 0.00000 0.02813 0.00000 0.00000 -0.05520
10 8PX 0.00000 0.00000 -0.01615 0.00000 0.00000
11 8PY -0.01082 0.00000 0.00000 0.01615 0.00000
12 8PZ 0.00000 -0.00102 0.00000 0.00000 0.00652
13 9PX 0.00000 0.00000 0.07482 0.00000 0.00000
14 9PY -0.01833 0.00000 0.00000 -0.07482 0.00000
15 9PZ 0.00000 0.08713 0.00000 0.00000 0.01149
16 10PX 0.00000 0.00000 1.51426 0.00000 0.00000
17 10PY 0.00324 0.00000 0.00000 -1.51426 0.00000
18 10PZ 0.00000 -2.36306 0.00000 0.00000 -0.23279
19 11PX 0.00000 0.00000 -0.03046 0.00000 0.00000
20 11PY -0.84482 0.00000 0.00000 0.03046 0.00000
21 11PZ 0.00000 -2.81873 0.00000 0.00000 0.70726
22 12D 0 0.00000 1.43612 0.00000 0.00000 -1.61403
23 12D+1 0.00000 0.00000 1.49364 0.00000 0.00000
24 12D-1 2.14469 0.00000 0.00000 -1.49364 0.00000
25 12D+2 -0.26375 0.00000 0.00000 1.20588 0.00000
26 12D-2 0.00000 0.00000 -1.20588 0.00000 0.00000
27 13D 0 0.00000 0.31016 0.00000 0.00000 0.14746
28 13D+1 0.00000 0.00000 0.13464 0.00000 0.00000
29 13D-1 -0.03493 0.00000 0.00000 -0.13464 0.00000
30 13D+2 -0.14661 0.00000 0.00000 0.14978 0.00000
31 13D-2 0.00000 0.00000 -0.14978 0.00000 0.00000
32 14D 0 0.00000 -0.00971 0.00000 0.00000 -0.04675
33 14D+1 0.00000 0.00000 -0.03282 0.00000 0.00000
34 14D-1 0.06893 0.00000 0.00000 0.03282 0.00000
35 14D+2 0.02899 0.00000 0.00000 -0.03975 0.00000
36 14D-2 0.00000 0.00000 0.03975 0.00000 0.00000
37 15F 0 0.00000 -0.00098 0.00000 0.00000 0.10090
38 15F+1 0.00000 0.00000 -0.24249 0.00000 0.00000
39 15F-1 -0.26676 0.00000 0.00000 0.24249 0.00000
40 15F+2 -0.17896 0.00000 0.00000 0.26715 0.00000
41 15F-2 0.00000 0.00000 -0.26715 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.32811 0.00000 0.00000 -0.26034
44 16F 0 0.00000 0.05641 0.00000 0.00000 -0.05021
45 16F+1 0.00000 0.00000 0.02150 0.00000 0.00000
46 16F-1 0.03685 0.00000 0.00000 -0.02150 0.00000
47 16F+2 0.00992 0.00000 0.00000 0.00218 0.00000
48 16F-2 0.00000 0.00000 -0.00218 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.05731 0.00000 0.00000 -0.00772
51 17G 0 0.00000 0.02360 0.00000 0.00000 -0.01482
52 17G+1 0.00000 0.00000 -0.01388 0.00000 0.00000
53 17G-1 0.01572 0.00000 0.00000 0.01388 0.00000
54 17G+2 -0.00290 0.00000 0.00000 0.01386 0.00000
55 17G-2 0.00000 0.00000 -0.01386 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.04054 0.00000 0.00000 -0.03573
58 17G+4 0.00850 0.00000 0.00000 -0.01597 0.00000
59 17G-4 0.00000 0.00000 -0.01597 0.00000 0.00000
60 2 Si 1S 0.00000 -0.02314 0.00000 0.00000 0.02334
61 2S 0.00000 0.05112 0.00000 0.00000 -0.07312
62 3S 0.00000 -0.14009 0.00000 0.00000 0.10561
63 4S 0.00000 -0.72527 0.00000 0.00000 -0.83679
64 5S 0.00000 2.40294 0.00000 0.00000 3.72160
65 6S 0.00000 -3.24195 0.00000 0.00000 -2.12169
66 7PX 0.00000 0.00000 0.09087 0.00000 0.00000
67 7PY -0.04544 0.00000 0.00000 -0.09087 0.00000
68 7PZ 0.00000 0.02813 0.00000 0.00000 0.05520
69 8PX 0.00000 0.00000 0.01615 0.00000 0.00000
70 8PY 0.01082 0.00000 0.00000 -0.01615 0.00000
71 8PZ 0.00000 -0.00102 0.00000 0.00000 -0.00652
72 9PX 0.00000 0.00000 -0.07482 0.00000 0.00000
73 9PY 0.01833 0.00000 0.00000 0.07482 0.00000
74 9PZ 0.00000 0.08713 0.00000 0.00000 -0.01149
75 10PX 0.00000 0.00000 -1.51426 0.00000 0.00000
76 10PY -0.00324 0.00000 0.00000 1.51426 0.00000
77 10PZ 0.00000 -2.36306 0.00000 0.00000 0.23279
78 11PX 0.00000 0.00000 0.03046 0.00000 0.00000
79 11PY 0.84482 0.00000 0.00000 -0.03046 0.00000
80 11PZ 0.00000 -2.81873 0.00000 0.00000 -0.70726
81 12D 0 0.00000 -1.43612 0.00000 0.00000 -1.61403
82 12D+1 0.00000 0.00000 1.49364 0.00000 0.00000
83 12D-1 2.14469 0.00000 0.00000 -1.49364 0.00000
84 12D+2 -0.26375 0.00000 0.00000 1.20588 0.00000
85 12D-2 0.00000 0.00000 -1.20588 0.00000 0.00000
86 13D 0 0.00000 -0.31016 0.00000 0.00000 0.14746
87 13D+1 0.00000 0.00000 0.13464 0.00000 0.00000
88 13D-1 -0.03493 0.00000 0.00000 -0.13464 0.00000
89 13D+2 -0.14661 0.00000 0.00000 0.14978 0.00000
90 13D-2 0.00000 0.00000 -0.14978 0.00000 0.00000
91 14D 0 0.00000 0.00971 0.00000 0.00000 -0.04675
92 14D+1 0.00000 0.00000 -0.03282 0.00000 0.00000
93 14D-1 0.06893 0.00000 0.00000 0.03282 0.00000
94 14D+2 0.02899 0.00000 0.00000 -0.03975 0.00000
95 14D-2 0.00000 0.00000 0.03975 0.00000 0.00000
96 15F 0 0.00000 -0.00098 0.00000 0.00000 -0.10090
97 15F+1 0.00000 0.00000 0.24249 0.00000 0.00000
98 15F-1 0.26676 0.00000 0.00000 -0.24249 0.00000
99 15F+2 0.17896 0.00000 0.00000 -0.26715 0.00000
100 15F-2 0.00000 0.00000 0.26715 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.32811 0.00000 0.00000 0.26034
103 16F 0 0.00000 0.05641 0.00000 0.00000 0.05021
104 16F+1 0.00000 0.00000 -0.02150 0.00000 0.00000
105 16F-1 -0.03685 0.00000 0.00000 0.02150 0.00000
106 16F+2 -0.00992 0.00000 0.00000 -0.00218 0.00000
107 16F-2 0.00000 0.00000 0.00218 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.05731 0.00000 0.00000 0.00772
110 17G 0 0.00000 -0.02360 0.00000 0.00000 -0.01482
111 17G+1 0.00000 0.00000 -0.01388 0.00000 0.00000
112 17G-1 0.01572 0.00000 0.00000 0.01388 0.00000
113 17G+2 -0.00290 0.00000 0.00000 0.01386 0.00000
114 17G-2 0.00000 0.00000 -0.01386 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 -0.04054 0.00000 0.00000 -0.03573
117 17G+4 0.00850 0.00000 0.00000 -0.01597 0.00000
118 17G-4 0.00000 0.00000 -0.01597 0.00000 0.00000
119 3 H 1S 0.00308 -0.03388 0.00000 0.03854 -0.02371
120 2S 0.06268 -0.06657 0.00000 -0.06884 0.01933
121 3S -0.70233 0.22783 0.00000 2.19095 -1.07180
122 4S -0.30097 1.43056 0.00000 0.34394 0.75980
123 5PX 0.00000 0.00000 0.01061 0.00000 0.00000
124 5PY 0.00057 -0.00523 0.00000 0.00944 -0.01744
125 5PZ 0.00150 -0.00082 0.00000 0.01499 0.00032
126 6PX 0.00000 0.00000 -0.03924 0.00000 0.00000
127 6PY -0.01131 0.02086 0.00000 -0.04151 0.07279
128 6PZ 0.01973 0.00558 0.00000 -0.06208 -0.00787
129 7PX 0.00000 0.00000 0.26124 0.00000 0.00000
130 7PY 0.17282 -0.50187 0.00000 -0.28912 -0.11994
131 7PZ 0.04879 -0.17893 0.00000 0.13988 0.17316
132 8D 0 -0.00239 0.00211 0.00000 0.00126 0.00268
133 8D+1 0.00000 0.00000 -0.00068 0.00000 0.00000
134 8D-1 0.00066 -0.00273 0.00000 0.00106 0.00061
135 8D+2 0.00139 0.00420 0.00000 -0.00115 0.00033
136 8D-2 0.00000 0.00000 0.00236 0.00000 0.00000
137 9D 0 0.00887 -0.01868 0.00000 -0.01785 -0.01145
138 9D+1 0.00000 0.00000 0.00638 0.00000 0.00000
139 9D-1 -0.01033 0.02388 0.00000 0.00411 -0.00677
140 9D+2 -0.00668 -0.04008 0.00000 -0.01221 0.01207
141 9D-2 0.00000 0.00000 -0.01770 0.00000 0.00000
142 10F 0 -0.00072 0.00036 0.00000 0.00050 0.00094
143 10F+1 0.00000 0.00000 -0.00062 0.00000 0.00000
144 10F-1 0.00171 0.00095 0.00000 0.00193 -0.00108
145 10F+2 -0.00073 0.00101 0.00000 -0.00157 0.00096
146 10F-2 0.00000 0.00000 -0.00110 0.00000 0.00000
147 10F+3 0.00000 0.00000 -0.00079 0.00000 0.00000
148 10F-3 -0.00080 0.00207 0.00000 0.00142 -0.00255
149 4 H 1S -0.00154 -0.03388 0.03338 -0.01927 -0.02371
150 2S -0.03134 -0.06657 -0.05961 0.03442 0.01933
151 3S 0.35116 0.22783 1.89742 -1.09547 -1.07180
152 4S 0.15049 1.43056 0.29786 -0.17197 0.75980
153 5PX 0.00121 0.00453 -0.00443 0.00868 0.01510
154 5PY -0.00154 0.00262 -0.00868 -0.00560 0.00872
155 5PZ -0.00075 -0.00082 0.01298 -0.00750 0.00032
156 6PX -0.01004 -0.01806 0.02132 -0.03497 -0.06304
157 6PY 0.00607 -0.01043 0.03497 0.01906 -0.03640
158 6PZ -0.00986 0.00558 -0.05376 0.03104 -0.00787
159 7PX 0.08043 0.43463 0.28215 -0.01207 0.10387
160 7PY 0.03352 0.25093 0.01207 -0.26821 0.05997
161 7PZ -0.02439 -0.17893 0.12114 -0.06994 0.17316
162 8D 0 0.00120 0.00211 0.00110 -0.00063 0.00268
163 8D+1 -0.00003 0.00236 -0.00097 0.00016 -0.00053
164 8D-1 0.00071 0.00137 -0.00016 0.00078 -0.00031
165 8D+2 0.00101 -0.00210 -0.00053 -0.00206 -0.00016
166 8D-2 0.00022 -0.00364 0.00145 0.00053 -0.00028
167 9D 0 -0.00444 -0.01868 -0.01546 0.00892 -0.01145
168 9D+1 -0.00441 -0.02068 -0.00149 0.00454 0.00586
169 9D-1 -0.00270 -0.01194 -0.00454 -0.00376 0.00339
170 9D+2 -0.00909 0.02004 0.01295 0.01022 -0.00604
171 9D-2 0.00139 0.03471 0.00473 -0.01295 -0.01046
172 10F 0 0.00036 0.00036 0.00043 -0.00025 0.00094
173 10F+1 0.00086 -0.00083 -0.00160 0.00057 0.00094
174 10F-1 0.00021 -0.00048 -0.00057 0.00094 0.00054
175 10F+2 -0.00079 -0.00050 0.00115 0.00043 -0.00048
176 10F-2 0.00004 -0.00087 0.00090 -0.00115 -0.00083
177 10F+3 -0.00137 0.00000 0.00039 0.00068 0.00000
178 10F-3 0.00040 0.00207 0.00123 -0.00071 -0.00255
179 5 H 1S -0.00154 -0.03388 -0.03338 -0.01927 -0.02371
180 2S -0.03134 -0.06657 0.05961 0.03442 0.01933
181 3S 0.35116 0.22783 -1.89742 -1.09547 -1.07180
182 4S 0.15049 1.43056 -0.29786 -0.17197 0.75980
183 5PX -0.00121 -0.00453 -0.00443 -0.00868 -0.01510
184 5PY -0.00154 0.00262 0.00868 -0.00560 0.00872
185 5PZ -0.00075 -0.00082 -0.01298 -0.00750 0.00032
186 6PX 0.01004 0.01806 0.02132 0.03497 0.06304
187 6PY 0.00607 -0.01043 -0.03497 0.01906 -0.03640
188 6PZ -0.00986 0.00558 0.05376 0.03104 -0.00787
189 7PX -0.08043 -0.43463 0.28215 0.01207 -0.10387
190 7PY 0.03352 0.25093 -0.01207 -0.26821 0.05997
191 7PZ -0.02439 -0.17893 -0.12114 -0.06994 0.17316
192 8D 0 0.00120 0.00211 -0.00110 -0.00063 0.00268
193 8D+1 0.00003 -0.00236 -0.00097 -0.00016 0.00053
194 8D-1 0.00071 0.00137 0.00016 0.00078 -0.00031
195 8D+2 0.00101 -0.00210 0.00053 -0.00206 -0.00016
196 8D-2 -0.00022 0.00364 0.00145 -0.00053 0.00028
197 9D 0 -0.00444 -0.01868 0.01546 0.00892 -0.01145
198 9D+1 0.00441 0.02068 -0.00149 -0.00454 -0.00586
199 9D-1 -0.00270 -0.01194 0.00454 -0.00376 0.00339
200 9D+2 -0.00909 0.02004 -0.01295 0.01022 -0.00604
201 9D-2 -0.00139 -0.03471 0.00473 0.01295 0.01046
202 10F 0 0.00036 0.00036 -0.00043 -0.00025 0.00094
203 10F+1 -0.00086 0.00083 -0.00160 -0.00057 -0.00094
204 10F-1 0.00021 -0.00048 0.00057 0.00094 0.00054
205 10F+2 -0.00079 -0.00050 -0.00115 0.00043 -0.00048
206 10F-2 -0.00004 0.00087 0.00090 0.00115 0.00083
207 10F+3 0.00137 0.00000 0.00039 -0.00068 0.00000
208 10F-3 0.00040 0.00207 -0.00123 -0.00071 -0.00255
209 6 H 1S 0.00308 0.03388 0.00000 0.03854 -0.02371
210 2S 0.06268 0.06657 0.00000 -0.06884 0.01933
211 3S -0.70233 -0.22783 0.00000 2.19095 -1.07180
212 4S -0.30097 -1.43056 0.00000 0.34394 0.75980
213 5PX 0.00000 0.00000 -0.01061 0.00000 0.00000
214 5PY -0.00057 -0.00523 0.00000 -0.00944 0.01744
215 5PZ -0.00150 -0.00082 0.00000 -0.01499 -0.00032
216 6PX 0.00000 0.00000 0.03924 0.00000 0.00000
217 6PY 0.01131 0.02086 0.00000 0.04151 -0.07279
218 6PZ -0.01973 0.00558 0.00000 0.06208 0.00787
219 7PX 0.00000 0.00000 -0.26124 0.00000 0.00000
220 7PY -0.17282 -0.50187 0.00000 0.28912 0.11994
221 7PZ -0.04879 -0.17893 0.00000 -0.13988 -0.17316
222 8D 0 -0.00239 -0.00211 0.00000 0.00126 0.00268
223 8D+1 0.00000 0.00000 -0.00068 0.00000 0.00000
224 8D-1 0.00066 0.00273 0.00000 0.00106 0.00061
225 8D+2 0.00139 -0.00420 0.00000 -0.00115 0.00033
226 8D-2 0.00000 0.00000 0.00236 0.00000 0.00000
227 9D 0 0.00887 0.01868 0.00000 -0.01785 -0.01145
228 9D+1 0.00000 0.00000 0.00638 0.00000 0.00000
229 9D-1 -0.01033 -0.02388 0.00000 0.00411 -0.00677
230 9D+2 -0.00668 0.04008 0.00000 -0.01221 0.01207
231 9D-2 0.00000 0.00000 -0.01770 0.00000 0.00000
232 10F 0 0.00072 0.00036 0.00000 -0.00050 -0.00094
233 10F+1 0.00000 0.00000 0.00062 0.00000 0.00000
234 10F-1 -0.00171 0.00095 0.00000 -0.00193 0.00108
235 10F+2 0.00073 0.00101 0.00000 0.00157 -0.00096
236 10F-2 0.00000 0.00000 0.00110 0.00000 0.00000
237 10F+3 0.00000 0.00000 0.00079 0.00000 0.00000
238 10F-3 0.00080 0.00207 0.00000 -0.00142 0.00255
239 7 H 1S -0.00154 0.03388 -0.03338 -0.01927 -0.02371
240 2S -0.03134 0.06657 0.05961 0.03442 0.01933
241 3S 0.35116 -0.22783 -1.89742 -1.09547 -1.07180
242 4S 0.15049 -1.43056 -0.29786 -0.17197 0.75980
243 5PX 0.00121 -0.00453 0.00443 0.00868 0.01510
244 5PY 0.00154 0.00262 -0.00868 0.00560 -0.00872
245 5PZ 0.00075 -0.00082 0.01298 0.00750 -0.00032
246 6PX -0.01004 0.01806 -0.02132 -0.03497 -0.06304
247 6PY -0.00607 -0.01043 0.03497 -0.01906 0.03640
248 6PZ 0.00986 0.00558 -0.05376 -0.03104 0.00787
249 7PX 0.08043 -0.43463 -0.28215 -0.01207 0.10387
250 7PY -0.03352 0.25093 0.01207 0.26821 -0.05997
251 7PZ 0.02439 -0.17893 0.12114 0.06994 -0.17316
252 8D 0 0.00120 -0.00211 -0.00110 -0.00063 0.00268
253 8D+1 0.00003 0.00236 -0.00097 -0.00016 0.00053
254 8D-1 0.00071 -0.00137 0.00016 0.00078 -0.00031
255 8D+2 0.00101 0.00210 0.00053 -0.00206 -0.00016
256 8D-2 -0.00022 -0.00364 0.00145 -0.00053 0.00028
257 9D 0 -0.00444 0.01868 0.01546 0.00892 -0.01145
258 9D+1 0.00441 -0.02068 -0.00149 -0.00454 -0.00586
259 9D-1 -0.00270 0.01194 0.00454 -0.00376 0.00339
260 9D+2 -0.00909 -0.02004 -0.01295 0.01022 -0.00604
261 9D-2 -0.00139 0.03471 0.00473 0.01295 0.01046
262 10F 0 -0.00036 0.00036 0.00043 0.00025 -0.00094
263 10F+1 0.00086 0.00083 0.00160 0.00057 0.00094
264 10F-1 -0.00021 -0.00048 -0.00057 -0.00094 -0.00054
265 10F+2 0.00079 -0.00050 0.00115 -0.00043 0.00048
266 10F-2 0.00004 0.00087 -0.00090 -0.00115 -0.00083
267 10F+3 -0.00137 0.00000 -0.00039 0.00068 0.00000
268 10F-3 -0.00040 0.00207 0.00123 0.00071 0.00255
269 8 H 1S -0.00154 0.03388 0.03338 -0.01927 -0.02371
270 2S -0.03134 0.06657 -0.05961 0.03442 0.01933
271 3S 0.35116 -0.22783 1.89742 -1.09547 -1.07180
272 4S 0.15049 -1.43056 0.29786 -0.17197 0.75980
273 5PX -0.00121 0.00453 0.00443 -0.00868 -0.01510
274 5PY 0.00154 0.00262 0.00868 0.00560 -0.00872
275 5PZ 0.00075 -0.00082 -0.01298 0.00750 -0.00032
276 6PX 0.01004 -0.01806 -0.02132 0.03497 0.06304
277 6PY -0.00607 -0.01043 -0.03497 -0.01906 0.03640
278 6PZ 0.00986 0.00558 0.05376 -0.03104 0.00787
279 7PX -0.08043 0.43463 -0.28215 0.01207 -0.10387
280 7PY -0.03352 0.25093 -0.01207 0.26821 -0.05997
281 7PZ 0.02439 -0.17893 -0.12114 0.06994 -0.17316
282 8D 0 0.00120 -0.00211 0.00110 -0.00063 0.00268
283 8D+1 -0.00003 -0.00236 -0.00097 0.00016 -0.00053
284 8D-1 0.00071 -0.00137 -0.00016 0.00078 -0.00031
285 8D+2 0.00101 0.00210 -0.00053 -0.00206 -0.00016
286 8D-2 0.00022 0.00364 0.00145 0.00053 -0.00028
287 9D 0 -0.00444 0.01868 -0.01546 0.00892 -0.01145
288 9D+1 -0.00441 0.02068 -0.00149 0.00454 0.00586
289 9D-1 -0.00270 0.01194 -0.00454 -0.00376 0.00339
290 9D+2 -0.00909 -0.02004 0.01295 0.01022 -0.00604
291 9D-2 0.00139 -0.03471 0.00473 -0.01295 -0.01046
292 10F 0 -0.00036 0.00036 -0.00043 0.00025 -0.00094
293 10F+1 -0.00086 -0.00083 0.00160 -0.00057 -0.00094
294 10F-1 -0.00021 -0.00048 0.00057 -0.00094 -0.00054
295 10F+2 0.00079 -0.00050 -0.00115 -0.00043 0.00048
296 10F-2 -0.00004 -0.00087 -0.00090 0.00115 0.00083
297 10F+3 0.00137 0.00000 -0.00039 -0.00068 0.00000
298 10F-3 -0.00040 0.00207 -0.00123 0.00071 0.00255
46 47 48 49 50
(A2U)--V (EU)--V (EU)--V (A1U)--V (A1G)--V
Eigenvalues -- 0.56176 0.64156 0.64156 0.65427 0.67973
1 1 Si 1S -0.00592 0.00000 0.00000 0.00000 -0.01100
2 2S -0.02111 0.00000 0.00000 0.00000 0.00064
3 3S -0.08123 0.00000 0.00000 0.00000 -0.12107
4 4S -0.39309 0.00000 0.00000 0.00000 -3.34096
5 5S -0.30225 0.00000 0.00000 0.00000 9.55408
6 6S 8.80127 0.00000 0.00000 0.00000 4.33580
7 7PX 0.00000 0.00000 -0.07711 0.00000 0.00000
8 7PY 0.00000 -0.07711 0.00000 0.00000 0.00000
9 7PZ 0.09236 0.00000 0.00000 0.00000 0.04451
10 8PX 0.00000 0.00000 -0.02105 0.00000 0.00000
11 8PY 0.00000 -0.02105 0.00000 0.00000 0.00000
12 8PZ -0.03763 0.00000 0.00000 0.00000 -0.00251
13 9PX 0.00000 0.00000 -0.02035 0.00000 0.00000
14 9PY 0.00000 -0.02035 0.00000 0.00000 0.00000
15 9PZ 0.33247 0.00000 0.00000 0.00000 -0.23411
16 10PX 0.00000 0.00000 3.42539 0.00000 0.00000
17 10PY 0.00000 3.42539 0.00000 0.00000 0.00000
18 10PZ -5.13137 0.00000 0.00000 0.00000 3.02354
19 11PX 0.00000 0.00000 1.36568 0.00000 0.00000
20 11PY 0.00000 1.36568 0.00000 0.00000 0.00000
21 11PZ -3.03193 0.00000 0.00000 0.00000 0.70699
22 12D 0 3.34990 0.00000 0.00000 0.00000 -2.18066
23 12D+1 0.00000 0.00000 1.74979 0.00000 0.00000
24 12D-1 0.00000 1.74979 0.00000 0.00000 0.00000
25 12D+2 0.00000 -2.32964 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 -2.32964 0.00000 0.00000
27 13D 0 0.28390 0.00000 0.00000 0.00000 -0.45299
28 13D+1 0.00000 0.00000 -0.03209 0.00000 0.00000
29 13D-1 0.00000 -0.03209 0.00000 0.00000 0.00000
30 13D+2 0.00000 -0.43397 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 -0.43397 0.00000 0.00000
32 14D 0 -0.07080 0.00000 0.00000 0.00000 0.12063
33 14D+1 0.00000 0.00000 -0.02035 0.00000 0.00000
34 14D-1 0.00000 -0.02035 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.01617 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.01617 0.00000 0.00000
37 15F 0 -0.38952 0.00000 0.00000 0.00000 -0.83788
38 15F+1 0.00000 0.00000 0.06232 0.00000 0.00000
39 15F-1 0.00000 0.06232 0.00000 0.00000 0.00000
40 15F+2 0.00000 -0.56864 0.00000 0.00000 0.00000
41 15F-2 0.00000 0.00000 -0.56864 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.39906 0.00000
43 15F-3 0.17791 0.00000 0.00000 0.00000 -1.42199
44 16F 0 0.02948 0.00000 0.00000 0.00000 -0.12856
45 16F+1 0.00000 0.00000 -0.01168 0.00000 0.00000
46 16F-1 0.00000 -0.01168 0.00000 0.00000 0.00000
47 16F+2 0.00000 -0.01053 0.00000 0.00000 0.00000
48 16F-2 0.00000 0.00000 -0.01053 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 -0.03775 0.00000
50 16F-3 0.02554 0.00000 0.00000 0.00000 -0.16929
51 17G 0 0.05503 0.00000 0.00000 0.00000 -0.00216
52 17G+1 0.00000 0.00000 -0.04048 0.00000 0.00000
53 17G-1 0.00000 -0.04048 0.00000 0.00000 0.00000
54 17G+2 0.00000 0.00708 0.00000 0.00000 0.00000
55 17G-2 0.00000 0.00000 0.00708 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.01073 0.00000
57 17G-3 0.03605 0.00000 0.00000 0.00000 -0.17512
58 17G+4 0.00000 0.04312 0.00000 0.00000 0.00000
59 17G-4 0.00000 0.00000 -0.04312 0.00000 0.00000
60 2 Si 1S 0.00592 0.00000 0.00000 0.00000 -0.01100
61 2S 0.02111 0.00000 0.00000 0.00000 0.00064
62 3S 0.08123 0.00000 0.00000 0.00000 -0.12107
63 4S 0.39309 0.00000 0.00000 0.00000 -3.34096
64 5S 0.30225 0.00000 0.00000 0.00000 9.55408
65 6S -8.80127 0.00000 0.00000 0.00000 4.33580
66 7PX 0.00000 0.00000 -0.07711 0.00000 0.00000
67 7PY 0.00000 -0.07711 0.00000 0.00000 0.00000
68 7PZ 0.09236 0.00000 0.00000 0.00000 -0.04451
69 8PX 0.00000 0.00000 -0.02105 0.00000 0.00000
70 8PY 0.00000 -0.02105 0.00000 0.00000 0.00000
71 8PZ -0.03763 0.00000 0.00000 0.00000 0.00251
72 9PX 0.00000 0.00000 -0.02035 0.00000 0.00000
73 9PY 0.00000 -0.02035 0.00000 0.00000 0.00000
74 9PZ 0.33247 0.00000 0.00000 0.00000 0.23411
75 10PX 0.00000 0.00000 3.42539 0.00000 0.00000
76 10PY 0.00000 3.42539 0.00000 0.00000 0.00000
77 10PZ -5.13137 0.00000 0.00000 0.00000 -3.02354
78 11PX 0.00000 0.00000 1.36568 0.00000 0.00000
79 11PY 0.00000 1.36568 0.00000 0.00000 0.00000
80 11PZ -3.03193 0.00000 0.00000 0.00000 -0.70699
81 12D 0 -3.34990 0.00000 0.00000 0.00000 -2.18066
82 12D+1 0.00000 0.00000 -1.74979 0.00000 0.00000
83 12D-1 0.00000 -1.74979 0.00000 0.00000 0.00000
84 12D+2 0.00000 2.32964 0.00000 0.00000 0.00000
85 12D-2 0.00000 0.00000 2.32964 0.00000 0.00000
86 13D 0 -0.28390 0.00000 0.00000 0.00000 -0.45299
87 13D+1 0.00000 0.00000 0.03209 0.00000 0.00000
88 13D-1 0.00000 0.03209 0.00000 0.00000 0.00000
89 13D+2 0.00000 0.43397 0.00000 0.00000 0.00000
90 13D-2 0.00000 0.00000 0.43397 0.00000 0.00000
91 14D 0 0.07080 0.00000 0.00000 0.00000 0.12063
92 14D+1 0.00000 0.00000 0.02035 0.00000 0.00000
93 14D-1 0.00000 0.02035 0.00000 0.00000 0.00000
94 14D+2 0.00000 -0.01617 0.00000 0.00000 0.00000
95 14D-2 0.00000 0.00000 -0.01617 0.00000 0.00000
96 15F 0 -0.38952 0.00000 0.00000 0.00000 0.83788
97 15F+1 0.00000 0.00000 0.06232 0.00000 0.00000
98 15F-1 0.00000 0.06232 0.00000 0.00000 0.00000
99 15F+2 0.00000 -0.56864 0.00000 0.00000 0.00000
100 15F-2 0.00000 0.00000 -0.56864 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.39906 0.00000
102 15F-3 0.17791 0.00000 0.00000 0.00000 1.42199
103 16F 0 0.02948 0.00000 0.00000 0.00000 0.12856
104 16F+1 0.00000 0.00000 -0.01168 0.00000 0.00000
105 16F-1 0.00000 -0.01168 0.00000 0.00000 0.00000
106 16F+2 0.00000 -0.01053 0.00000 0.00000 0.00000
107 16F-2 0.00000 0.00000 -0.01053 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 -0.03775 0.00000
109 16F-3 0.02554 0.00000 0.00000 0.00000 0.16929
110 17G 0 -0.05503 0.00000 0.00000 0.00000 -0.00216
111 17G+1 0.00000 0.00000 0.04048 0.00000 0.00000
112 17G-1 0.00000 0.04048 0.00000 0.00000 0.00000
113 17G+2 0.00000 -0.00708 0.00000 0.00000 0.00000
114 17G-2 0.00000 0.00000 -0.00708 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 -0.01073 0.00000
116 17G-3 -0.03605 0.00000 0.00000 0.00000 -0.17512
117 17G+4 0.00000 -0.04312 0.00000 0.00000 0.00000
118 17G-4 0.00000 0.00000 0.04312 0.00000 0.00000
119 3 H 1S 0.01031 -0.03366 0.00000 0.00000 -0.00011
120 2S -0.04899 0.17573 0.00000 0.00000 0.15450
121 3S 0.83585 -3.33721 0.00000 0.00000 -3.62589
122 4S -0.14128 -1.98079 0.00000 0.00000 -1.74672
123 5PX 0.00000 0.00000 -0.00407 -0.02313 0.00000
124 5PY 0.00981 -0.01333 0.00000 0.00000 -0.01188
125 5PZ -0.00729 -0.00141 0.00000 0.00000 0.00947
126 6PX 0.00000 0.00000 0.00296 0.07889 0.00000
127 6PY -0.03951 0.05218 0.00000 0.00000 0.06641
128 6PZ 0.03125 0.01338 0.00000 0.00000 -0.03091
129 7PX 0.00000 0.00000 0.05759 -0.26775 0.00000
130 7PY -0.03802 0.62961 0.00000 0.00000 1.36867
131 7PZ -0.24073 0.19886 0.00000 0.00000 0.89814
132 8D 0 -0.00025 -0.00214 0.00000 0.00000 -0.00137
133 8D+1 0.00000 0.00000 -0.00003 0.00127 0.00000
134 8D-1 -0.00001 -0.00142 0.00000 0.00000 0.00687
135 8D+2 0.00054 -0.00105 0.00000 0.00000 -0.00922
136 8D-2 0.00000 0.00000 0.00300 0.00422 0.00000
137 9D 0 -0.00123 0.02351 0.00000 0.00000 0.03217
138 9D+1 0.00000 0.00000 0.00500 -0.00729 0.00000
139 9D-1 0.00460 -0.01606 0.00000 0.00000 -0.08681
140 9D+2 -0.01561 0.03431 0.00000 0.00000 0.11853
141 9D-2 0.00000 0.00000 -0.01757 -0.02516 0.00000
142 10F 0 -0.00008 -0.00300 0.00000 0.00000 -0.00209
143 10F+1 0.00000 0.00000 -0.00097 0.00032 0.00000
144 10F-1 0.00069 0.00339 0.00000 0.00000 -0.00222
145 10F+2 -0.00027 -0.00307 0.00000 0.00000 -0.00568
146 10F-2 0.00000 0.00000 -0.00172 -0.00150 0.00000
147 10F+3 0.00000 0.00000 0.00050 0.00278 0.00000
148 10F-3 0.00180 -0.00133 0.00000 0.00000 -0.00634
149 4 H 1S 0.01031 0.01683 0.02915 0.00000 -0.00011
150 2S -0.04899 -0.08787 -0.15219 0.00000 0.15450
151 3S 0.83585 1.66861 2.89011 0.00000 -3.62589
152 4S -0.14128 0.99039 1.71541 0.00000 -1.74672
153 5PX -0.00850 -0.00401 -0.01101 0.01156 0.01029
154 5PY -0.00491 -0.00638 -0.00401 -0.02003 0.00594
155 5PZ -0.00729 0.00070 0.00122 0.00000 0.00947
156 6PX 0.03421 0.02131 0.03988 -0.03945 -0.05752
157 6PY 0.01975 0.01526 0.02131 0.06832 -0.03321
158 6PZ 0.03125 -0.00669 -0.01159 0.00000 -0.03091
159 7PX 0.03292 0.24769 0.48661 0.13388 -1.18530
160 7PY 0.01901 0.20060 0.24769 -0.23188 -0.68433
161 7PZ -0.24073 -0.09943 -0.17222 0.00000 0.89814
162 8D 0 -0.00025 0.00107 0.00186 0.00000 -0.00137
163 8D+1 0.00000 -0.00060 -0.00107 -0.00063 -0.00595
164 8D-1 0.00000 -0.00038 -0.00060 0.00110 -0.00343
165 8D+2 -0.00027 0.00199 -0.00176 0.00365 0.00461
166 8D-2 -0.00047 -0.00176 -0.00004 -0.00211 0.00798
167 9D 0 -0.00123 -0.01175 -0.02036 0.00000 0.03217
168 9D+1 -0.00398 -0.00912 -0.01080 0.00364 0.07518
169 9D-1 -0.00230 -0.00027 -0.00912 -0.00631 0.04340
170 9D+2 0.00780 -0.00460 0.02246 -0.02179 -0.05926
171 9D-2 0.01352 0.02246 0.02134 0.01258 -0.10265
172 10F 0 -0.00008 0.00150 0.00259 0.00000 -0.00209
173 10F+1 -0.00060 0.00189 0.00230 -0.00016 0.00192
174 10F-1 -0.00035 0.00012 0.00189 0.00028 0.00111
175 10F+2 0.00014 -0.00206 -0.00059 -0.00130 0.00284
176 10F-2 0.00024 -0.00059 -0.00274 0.00075 0.00492
177 10F+3 0.00000 0.00043 -0.00025 0.00278 0.00000
178 10F-3 0.00180 0.00067 0.00115 0.00000 -0.00634
179 5 H 1S 0.01031 0.01683 -0.02915 0.00000 -0.00011
180 2S -0.04899 -0.08787 0.15219 0.00000 0.15450
181 3S 0.83585 1.66861 -2.89011 0.00000 -3.62589
182 4S -0.14128 0.99039 -1.71541 0.00000 -1.74672
183 5PX 0.00850 0.00401 -0.01101 0.01156 -0.01029
184 5PY -0.00491 -0.00638 0.00401 0.02003 0.00594
185 5PZ -0.00729 0.00070 -0.00122 0.00000 0.00947
186 6PX -0.03421 -0.02131 0.03988 -0.03945 0.05752
187 6PY 0.01975 0.01526 -0.02131 -0.06832 -0.03321
188 6PZ 0.03125 -0.00669 0.01159 0.00000 -0.03091
189 7PX -0.03292 -0.24769 0.48661 0.13388 1.18530
190 7PY 0.01901 0.20060 -0.24769 0.23188 -0.68433
191 7PZ -0.24073 -0.09943 0.17222 0.00000 0.89814
192 8D 0 -0.00025 0.00107 -0.00186 0.00000 -0.00137
193 8D+1 0.00000 0.00060 -0.00107 -0.00063 0.00595
194 8D-1 0.00000 -0.00038 0.00060 -0.00110 -0.00343
195 8D+2 -0.00027 0.00199 0.00176 -0.00365 0.00461
196 8D-2 0.00047 0.00176 -0.00004 -0.00211 -0.00798
197 9D 0 -0.00123 -0.01175 0.02036 0.00000 0.03217
198 9D+1 0.00398 0.00912 -0.01080 0.00364 -0.07518
199 9D-1 -0.00230 -0.00027 0.00912 0.00631 0.04340
200 9D+2 0.00780 -0.00460 -0.02246 0.02179 -0.05926
201 9D-2 -0.01352 -0.02246 0.02134 0.01258 0.10265
202 10F 0 -0.00008 0.00150 -0.00259 0.00000 -0.00209
203 10F+1 0.00060 -0.00189 0.00230 -0.00016 -0.00192
204 10F-1 -0.00035 0.00012 -0.00189 -0.00028 0.00111
205 10F+2 0.00014 -0.00206 0.00059 0.00130 0.00284
206 10F-2 -0.00024 0.00059 -0.00274 0.00075 -0.00492
207 10F+3 0.00000 -0.00043 -0.00025 0.00278 0.00000
208 10F-3 0.00180 0.00067 -0.00115 0.00000 -0.00634
209 6 H 1S -0.01031 0.03366 0.00000 0.00000 -0.00011
210 2S 0.04899 -0.17573 0.00000 0.00000 0.15450
211 3S -0.83585 3.33721 0.00000 0.00000 -3.62589
212 4S 0.14128 1.98079 0.00000 0.00000 -1.74672
213 5PX 0.00000 0.00000 -0.00407 -0.02313 0.00000
214 5PY 0.00981 -0.01333 0.00000 0.00000 0.01188
215 5PZ -0.00729 -0.00141 0.00000 0.00000 -0.00947
216 6PX 0.00000 0.00000 0.00296 0.07889 0.00000
217 6PY -0.03951 0.05218 0.00000 0.00000 -0.06641
218 6PZ 0.03125 0.01338 0.00000 0.00000 0.03091
219 7PX 0.00000 0.00000 0.05759 -0.26775 0.00000
220 7PY -0.03802 0.62961 0.00000 0.00000 -1.36867
221 7PZ -0.24073 0.19886 0.00000 0.00000 -0.89814
222 8D 0 0.00025 0.00214 0.00000 0.00000 -0.00137
223 8D+1 0.00000 0.00000 0.00003 -0.00127 0.00000
224 8D-1 0.00001 0.00142 0.00000 0.00000 0.00687
225 8D+2 -0.00054 0.00105 0.00000 0.00000 -0.00922
226 8D-2 0.00000 0.00000 -0.00300 -0.00422 0.00000
227 9D 0 0.00123 -0.02351 0.00000 0.00000 0.03217
228 9D+1 0.00000 0.00000 -0.00500 0.00729 0.00000
229 9D-1 -0.00460 0.01606 0.00000 0.00000 -0.08681
230 9D+2 0.01561 -0.03431 0.00000 0.00000 0.11853
231 9D-2 0.00000 0.00000 0.01757 0.02516 0.00000
232 10F 0 -0.00008 -0.00300 0.00000 0.00000 0.00209
233 10F+1 0.00000 0.00000 -0.00097 0.00032 0.00000
234 10F-1 0.00069 0.00339 0.00000 0.00000 0.00222
235 10F+2 -0.00027 -0.00307 0.00000 0.00000 0.00568
236 10F-2 0.00000 0.00000 -0.00172 -0.00150 0.00000
237 10F+3 0.00000 0.00000 0.00050 0.00278 0.00000
238 10F-3 0.00180 -0.00133 0.00000 0.00000 0.00634
239 7 H 1S -0.01031 -0.01683 0.02915 0.00000 -0.00011
240 2S 0.04899 0.08787 -0.15219 0.00000 0.15450
241 3S -0.83585 -1.66861 2.89011 0.00000 -3.62589
242 4S 0.14128 -0.99039 1.71541 0.00000 -1.74672
243 5PX 0.00850 0.00401 -0.01101 0.01156 0.01029
244 5PY -0.00491 -0.00638 0.00401 0.02003 -0.00594
245 5PZ -0.00729 0.00070 -0.00122 0.00000 -0.00947
246 6PX -0.03421 -0.02131 0.03988 -0.03945 -0.05752
247 6PY 0.01975 0.01526 -0.02131 -0.06832 0.03321
248 6PZ 0.03125 -0.00669 0.01159 0.00000 0.03091
249 7PX -0.03292 -0.24769 0.48661 0.13388 -1.18530
250 7PY 0.01901 0.20060 -0.24769 0.23188 0.68433
251 7PZ -0.24073 -0.09943 0.17222 0.00000 -0.89814
252 8D 0 0.00025 -0.00107 0.00186 0.00000 -0.00137
253 8D+1 0.00000 -0.00060 0.00107 0.00063 0.00595
254 8D-1 0.00000 0.00038 -0.00060 0.00110 -0.00343
255 8D+2 0.00027 -0.00199 -0.00176 0.00365 0.00461
256 8D-2 -0.00047 -0.00176 0.00004 0.00211 -0.00798
257 9D 0 0.00123 0.01175 -0.02036 0.00000 0.03217
258 9D+1 -0.00398 -0.00912 0.01080 -0.00364 -0.07518
259 9D-1 0.00230 0.00027 -0.00912 -0.00631 0.04340
260 9D+2 -0.00780 0.00460 0.02246 -0.02179 -0.05926
261 9D-2 0.01352 0.02246 -0.02134 -0.01258 0.10265
262 10F 0 -0.00008 0.00150 -0.00259 0.00000 0.00209
263 10F+1 0.00060 -0.00189 0.00230 -0.00016 0.00192
264 10F-1 -0.00035 0.00012 -0.00189 -0.00028 -0.00111
265 10F+2 0.00014 -0.00206 0.00059 0.00130 -0.00284
266 10F-2 -0.00024 0.00059 -0.00274 0.00075 0.00492
267 10F+3 0.00000 -0.00043 -0.00025 0.00278 0.00000
268 10F-3 0.00180 0.00067 -0.00115 0.00000 0.00634
269 8 H 1S -0.01031 -0.01683 -0.02915 0.00000 -0.00011
270 2S 0.04899 0.08787 0.15219 0.00000 0.15450
271 3S -0.83585 -1.66861 -2.89011 0.00000 -3.62589
272 4S 0.14128 -0.99039 -1.71541 0.00000 -1.74672
273 5PX -0.00850 -0.00401 -0.01101 0.01156 -0.01029
274 5PY -0.00491 -0.00638 -0.00401 -0.02003 -0.00594
275 5PZ -0.00729 0.00070 0.00122 0.00000 -0.00947
276 6PX 0.03421 0.02131 0.03988 -0.03945 0.05752
277 6PY 0.01975 0.01526 0.02131 0.06832 0.03321
278 6PZ 0.03125 -0.00669 -0.01159 0.00000 0.03091
279 7PX 0.03292 0.24769 0.48661 0.13388 1.18530
280 7PY 0.01901 0.20060 0.24769 -0.23188 0.68433
281 7PZ -0.24073 -0.09943 -0.17222 0.00000 -0.89814
282 8D 0 0.00025 -0.00107 -0.00186 0.00000 -0.00137
283 8D+1 0.00000 0.00060 0.00107 0.00063 -0.00595
284 8D-1 0.00000 0.00038 0.00060 -0.00110 -0.00343
285 8D+2 0.00027 -0.00199 0.00176 -0.00365 0.00461
286 8D-2 0.00047 0.00176 0.00004 0.00211 0.00798
287 9D 0 0.00123 0.01175 0.02036 0.00000 0.03217
288 9D+1 0.00398 0.00912 0.01080 -0.00364 0.07518
289 9D-1 0.00230 0.00027 0.00912 0.00631 0.04340
290 9D+2 -0.00780 0.00460 -0.02246 0.02179 -0.05926
291 9D-2 -0.01352 -0.02246 -0.02134 -0.01258 -0.10265
292 10F 0 -0.00008 0.00150 0.00259 0.00000 0.00209
293 10F+1 -0.00060 0.00189 0.00230 -0.00016 -0.00192
294 10F-1 -0.00035 0.00012 0.00189 0.00028 -0.00111
295 10F+2 0.00014 -0.00206 -0.00059 -0.00130 -0.00284
296 10F-2 0.00024 -0.00059 -0.00274 0.00075 -0.00492
297 10F+3 0.00000 0.00043 -0.00025 0.00278 0.00000
298 10F-3 0.00180 0.00067 0.00115 0.00000 0.00634
51 52 53 54 55
(A2G)--V (EG)--V (EG)--V (EU)--V (EU)--V
Eigenvalues -- 0.68740 0.74142 0.74142 0.76044 0.76044
1 1 Si 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 0.08322 0.00000 0.00000 0.08774
8 7PY 0.00000 0.00000 0.08322 0.08774 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.03169 0.00000 0.00000 -0.03469
11 8PY 0.00000 0.00000 -0.03169 -0.03469 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 -0.20371 0.00000 0.00000 -0.29529
14 9PY 0.00000 0.00000 -0.20371 -0.29529 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 3.73308 0.00000 0.00000 5.17898
17 10PY 0.00000 0.00000 3.73308 5.17898 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.24893 0.00000 0.00000 0.83905
20 11PY 0.00000 0.00000 0.24893 0.83905 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 1.26247 0.00000 0.00000 1.38651
24 12D-1 0.00000 0.00000 1.26247 1.38651 0.00000
25 12D+2 0.00000 0.00000 -1.15467 -1.48991 0.00000
26 12D-2 0.00000 -1.15467 0.00000 0.00000 -1.48991
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.65653 0.00000 0.00000 0.53032
29 13D-1 0.00000 0.00000 0.65653 0.53032 0.00000
30 13D+2 0.00000 0.00000 -0.88080 -1.17086 0.00000
31 13D-2 0.00000 -0.88080 0.00000 0.00000 -1.17086
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 -0.08369 0.00000 0.00000 -0.10154
34 14D-1 0.00000 0.00000 -0.08369 -0.10154 0.00000
35 14D+2 0.00000 0.00000 0.12151 0.13440 0.00000
36 14D-2 0.00000 0.12151 0.00000 0.00000 0.13440
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 -0.27393 0.00000 0.00000 -0.20884
39 15F-1 0.00000 0.00000 -0.27393 -0.20884 0.00000
40 15F+2 0.00000 0.00000 -0.54356 -0.73139 0.00000
41 15F-2 0.00000 -0.54356 0.00000 0.00000 -0.73139
42 15F+3 0.00801 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 -0.01277 0.00000 0.00000 -0.02467
46 16F-1 0.00000 0.00000 -0.01277 -0.02467 0.00000
47 16F+2 0.00000 0.00000 -0.08146 -0.08670 0.00000
48 16F-2 0.00000 -0.08146 0.00000 0.00000 -0.08670
49 16F+3 0.02631 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 -0.06566 0.00000 0.00000 -0.07977
53 17G-1 0.00000 0.00000 -0.06566 -0.07977 0.00000
54 17G+2 0.00000 0.00000 -0.00793 0.01607 0.00000
55 17G-2 0.00000 -0.00793 0.00000 0.00000 0.01607
56 17G+3 0.04212 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.05539 0.08686 0.00000
59 17G-4 0.00000 -0.05539 0.00000 0.00000 -0.08686
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00000
61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
62 3S 0.00000 0.00000 0.00000 0.00000 0.00000
63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
64 5S 0.00000 0.00000 0.00000 0.00000 0.00000
65 6S 0.00000 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 -0.08322 0.00000 0.00000 0.08774
67 7PY 0.00000 0.00000 -0.08322 0.08774 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 0.03169 0.00000 0.00000 -0.03469
70 8PY 0.00000 0.00000 0.03169 -0.03469 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 0.20371 0.00000 0.00000 -0.29529
73 9PY 0.00000 0.00000 0.20371 -0.29529 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 -3.73308 0.00000 0.00000 5.17898
76 10PY 0.00000 0.00000 -3.73308 5.17898 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 -0.24893 0.00000 0.00000 0.83905
79 11PY 0.00000 0.00000 -0.24893 0.83905 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 1.26247 0.00000 0.00000 -1.38651
83 12D-1 0.00000 0.00000 1.26247 -1.38651 0.00000
84 12D+2 0.00000 0.00000 -1.15467 1.48991 0.00000
85 12D-2 0.00000 -1.15467 0.00000 0.00000 1.48991
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.65653 0.00000 0.00000 -0.53032
88 13D-1 0.00000 0.00000 0.65653 -0.53032 0.00000
89 13D+2 0.00000 0.00000 -0.88080 1.17086 0.00000
90 13D-2 0.00000 -0.88080 0.00000 0.00000 1.17086
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 -0.08369 0.00000 0.00000 0.10154
93 14D-1 0.00000 0.00000 -0.08369 0.10154 0.00000
94 14D+2 0.00000 0.00000 0.12151 -0.13440 0.00000
95 14D-2 0.00000 0.12151 0.00000 0.00000 -0.13440
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.27393 0.00000 0.00000 -0.20884
98 15F-1 0.00000 0.00000 0.27393 -0.20884 0.00000
99 15F+2 0.00000 0.00000 0.54356 -0.73139 0.00000
100 15F-2 0.00000 0.54356 0.00000 0.00000 -0.73139
101 15F+3 -0.00801 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.01277 0.00000 0.00000 -0.02467
105 16F-1 0.00000 0.00000 0.01277 -0.02467 0.00000
106 16F+2 0.00000 0.00000 0.08146 -0.08670 0.00000
107 16F-2 0.00000 0.08146 0.00000 0.00000 -0.08670
108 16F+3 -0.02631 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 -0.06566 0.00000 0.00000 0.07977
112 17G-1 0.00000 0.00000 -0.06566 0.07977 0.00000
113 17G+2 0.00000 0.00000 -0.00793 -0.01607 0.00000
114 17G-2 0.00000 -0.00793 0.00000 0.00000 -0.01607
115 17G+3 0.04212 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.05539 -0.08686 0.00000
118 17G-4 0.00000 -0.05539 0.00000 0.00000 0.08686
119 3 H 1S 0.00000 0.00000 0.00401 0.00262 0.00000
120 2S 0.00000 0.00000 0.11313 0.13411 0.00000
121 3S 0.00000 0.00000 -2.84035 -3.62504 0.00000
122 4S 0.00000 0.00000 -1.94550 -2.64967 0.00000
123 5PX 0.02509 0.01110 0.00000 0.00000 0.00176
124 5PY 0.00000 0.00000 0.01421 0.00834 0.00000
125 5PZ 0.00000 0.00000 -0.01184 -0.00098 0.00000
126 6PX -0.09129 -0.04207 0.00000 0.00000 -0.00996
127 6PY 0.00000 0.00000 -0.02647 0.00215 0.00000
128 6PZ 0.00000 0.00000 0.05598 0.02013 0.00000
129 7PX 0.53924 0.27398 0.00000 0.00000 0.09105
130 7PY 0.00000 0.00000 1.75577 1.95738 0.00000
131 7PZ 0.00000 0.00000 0.28146 0.62645 0.00000
132 8D 0 0.00000 0.00000 -0.00351 -0.00585 0.00000
133 8D+1 0.00186 0.00001 0.00000 0.00000 -0.00040
134 8D-1 0.00000 0.00000 0.00698 0.00798 0.00000
135 8D+2 0.00000 0.00000 -0.00974 -0.00995 0.00000
136 8D-2 0.00086 0.00034 0.00000 0.00000 0.00022
137 9D 0 0.00000 0.00000 0.04792 0.06063 0.00000
138 9D+1 -0.01298 0.00117 0.00000 0.00000 0.00427
139 9D-1 0.00000 0.00000 -0.08094 -0.10090 0.00000
140 9D+2 0.00000 0.00000 0.11568 0.12720 0.00000
141 9D-2 -0.01521 -0.00472 0.00000 0.00000 -0.00114
142 10F 0 0.00000 0.00000 -0.00281 -0.00478 0.00000
143 10F+1 -0.00095 -0.00050 0.00000 0.00000 -0.00076
144 10F-1 0.00000 0.00000 -0.00421 0.00059 0.00000
145 10F+2 0.00000 0.00000 -0.00195 -0.00499 0.00000
146 10F-2 0.00261 0.00082 0.00000 0.00000 0.00056
147 10F+3 -0.00546 -0.00223 0.00000 0.00000 -0.00184
148 10F-3 0.00000 0.00000 -0.00592 -0.00496 0.00000
149 4 H 1S 0.00000 -0.00347 -0.00201 -0.00131 -0.00227
150 2S 0.00000 -0.09797 -0.05656 -0.06706 -0.11614
151 3S 0.00000 2.45981 1.42017 1.81252 3.13938
152 4S 0.00000 1.68485 0.97275 1.32483 2.29468
153 5PX -0.01254 0.01344 0.00135 0.00285 0.00669
154 5PY 0.02173 0.00135 0.01188 0.00340 0.00285
155 5PZ 0.00000 0.01025 0.00592 0.00049 0.00085
156 6PX 0.04564 -0.03037 0.00676 0.00525 -0.00087
157 6PY -0.07906 0.00676 -0.03817 -0.00693 0.00525
158 6PZ 0.00000 -0.04848 -0.02799 -0.01006 -0.01743
159 7PX -0.26962 1.38533 0.64164 0.80814 1.49079
160 7PY 0.46699 0.64164 0.64443 0.55763 0.80814
161 7PZ 0.00000 -0.24375 -0.14073 -0.31323 -0.54252
162 8D 0 0.00000 0.00304 0.00176 0.00293 0.00507
163 8D+1 -0.00093 0.00524 0.00302 0.00363 0.00588
164 8D-1 0.00161 0.00302 0.00175 0.00169 0.00363
165 8D+2 0.00075 -0.00436 -0.00218 -0.00233 -0.00440
166 8D-2 -0.00043 -0.00722 -0.00436 -0.00440 -0.00741
167 9D 0 0.00000 -0.04150 -0.02396 -0.03031 -0.05251
168 9D+1 0.00649 -0.06041 -0.03555 -0.04554 -0.07461
169 9D-1 -0.01124 -0.03555 -0.01936 -0.02202 -0.04554
170 9D+2 -0.01317 0.05214 0.02538 0.03095 0.05557
171 9D-2 0.00760 0.08558 0.05214 0.05557 0.09512
172 10F 0 0.00000 0.00244 0.00141 0.00239 0.00414
173 10F+1 0.00048 -0.00328 -0.00161 0.00059 0.00025
174 10F-1 -0.00083 -0.00161 -0.00143 -0.00042 0.00059
175 10F+2 0.00226 -0.00120 0.00013 -0.00082 -0.00240
176 10F-2 -0.00131 -0.00126 -0.00120 -0.00240 -0.00360
177 10F+3 -0.00546 0.00112 -0.00193 -0.00159 0.00092
178 10F-3 0.00000 0.00512 0.00296 0.00248 0.00430
179 5 H 1S 0.00000 0.00347 -0.00201 -0.00131 0.00227
180 2S 0.00000 0.09797 -0.05656 -0.06706 0.11614
181 3S 0.00000 -2.45981 1.42017 1.81252 -3.13938
182 4S 0.00000 -1.68485 0.97275 1.32483 -2.29468
183 5PX -0.01254 0.01344 -0.00135 -0.00285 0.00669
184 5PY -0.02173 -0.00135 0.01188 0.00340 -0.00285
185 5PZ 0.00000 -0.01025 0.00592 0.00049 -0.00085
186 6PX 0.04564 -0.03037 -0.00676 -0.00525 -0.00087
187 6PY 0.07906 -0.00676 -0.03817 -0.00693 -0.00525
188 6PZ 0.00000 0.04848 -0.02799 -0.01006 0.01743
189 7PX -0.26962 1.38533 -0.64164 -0.80814 1.49079
190 7PY -0.46699 -0.64164 0.64443 0.55763 -0.80814
191 7PZ 0.00000 0.24375 -0.14073 -0.31323 0.54252
192 8D 0 0.00000 -0.00304 0.00176 0.00293 -0.00507
193 8D+1 -0.00093 0.00524 -0.00302 -0.00363 0.00588
194 8D-1 -0.00161 -0.00302 0.00175 0.00169 -0.00363
195 8D+2 -0.00075 0.00436 -0.00218 -0.00233 0.00440
196 8D-2 -0.00043 -0.00722 0.00436 0.00440 -0.00741
197 9D 0 0.00000 0.04150 -0.02396 -0.03031 0.05251
198 9D+1 0.00649 -0.06041 0.03555 0.04554 -0.07461
199 9D-1 0.01124 0.03555 -0.01936 -0.02202 0.04554
200 9D+2 0.01317 -0.05214 0.02538 0.03095 -0.05557
201 9D-2 0.00760 0.08558 -0.05214 -0.05557 0.09512
202 10F 0 0.00000 -0.00244 0.00141 0.00239 -0.00414
203 10F+1 0.00048 -0.00328 0.00161 -0.00059 0.00025
204 10F-1 0.00083 0.00161 -0.00143 -0.00042 -0.00059
205 10F+2 -0.00226 0.00120 0.00013 -0.00082 0.00240
206 10F-2 -0.00131 -0.00126 0.00120 0.00240 -0.00360
207 10F+3 -0.00546 0.00112 0.00193 0.00159 0.00092
208 10F-3 0.00000 -0.00512 0.00296 0.00248 -0.00430
209 6 H 1S 0.00000 0.00000 0.00401 -0.00262 0.00000
210 2S 0.00000 0.00000 0.11313 -0.13411 0.00000
211 3S 0.00000 0.00000 -2.84035 3.62504 0.00000
212 4S 0.00000 0.00000 -1.94550 2.64967 0.00000
213 5PX -0.02509 -0.01110 0.00000 0.00000 0.00176
214 5PY 0.00000 0.00000 -0.01421 0.00834 0.00000
215 5PZ 0.00000 0.00000 0.01184 -0.00098 0.00000
216 6PX 0.09129 0.04207 0.00000 0.00000 -0.00996
217 6PY 0.00000 0.00000 0.02647 0.00215 0.00000
218 6PZ 0.00000 0.00000 -0.05598 0.02013 0.00000
219 7PX -0.53924 -0.27398 0.00000 0.00000 0.09105
220 7PY 0.00000 0.00000 -1.75577 1.95738 0.00000
221 7PZ 0.00000 0.00000 -0.28146 0.62645 0.00000
222 8D 0 0.00000 0.00000 -0.00351 0.00585 0.00000
223 8D+1 0.00186 0.00001 0.00000 0.00000 0.00040
224 8D-1 0.00000 0.00000 0.00698 -0.00798 0.00000
225 8D+2 0.00000 0.00000 -0.00974 0.00995 0.00000
226 8D-2 0.00086 0.00034 0.00000 0.00000 -0.00022
227 9D 0 0.00000 0.00000 0.04792 -0.06063 0.00000
228 9D+1 -0.01298 0.00117 0.00000 0.00000 -0.00427
229 9D-1 0.00000 0.00000 -0.08094 0.10090 0.00000
230 9D+2 0.00000 0.00000 0.11568 -0.12720 0.00000
231 9D-2 -0.01521 -0.00472 0.00000 0.00000 0.00114
232 10F 0 0.00000 0.00000 0.00281 -0.00478 0.00000
233 10F+1 0.00095 0.00050 0.00000 0.00000 -0.00076
234 10F-1 0.00000 0.00000 0.00421 0.00059 0.00000
235 10F+2 0.00000 0.00000 0.00195 -0.00499 0.00000
236 10F-2 -0.00261 -0.00082 0.00000 0.00000 0.00056
237 10F+3 0.00546 0.00223 0.00000 0.00000 -0.00184
238 10F-3 0.00000 0.00000 0.00592 -0.00496 0.00000
239 7 H 1S 0.00000 0.00347 -0.00201 0.00131 -0.00227
240 2S 0.00000 0.09797 -0.05656 0.06706 -0.11614
241 3S 0.00000 -2.45981 1.42017 -1.81252 3.13938
242 4S 0.00000 -1.68485 0.97275 -1.32483 2.29468
243 5PX 0.01254 -0.01344 0.00135 -0.00285 0.00669
244 5PY 0.02173 0.00135 -0.01188 0.00340 -0.00285
245 5PZ 0.00000 0.01025 -0.00592 0.00049 -0.00085
246 6PX -0.04564 0.03037 0.00676 -0.00525 -0.00087
247 6PY -0.07906 0.00676 0.03817 -0.00693 -0.00525
248 6PZ 0.00000 -0.04848 0.02799 -0.01006 0.01743
249 7PX 0.26962 -1.38533 0.64164 -0.80814 1.49079
250 7PY 0.46699 0.64164 -0.64443 0.55763 -0.80814
251 7PZ 0.00000 -0.24375 0.14073 -0.31323 0.54252
252 8D 0 0.00000 -0.00304 0.00176 -0.00293 0.00507
253 8D+1 -0.00093 0.00524 -0.00302 0.00363 -0.00588
254 8D-1 -0.00161 -0.00302 0.00175 -0.00169 0.00363
255 8D+2 -0.00075 0.00436 -0.00218 0.00233 -0.00440
256 8D-2 -0.00043 -0.00722 0.00436 -0.00440 0.00741
257 9D 0 0.00000 0.04150 -0.02396 0.03031 -0.05251
258 9D+1 0.00649 -0.06041 0.03555 -0.04554 0.07461
259 9D-1 0.01124 0.03555 -0.01936 0.02202 -0.04554
260 9D+2 0.01317 -0.05214 0.02538 -0.03095 0.05557
261 9D-2 0.00760 0.08558 -0.05214 0.05557 -0.09512
262 10F 0 0.00000 0.00244 -0.00141 0.00239 -0.00414
263 10F+1 -0.00048 0.00328 -0.00161 -0.00059 0.00025
264 10F-1 -0.00083 -0.00161 0.00143 -0.00042 -0.00059
265 10F+2 0.00226 -0.00120 -0.00013 -0.00082 0.00240
266 10F-2 0.00131 0.00126 -0.00120 0.00240 -0.00360
267 10F+3 0.00546 -0.00112 -0.00193 0.00159 0.00092
268 10F-3 0.00000 0.00512 -0.00296 0.00248 -0.00430
269 8 H 1S 0.00000 -0.00347 -0.00201 0.00131 0.00227
270 2S 0.00000 -0.09797 -0.05656 0.06706 0.11614
271 3S 0.00000 2.45981 1.42017 -1.81252 -3.13938
272 4S 0.00000 1.68485 0.97275 -1.32483 -2.29468
273 5PX 0.01254 -0.01344 -0.00135 0.00285 0.00669
274 5PY -0.02173 -0.00135 -0.01188 0.00340 0.00285
275 5PZ 0.00000 -0.01025 -0.00592 0.00049 0.00085
276 6PX -0.04564 0.03037 -0.00676 0.00525 -0.00087
277 6PY 0.07906 -0.00676 0.03817 -0.00693 0.00525
278 6PZ 0.00000 0.04848 0.02799 -0.01006 -0.01743
279 7PX 0.26962 -1.38533 -0.64164 0.80814 1.49079
280 7PY -0.46699 -0.64164 -0.64443 0.55763 0.80814
281 7PZ 0.00000 0.24375 0.14073 -0.31323 -0.54252
282 8D 0 0.00000 0.00304 0.00176 -0.00293 -0.00507
283 8D+1 -0.00093 0.00524 0.00302 -0.00363 -0.00588
284 8D-1 0.00161 0.00302 0.00175 -0.00169 -0.00363
285 8D+2 0.00075 -0.00436 -0.00218 0.00233 0.00440
286 8D-2 -0.00043 -0.00722 -0.00436 0.00440 0.00741
287 9D 0 0.00000 -0.04150 -0.02396 0.03031 0.05251
288 9D+1 0.00649 -0.06041 -0.03555 0.04554 0.07461
289 9D-1 -0.01124 -0.03555 -0.01936 0.02202 0.04554
290 9D+2 -0.01317 0.05214 0.02538 -0.03095 -0.05557
291 9D-2 0.00760 0.08558 0.05214 -0.05557 -0.09512
292 10F 0 0.00000 -0.00244 -0.00141 0.00239 0.00414
293 10F+1 -0.00048 0.00328 0.00161 0.00059 0.00025
294 10F-1 0.00083 0.00161 0.00143 -0.00042 0.00059
295 10F+2 -0.00226 0.00120 -0.00013 -0.00082 -0.00240
296 10F-2 0.00131 0.00126 0.00120 -0.00240 -0.00360
297 10F+3 0.00546 -0.00112 0.00193 -0.00159 0.00092
298 10F-3 0.00000 -0.00512 -0.00296 0.00248 0.00430
56 57 58 59 60
(A2U)--V (EG)--V (EG)--V (EU)--V (EU)--V
Eigenvalues -- 0.80924 0.81394 0.81394 0.83001 0.83001
1 1 Si 1S -0.00387 0.00000 0.00000 0.00000 0.00000
2 2S 0.01023 0.00000 0.00000 0.00000 0.00000
3 3S -0.02595 0.00000 0.00000 0.00000 0.00000
4 4S -0.15483 0.00000 0.00000 0.00000 0.00000
5 5S -0.12956 0.00000 0.00000 0.00000 0.00000
6 6S 0.79575 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 -0.08504 0.00000 0.00000 -0.00103
8 7PY 0.00000 0.00000 -0.08504 -0.00103 0.00000
9 7PZ -0.05971 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.03797 0.00000 0.00000 -0.01096
11 8PY 0.00000 0.00000 -0.03797 -0.01096 0.00000
12 8PZ 0.00358 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.09481 0.00000 0.00000 -0.12600
14 9PY 0.00000 0.00000 0.09481 -0.12600 0.00000
15 9PZ -0.14042 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 3.08918 0.00000 0.00000 2.15577
17 10PY 0.00000 0.00000 3.08918 2.15577 0.00000
18 10PZ 2.65276 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 1.33735 0.00000 0.00000 0.76598
20 11PY 0.00000 0.00000 1.33735 0.76598 0.00000
21 11PZ 0.62454 0.00000 0.00000 0.00000 0.00000
22 12D 0 -0.93614 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 1.61458 0.00000 0.00000 -0.01750
24 12D-1 0.00000 0.00000 1.61458 -0.01750 0.00000
25 12D+2 0.00000 0.00000 -1.53465 -1.63200 0.00000
26 12D-2 0.00000 -1.53465 0.00000 0.00000 -1.63200
27 13D 0 -0.08808 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.22086 0.00000 0.00000 0.53916
29 13D-1 0.00000 0.00000 0.22086 0.53916 0.00000
30 13D+2 0.00000 0.00000 -0.37080 0.07388 0.00000
31 13D-2 0.00000 -0.37080 0.00000 0.00000 0.07388
32 14D 0 0.06024 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 -0.10966 0.00000 0.00000 -0.00332
34 14D-1 0.00000 0.00000 -0.10966 -0.00332 0.00000
35 14D+2 0.00000 0.00000 0.07685 0.06279 0.00000
36 14D-2 0.00000 0.07685 0.00000 0.00000 0.06279
37 15F 0 0.09712 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 -0.54433 0.00000 0.00000 -0.38374
39 15F-1 0.00000 0.00000 -0.54433 -0.38374 0.00000
40 15F+2 0.00000 0.00000 -0.84882 -0.32423 0.00000
41 15F-2 0.00000 -0.84882 0.00000 0.00000 -0.32423
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.69006 0.00000 0.00000 0.00000 0.00000
44 16F 0 -0.02288 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 0.01014 0.00000 0.00000 0.01709
46 16F-1 0.00000 0.00000 0.01014 0.01709 0.00000
47 16F+2 0.00000 0.00000 0.02031 -0.00429 0.00000
48 16F-2 0.00000 0.02031 0.00000 0.00000 -0.00429
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.04488 0.00000 0.00000 0.00000 0.00000
51 17G 0 -0.04716 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 -0.01992 0.00000 0.00000 -0.03497
53 17G-1 0.00000 0.00000 -0.01992 -0.03497 0.00000
54 17G+2 0.00000 0.00000 0.00169 0.03873 0.00000
55 17G-2 0.00000 0.00169 0.00000 0.00000 0.03873
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.06756 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.06204 0.06000 0.00000
59 17G-4 0.00000 -0.06204 0.00000 0.00000 -0.06000
60 2 Si 1S 0.00387 0.00000 0.00000 0.00000 0.00000
61 2S -0.01023 0.00000 0.00000 0.00000 0.00000
62 3S 0.02595 0.00000 0.00000 0.00000 0.00000
63 4S 0.15483 0.00000 0.00000 0.00000 0.00000
64 5S 0.12956 0.00000 0.00000 0.00000 0.00000
65 6S -0.79575 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 0.08504 0.00000 0.00000 -0.00103
67 7PY 0.00000 0.00000 0.08504 -0.00103 0.00000
68 7PZ -0.05971 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 0.03797 0.00000 0.00000 -0.01096
70 8PY 0.00000 0.00000 0.03797 -0.01096 0.00000
71 8PZ 0.00358 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 -0.09481 0.00000 0.00000 -0.12600
73 9PY 0.00000 0.00000 -0.09481 -0.12600 0.00000
74 9PZ -0.14042 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 -3.08918 0.00000 0.00000 2.15577
76 10PY 0.00000 0.00000 -3.08918 2.15577 0.00000
77 10PZ 2.65276 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 -1.33735 0.00000 0.00000 0.76598
79 11PY 0.00000 0.00000 -1.33735 0.76598 0.00000
80 11PZ 0.62454 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.93614 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 1.61458 0.00000 0.00000 0.01750
83 12D-1 0.00000 0.00000 1.61458 0.01750 0.00000
84 12D+2 0.00000 0.00000 -1.53465 1.63200 0.00000
85 12D-2 0.00000 -1.53465 0.00000 0.00000 1.63200
86 13D 0 0.08808 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.22086 0.00000 0.00000 -0.53916
88 13D-1 0.00000 0.00000 0.22086 -0.53916 0.00000
89 13D+2 0.00000 0.00000 -0.37080 -0.07388 0.00000
90 13D-2 0.00000 -0.37080 0.00000 0.00000 -0.07388
91 14D 0 -0.06024 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 -0.10966 0.00000 0.00000 0.00332
93 14D-1 0.00000 0.00000 -0.10966 0.00332 0.00000
94 14D+2 0.00000 0.00000 0.07685 -0.06279 0.00000
95 14D-2 0.00000 0.07685 0.00000 0.00000 -0.06279
96 15F 0 0.09712 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.54433 0.00000 0.00000 -0.38374
98 15F-1 0.00000 0.00000 0.54433 -0.38374 0.00000
99 15F+2 0.00000 0.00000 0.84882 -0.32423 0.00000
100 15F-2 0.00000 0.84882 0.00000 0.00000 -0.32423
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 -0.69006 0.00000 0.00000 0.00000 0.00000
103 16F 0 -0.02288 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 -0.01014 0.00000 0.00000 0.01709
105 16F-1 0.00000 0.00000 -0.01014 0.01709 0.00000
106 16F+2 0.00000 0.00000 -0.02031 -0.00429 0.00000
107 16F-2 0.00000 -0.02031 0.00000 0.00000 -0.00429
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.04488 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.04716 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 -0.01992 0.00000 0.00000 0.03497
112 17G-1 0.00000 0.00000 -0.01992 0.03497 0.00000
113 17G+2 0.00000 0.00000 0.00169 -0.03873 0.00000
114 17G-2 0.00000 0.00169 0.00000 0.00000 -0.03873
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.06756 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.06204 -0.06000 0.00000
118 17G-4 0.00000 -0.06204 0.00000 0.00000 0.06000
119 3 H 1S -0.00235 0.00000 -0.01512 -0.00536 0.00000
120 2S -0.01648 0.00000 0.10228 0.03850 0.00000
121 3S -0.92120 0.00000 -2.93331 -1.67589 0.00000
122 4S -0.47581 0.00000 -2.03176 -1.40069 0.00000
123 5PX 0.00000 -0.02089 0.00000 0.00000 0.00082
124 5PY 0.00060 0.00000 -0.00434 -0.01258 0.00000
125 5PZ -0.02331 0.00000 0.00859 0.02438 0.00000
126 6PX 0.00000 0.07788 0.00000 0.00000 -0.00677
127 6PY 0.01043 0.00000 0.03161 0.06427 0.00000
128 6PZ 0.09882 0.00000 -0.03141 -0.08687 0.00000
129 7PX 0.00000 -0.33898 0.00000 0.00000 0.04488
130 7PY 0.23970 0.00000 0.84479 0.24137 0.00000
131 7PZ -0.38574 0.00000 0.48489 0.93022 0.00000
132 8D 0 0.00028 0.00000 -0.00152 0.00081 0.00000
133 8D+1 0.00000 -0.00216 0.00000 0.00000 -0.00021
134 8D-1 -0.00259 0.00000 0.00220 0.00464 0.00000
135 8D+2 0.00031 0.00000 -0.00126 0.00148 0.00000
136 8D-2 0.00000 0.00208 0.00000 0.00000 0.00047
137 9D 0 0.00540 0.00000 0.02172 -0.00279 0.00000
138 9D+1 0.00000 0.01454 0.00000 0.00000 0.00431
139 9D-1 0.01280 0.00000 -0.03517 -0.05258 0.00000
140 9D+2 0.00844 0.00000 0.03792 0.01024 0.00000
141 9D-2 0.00000 -0.00881 0.00000 0.00000 0.00488
142 10F 0 0.00343 0.00000 -0.00078 -0.00100 0.00000
143 10F+1 0.00000 -0.00061 0.00000 0.00000 0.00088
144 10F-1 -0.00373 0.00000 0.00217 0.00112 0.00000
145 10F+2 0.00409 0.00000 -0.00099 -0.00133 0.00000
146 10F-2 0.00000 -0.00550 0.00000 0.00000 -0.00477
147 10F+3 0.00000 0.00361 0.00000 0.00000 0.00575
148 10F-3 -0.00202 0.00000 0.00008 0.00067 0.00000
149 4 H 1S -0.00235 0.01309 0.00756 0.00268 0.00465
150 2S -0.01648 -0.08858 -0.05114 -0.01925 -0.03334
151 3S -0.92120 2.54032 1.46666 0.83795 1.45136
152 4S -0.47581 1.75956 1.01588 0.70035 1.21304
153 5PX -0.00052 -0.00848 0.00716 -0.00580 -0.00923
154 5PY -0.00030 0.00716 -0.01675 -0.00253 -0.00580
155 5PZ -0.02331 -0.00744 -0.00429 -0.01219 -0.02111
156 6PX -0.00903 0.04318 -0.02004 0.03076 0.04651
157 6PY -0.00521 -0.02004 0.06631 0.01099 0.03076
158 6PZ 0.09882 0.02720 0.01571 0.04343 0.07523
159 7PX -0.20759 0.54885 0.51259 0.08508 0.19225
160 7PY -0.11985 0.51259 -0.04304 0.09400 0.08508
161 7PZ -0.38574 -0.41993 -0.24244 -0.46511 -0.80559
162 8D 0 0.00028 0.00132 0.00076 -0.00041 -0.00071
163 8D+1 0.00224 0.00111 0.00189 0.00210 0.00343
164 8D-1 0.00129 0.00189 -0.00107 0.00100 0.00210
165 8D+2 -0.00016 -0.00145 0.00125 0.00073 0.00044
166 8D-2 -0.00027 -0.00043 -0.00145 0.00044 0.00123
167 9D 0 0.00540 -0.01881 -0.01086 0.00140 0.00242
168 9D+1 -0.01109 -0.02274 -0.02153 -0.02463 -0.03836
169 9D-1 -0.00640 -0.02153 0.00211 -0.00991 -0.02463
170 9D+2 -0.00422 0.02023 0.00288 0.00622 0.00232
171 9D-2 -0.00731 0.02624 0.02023 0.00232 0.00890
172 10F 0 0.00343 0.00067 0.00039 0.00050 0.00087
173 10F+1 0.00323 0.00147 0.00120 0.00010 0.00106
174 10F-1 0.00186 0.00120 0.00008 0.00094 0.00010
175 10F+2 -0.00204 0.00195 -0.00437 -0.00391 0.00149
176 10F-2 -0.00354 -0.00212 0.00195 0.00149 -0.00219
177 10F+3 0.00000 -0.00181 0.00313 0.00498 -0.00288
178 10F-3 -0.00202 -0.00007 -0.00004 -0.00033 -0.00058
179 5 H 1S -0.00235 -0.01309 0.00756 0.00268 -0.00465
180 2S -0.01648 0.08858 -0.05114 -0.01925 0.03334
181 3S -0.92120 -2.54032 1.46666 0.83795 -1.45136
182 4S -0.47581 -1.75956 1.01588 0.70035 -1.21304
183 5PX 0.00052 -0.00848 -0.00716 0.00580 -0.00923
184 5PY -0.00030 -0.00716 -0.01675 -0.00253 0.00580
185 5PZ -0.02331 0.00744 -0.00429 -0.01219 0.02111
186 6PX 0.00903 0.04318 0.02004 -0.03076 0.04651
187 6PY -0.00521 0.02004 0.06631 0.01099 -0.03076
188 6PZ 0.09882 -0.02720 0.01571 0.04343 -0.07523
189 7PX 0.20759 0.54885 -0.51259 -0.08508 0.19225
190 7PY -0.11985 -0.51259 -0.04304 0.09400 -0.08508
191 7PZ -0.38574 0.41993 -0.24244 -0.46511 0.80559
192 8D 0 0.00028 -0.00132 0.00076 -0.00041 0.00071
193 8D+1 -0.00224 0.00111 -0.00189 -0.00210 0.00343
194 8D-1 0.00129 -0.00189 -0.00107 0.00100 -0.00210
195 8D+2 -0.00016 0.00145 0.00125 0.00073 -0.00044
196 8D-2 0.00027 -0.00043 0.00145 -0.00044 0.00123
197 9D 0 0.00540 0.01881 -0.01086 0.00140 -0.00242
198 9D+1 0.01109 -0.02274 0.02153 0.02463 -0.03836
199 9D-1 -0.00640 0.02153 0.00211 -0.00991 0.02463
200 9D+2 -0.00422 -0.02023 0.00288 0.00622 -0.00232
201 9D-2 0.00731 0.02624 -0.02023 -0.00232 0.00890
202 10F 0 0.00343 -0.00067 0.00039 0.00050 -0.00087
203 10F+1 -0.00323 0.00147 -0.00120 -0.00010 0.00106
204 10F-1 0.00186 -0.00120 0.00008 0.00094 -0.00010
205 10F+2 -0.00204 -0.00195 -0.00437 -0.00391 -0.00149
206 10F-2 0.00354 -0.00212 -0.00195 -0.00149 -0.00219
207 10F+3 0.00000 -0.00181 -0.00313 -0.00498 -0.00288
208 10F-3 -0.00202 0.00007 -0.00004 -0.00033 0.00058
209 6 H 1S 0.00235 0.00000 -0.01512 0.00536 0.00000
210 2S 0.01648 0.00000 0.10228 -0.03850 0.00000
211 3S 0.92120 0.00000 -2.93331 1.67589 0.00000
212 4S 0.47581 0.00000 -2.03176 1.40069 0.00000
213 5PX 0.00000 0.02089 0.00000 0.00000 0.00082
214 5PY 0.00060 0.00000 0.00434 -0.01258 0.00000
215 5PZ -0.02331 0.00000 -0.00859 0.02438 0.00000
216 6PX 0.00000 -0.07788 0.00000 0.00000 -0.00677
217 6PY 0.01043 0.00000 -0.03161 0.06427 0.00000
218 6PZ 0.09882 0.00000 0.03141 -0.08687 0.00000
219 7PX 0.00000 0.33898 0.00000 0.00000 0.04488
220 7PY 0.23970 0.00000 -0.84479 0.24137 0.00000
221 7PZ -0.38574 0.00000 -0.48489 0.93022 0.00000
222 8D 0 -0.00028 0.00000 -0.00152 -0.00081 0.00000
223 8D+1 0.00000 -0.00216 0.00000 0.00000 0.00021
224 8D-1 0.00259 0.00000 0.00220 -0.00464 0.00000
225 8D+2 -0.00031 0.00000 -0.00126 -0.00148 0.00000
226 8D-2 0.00000 0.00208 0.00000 0.00000 -0.00047
227 9D 0 -0.00540 0.00000 0.02172 0.00279 0.00000
228 9D+1 0.00000 0.01454 0.00000 0.00000 -0.00431
229 9D-1 -0.01280 0.00000 -0.03517 0.05258 0.00000
230 9D+2 -0.00844 0.00000 0.03792 -0.01024 0.00000
231 9D-2 0.00000 -0.00881 0.00000 0.00000 -0.00488
232 10F 0 0.00343 0.00000 0.00078 -0.00100 0.00000
233 10F+1 0.00000 0.00061 0.00000 0.00000 0.00088
234 10F-1 -0.00373 0.00000 -0.00217 0.00112 0.00000
235 10F+2 0.00409 0.00000 0.00099 -0.00133 0.00000
236 10F-2 0.00000 0.00550 0.00000 0.00000 -0.00477
237 10F+3 0.00000 -0.00361 0.00000 0.00000 0.00575
238 10F-3 -0.00202 0.00000 -0.00008 0.00067 0.00000
239 7 H 1S 0.00235 -0.01309 0.00756 -0.00268 0.00465
240 2S 0.01648 0.08858 -0.05114 0.01925 -0.03334
241 3S 0.92120 -2.54032 1.46666 -0.83795 1.45136
242 4S 0.47581 -1.75956 1.01588 -0.70035 1.21304
243 5PX 0.00052 0.00848 0.00716 0.00580 -0.00923
244 5PY -0.00030 0.00716 0.01675 -0.00253 0.00580
245 5PZ -0.02331 -0.00744 0.00429 -0.01219 0.02111
246 6PX 0.00903 -0.04318 -0.02004 -0.03076 0.04651
247 6PY -0.00521 -0.02004 -0.06631 0.01099 -0.03076
248 6PZ 0.09882 0.02720 -0.01571 0.04343 -0.07523
249 7PX 0.20759 -0.54885 0.51259 -0.08508 0.19225
250 7PY -0.11985 0.51259 0.04304 0.09400 -0.08508
251 7PZ -0.38574 -0.41993 0.24244 -0.46511 0.80559
252 8D 0 -0.00028 -0.00132 0.00076 0.00041 -0.00071
253 8D+1 0.00224 0.00111 -0.00189 0.00210 -0.00343
254 8D-1 -0.00129 -0.00189 -0.00107 -0.00100 0.00210
255 8D+2 0.00016 0.00145 0.00125 -0.00073 0.00044
256 8D-2 -0.00027 -0.00043 0.00145 0.00044 -0.00123
257 9D 0 -0.00540 0.01881 -0.01086 -0.00140 0.00242
258 9D+1 -0.01109 -0.02274 0.02153 -0.02463 0.03836
259 9D-1 0.00640 0.02153 0.00211 0.00991 -0.02463
260 9D+2 0.00422 -0.02023 0.00288 -0.00622 0.00232
261 9D-2 -0.00731 0.02624 -0.02023 0.00232 -0.00890
262 10F 0 0.00343 0.00067 -0.00039 0.00050 -0.00087
263 10F+1 -0.00323 -0.00147 0.00120 -0.00010 0.00106
264 10F-1 0.00186 0.00120 -0.00008 0.00094 -0.00010
265 10F+2 -0.00204 0.00195 0.00437 -0.00391 -0.00149
266 10F-2 0.00354 0.00212 0.00195 -0.00149 -0.00219
267 10F+3 0.00000 0.00181 0.00313 -0.00498 -0.00288
268 10F-3 -0.00202 -0.00007 0.00004 -0.00033 0.00058
269 8 H 1S 0.00235 0.01309 0.00756 -0.00268 -0.00465
270 2S 0.01648 -0.08858 -0.05114 0.01925 0.03334
271 3S 0.92120 2.54032 1.46666 -0.83795 -1.45136
272 4S 0.47581 1.75956 1.01588 -0.70035 -1.21304
273 5PX -0.00052 0.00848 -0.00716 -0.00580 -0.00923
274 5PY -0.00030 -0.00716 0.01675 -0.00253 -0.00580
275 5PZ -0.02331 0.00744 0.00429 -0.01219 -0.02111
276 6PX -0.00903 -0.04318 0.02004 0.03076 0.04651
277 6PY -0.00521 0.02004 -0.06631 0.01099 0.03076
278 6PZ 0.09882 -0.02720 -0.01571 0.04343 0.07523
279 7PX -0.20759 -0.54885 -0.51259 0.08508 0.19225
280 7PY -0.11985 -0.51259 0.04304 0.09400 0.08508
281 7PZ -0.38574 0.41993 0.24244 -0.46511 -0.80559
282 8D 0 -0.00028 0.00132 0.00076 0.00041 0.00071
283 8D+1 -0.00224 0.00111 0.00189 -0.00210 -0.00343
284 8D-1 -0.00129 0.00189 -0.00107 -0.00100 -0.00210
285 8D+2 0.00016 -0.00145 0.00125 -0.00073 -0.00044
286 8D-2 0.00027 -0.00043 -0.00145 -0.00044 -0.00123
287 9D 0 -0.00540 -0.01881 -0.01086 -0.00140 -0.00242
288 9D+1 0.01109 -0.02274 -0.02153 0.02463 0.03836
289 9D-1 0.00640 -0.02153 0.00211 0.00991 0.02463
290 9D+2 0.00422 0.02023 0.00288 -0.00622 -0.00232
291 9D-2 0.00731 0.02624 0.02023 -0.00232 -0.00890
292 10F 0 0.00343 -0.00067 -0.00039 0.00050 0.00087
293 10F+1 0.00323 -0.00147 -0.00120 0.00010 0.00106
294 10F-1 0.00186 -0.00120 -0.00008 0.00094 0.00010
295 10F+2 -0.00204 -0.00195 0.00437 -0.00391 0.00149
296 10F-2 -0.00354 0.00212 -0.00195 0.00149 -0.00219
297 10F+3 0.00000 0.00181 -0.00313 0.00498 -0.00288
298 10F-3 -0.00202 0.00007 0.00004 -0.00033 -0.00058
61 62 63 64 65
(EU)--V (EU)--V (A1G)--V (EG)--V (EG)--V
Eigenvalues -- 0.83829 0.83829 0.88986 0.89083 0.89083
1 1 Si 1S 0.00000 0.00000 -0.01216 0.00000 0.00000
2 2S 0.00000 0.00000 0.01076 0.00000 0.00000
3 3S 0.00000 0.00000 -0.10159 0.00000 0.00000
4 4S 0.00000 0.00000 -0.94037 0.00000 0.00000
5 5S 0.00000 0.00000 3.58710 0.00000 0.00000
6 6S 0.00000 0.00000 -0.42141 0.00000 0.00000
7 7PX 0.00000 -0.02595 0.00000 -0.02957 0.00000
8 7PY -0.02595 0.00000 0.00000 0.00000 -0.02957
9 7PZ 0.00000 0.00000 -0.10621 0.00000 0.00000
10 8PX 0.00000 -0.01823 0.00000 -0.00975 0.00000
11 8PY -0.01823 0.00000 0.00000 0.00000 -0.00975
12 8PZ 0.00000 0.00000 0.00629 0.00000 0.00000
13 9PX 0.00000 -0.09291 0.00000 0.01421 0.00000
14 9PY -0.09291 0.00000 0.00000 0.00000 0.01421
15 9PZ 0.00000 0.00000 0.22848 0.00000 0.00000
16 10PX 0.00000 3.64906 0.00000 1.56128 0.00000
17 10PY 3.64906 0.00000 0.00000 0.00000 1.56128
18 10PZ 0.00000 0.00000 -0.92641 0.00000 0.00000
19 11PX 0.00000 0.86400 0.00000 2.62356 0.00000
20 11PY 0.86400 0.00000 0.00000 0.00000 2.62356
21 11PZ 0.00000 0.00000 1.37557 0.00000 0.00000
22 12D 0 0.00000 0.00000 -2.02557 0.00000 0.00000
23 12D+1 0.00000 1.19543 0.00000 -1.47410 0.00000
24 12D-1 1.19543 0.00000 0.00000 0.00000 -1.47410
25 12D+2 -2.63934 0.00000 0.00000 0.00000 -1.56438
26 12D-2 0.00000 -2.63934 0.00000 -1.56438 0.00000
27 13D 0 0.00000 0.00000 0.67909 0.00000 0.00000
28 13D+1 0.00000 0.78960 0.00000 0.68154 0.00000
29 13D-1 0.78960 0.00000 0.00000 0.00000 0.68154
30 13D+2 -0.19640 0.00000 0.00000 0.00000 0.31211
31 13D-2 0.00000 -0.19640 0.00000 0.31211 0.00000
32 14D 0 0.00000 0.00000 0.03746 0.00000 0.00000
33 14D+1 0.00000 -0.03006 0.00000 0.02459 0.00000
34 14D-1 -0.03006 0.00000 0.00000 0.00000 0.02459
35 14D+2 0.05752 0.00000 0.00000 0.00000 0.05251
36 14D-2 0.00000 0.05752 0.00000 0.05251 0.00000
37 15F 0 0.00000 0.00000 0.93080 0.00000 0.00000
38 15F+1 0.00000 -0.15541 0.00000 0.62244 0.00000
39 15F-1 -0.15541 0.00000 0.00000 0.00000 0.62244
40 15F+2 -0.40095 0.00000 0.00000 0.00000 -0.54198
41 15F-2 0.00000 -0.40095 0.00000 -0.54198 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 -0.43509 0.00000 0.00000
44 16F 0 0.00000 0.00000 -0.13196 0.00000 0.00000
45 16F+1 0.00000 -0.01153 0.00000 -0.04185 0.00000
46 16F-1 -0.01153 0.00000 0.00000 0.00000 -0.04185
47 16F+2 -0.05634 0.00000 0.00000 0.00000 -0.00208
48 16F-2 0.00000 -0.05634 0.00000 -0.00208 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.03377 0.00000 0.00000
51 17G 0 0.00000 0.00000 -0.01487 0.00000 0.00000
52 17G+1 0.00000 -0.05607 0.00000 -0.06660 0.00000
53 17G-1 -0.05607 0.00000 0.00000 0.00000 -0.06660
54 17G+2 -0.01373 0.00000 0.00000 0.00000 -0.02154
55 17G-2 0.00000 -0.01373 0.00000 -0.02154 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.04055 0.00000 0.00000
58 17G+4 0.03634 0.00000 0.00000 0.00000 -0.02387
59 17G-4 0.00000 -0.03634 0.00000 0.02387 0.00000
60 2 Si 1S 0.00000 0.00000 -0.01216 0.00000 0.00000
61 2S 0.00000 0.00000 0.01076 0.00000 0.00000
62 3S 0.00000 0.00000 -0.10159 0.00000 0.00000
63 4S 0.00000 0.00000 -0.94037 0.00000 0.00000
64 5S 0.00000 0.00000 3.58710 0.00000 0.00000
65 6S 0.00000 0.00000 -0.42141 0.00000 0.00000
66 7PX 0.00000 -0.02595 0.00000 0.02957 0.00000
67 7PY -0.02595 0.00000 0.00000 0.00000 0.02957
68 7PZ 0.00000 0.00000 0.10621 0.00000 0.00000
69 8PX 0.00000 -0.01823 0.00000 0.00975 0.00000
70 8PY -0.01823 0.00000 0.00000 0.00000 0.00975
71 8PZ 0.00000 0.00000 -0.00629 0.00000 0.00000
72 9PX 0.00000 -0.09291 0.00000 -0.01421 0.00000
73 9PY -0.09291 0.00000 0.00000 0.00000 -0.01421
74 9PZ 0.00000 0.00000 -0.22848 0.00000 0.00000
75 10PX 0.00000 3.64906 0.00000 -1.56128 0.00000
76 10PY 3.64906 0.00000 0.00000 0.00000 -1.56128
77 10PZ 0.00000 0.00000 0.92641 0.00000 0.00000
78 11PX 0.00000 0.86400 0.00000 -2.62356 0.00000
79 11PY 0.86400 0.00000 0.00000 0.00000 -2.62356
80 11PZ 0.00000 0.00000 -1.37557 0.00000 0.00000
81 12D 0 0.00000 0.00000 -2.02557 0.00000 0.00000
82 12D+1 0.00000 -1.19543 0.00000 -1.47410 0.00000
83 12D-1 -1.19543 0.00000 0.00000 0.00000 -1.47410
84 12D+2 2.63934 0.00000 0.00000 0.00000 -1.56438
85 12D-2 0.00000 2.63934 0.00000 -1.56438 0.00000
86 13D 0 0.00000 0.00000 0.67909 0.00000 0.00000
87 13D+1 0.00000 -0.78960 0.00000 0.68154 0.00000
88 13D-1 -0.78960 0.00000 0.00000 0.00000 0.68154
89 13D+2 0.19640 0.00000 0.00000 0.00000 0.31211
90 13D-2 0.00000 0.19640 0.00000 0.31211 0.00000
91 14D 0 0.00000 0.00000 0.03746 0.00000 0.00000
92 14D+1 0.00000 0.03006 0.00000 0.02459 0.00000
93 14D-1 0.03006 0.00000 0.00000 0.00000 0.02459
94 14D+2 -0.05752 0.00000 0.00000 0.00000 0.05251
95 14D-2 0.00000 -0.05752 0.00000 0.05251 0.00000
96 15F 0 0.00000 0.00000 -0.93080 0.00000 0.00000
97 15F+1 0.00000 -0.15541 0.00000 -0.62244 0.00000
98 15F-1 -0.15541 0.00000 0.00000 0.00000 -0.62244
99 15F+2 -0.40095 0.00000 0.00000 0.00000 0.54198
100 15F-2 0.00000 -0.40095 0.00000 0.54198 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.43509 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.13196 0.00000 0.00000
104 16F+1 0.00000 -0.01153 0.00000 0.04185 0.00000
105 16F-1 -0.01153 0.00000 0.00000 0.00000 0.04185
106 16F+2 -0.05634 0.00000 0.00000 0.00000 0.00208
107 16F-2 0.00000 -0.05634 0.00000 0.00208 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 -0.03377 0.00000 0.00000
110 17G 0 0.00000 0.00000 -0.01487 0.00000 0.00000
111 17G+1 0.00000 0.05607 0.00000 -0.06660 0.00000
112 17G-1 0.05607 0.00000 0.00000 0.00000 -0.06660
113 17G+2 0.01373 0.00000 0.00000 0.00000 -0.02154
114 17G-2 0.00000 0.01373 0.00000 -0.02154 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.04055 0.00000 0.00000
117 17G+4 -0.03634 0.00000 0.00000 0.00000 -0.02387
118 17G-4 0.00000 0.03634 0.00000 0.02387 0.00000
119 3 H 1S -0.02423 0.00000 -0.00491 0.00000 0.00061
120 2S 0.13127 0.00000 0.03475 0.00000 0.07681
121 3S -3.34547 0.00000 -0.27067 0.00000 -0.88813
122 4S -1.84483 0.00000 -0.33576 0.00000 -2.00600
123 5PX 0.00000 0.01573 0.00000 0.01379 0.00000
124 5PY 0.00106 0.00000 0.00479 0.00000 -0.00297
125 5PZ -0.02040 0.00000 0.00688 0.00000 0.01365
126 6PX 0.00000 -0.06085 0.00000 -0.05784 0.00000
127 6PY 0.00659 0.00000 -0.02714 0.00000 0.00975
128 6PZ 0.08383 0.00000 -0.03660 0.00000 -0.04797
129 7PX 0.00000 0.44393 0.00000 0.53289 0.00000
130 7PY 1.13309 0.00000 0.09250 0.00000 0.40361
131 7PZ -0.10676 0.00000 0.42070 0.00000 0.24200
132 8D 0 -0.00198 0.00000 0.00480 0.00000 -0.00050
133 8D+1 0.00000 -0.00208 0.00000 -0.00022 0.00000
134 8D-1 0.00091 0.00000 0.00427 0.00000 -0.00453
135 8D+2 -0.00560 0.00000 -0.00124 0.00000 -0.00504
136 8D-2 0.00000 0.00131 0.00000 0.00485 0.00000
137 9D 0 0.03445 0.00000 -0.03162 0.00000 0.01822
138 9D+1 0.00000 0.01570 0.00000 -0.00245 0.00000
139 9D-1 -0.03003 0.00000 -0.02702 0.00000 0.02538
140 9D+2 0.07525 0.00000 0.00519 0.00000 0.04342
141 9D-2 0.00000 -0.00962 0.00000 -0.03371 0.00000
142 10F 0 -0.00164 0.00000 0.00232 0.00000 -0.00057
143 10F+1 0.00000 0.00024 0.00000 -0.00039 0.00000
144 10F-1 -0.00754 0.00000 -0.00097 0.00000 -0.00556
145 10F+2 0.00118 0.00000 0.00225 0.00000 0.00159
146 10F-2 0.00000 -0.00187 0.00000 -0.00158 0.00000
147 10F+3 0.00000 0.00196 0.00000 0.00291 0.00000
148 10F-3 -0.00532 0.00000 -0.00385 0.00000 -0.00168
149 4 H 1S 0.01211 0.02098 -0.00491 -0.00053 -0.00030
150 2S -0.06563 -0.11368 0.03475 -0.06652 -0.03840
151 3S 1.67273 2.89726 -0.27067 0.76914 0.44406
152 4S 0.92241 1.59767 -0.33576 1.73725 1.00300
153 5PX -0.00635 0.00473 -0.00415 0.00122 -0.00726
154 5PY 0.01206 -0.00635 -0.00239 -0.00726 0.00960
155 5PZ 0.01020 0.01766 0.00688 -0.01182 -0.00682
156 6PX 0.02920 -0.01027 0.02350 -0.00714 0.02927
157 6PY -0.04399 0.02920 0.01357 0.02927 -0.04094
158 6PZ -0.04192 -0.07260 -0.03660 0.04154 0.02398
159 7PX 0.29842 0.96080 -0.08011 0.43593 -0.05598
160 7PY 0.61622 0.29842 -0.04625 -0.05598 0.50057
161 7PZ 0.05338 0.09246 0.42070 -0.20958 -0.12100
162 8D 0 0.00099 0.00171 0.00480 0.00043 0.00025
163 8D+1 0.00130 0.00017 -0.00370 -0.00345 -0.00187
164 8D-1 -0.00133 0.00130 -0.00213 -0.00187 -0.00130
165 8D+2 -0.00042 -0.00299 0.00062 -0.00428 0.00238
166 8D-2 -0.00299 -0.00387 0.00107 -0.00257 -0.00428
167 9D 0 -0.01723 -0.02984 -0.03162 -0.01578 -0.00911
168 9D+1 -0.01980 -0.01860 0.02340 0.01842 0.01205
169 9D-1 0.00426 -0.01980 0.01351 0.01205 0.00451
170 9D+2 0.01160 0.03675 -0.00260 0.03340 -0.01443
171 9D-2 0.03675 0.05403 -0.00450 0.02414 0.03340
172 10F 0 0.00082 0.00142 0.00232 0.00050 0.00029
173 10F+1 -0.00337 -0.00560 0.00084 -0.00427 -0.00224
174 10F-1 -0.00171 -0.00337 0.00049 -0.00224 -0.00169
175 10F+2 -0.00111 0.00132 -0.00112 0.00137 -0.00079
176 10F-2 0.00132 0.00041 -0.00195 0.00080 0.00137
177 10F+3 0.00170 -0.00098 0.00000 -0.00146 0.00252
178 10F-3 0.00266 0.00461 -0.00385 0.00146 0.00084
179 5 H 1S 0.01211 -0.02098 -0.00491 0.00053 -0.00030
180 2S -0.06563 0.11368 0.03475 0.06652 -0.03840
181 3S 1.67273 -2.89726 -0.27067 -0.76914 0.44406
182 4S 0.92241 -1.59767 -0.33576 -1.73725 1.00300
183 5PX 0.00635 0.00473 0.00415 0.00122 0.00726
184 5PY 0.01206 0.00635 -0.00239 0.00726 0.00960
185 5PZ 0.01020 -0.01766 0.00688 0.01182 -0.00682
186 6PX -0.02920 -0.01027 -0.02350 -0.00714 -0.02927
187 6PY -0.04399 -0.02920 0.01357 -0.02927 -0.04094
188 6PZ -0.04192 0.07260 -0.03660 -0.04154 0.02398
189 7PX -0.29842 0.96080 0.08011 0.43593 0.05598
190 7PY 0.61622 -0.29842 -0.04625 0.05598 0.50057
191 7PZ 0.05338 -0.09246 0.42070 0.20958 -0.12100
192 8D 0 0.00099 -0.00171 0.00480 -0.00043 0.00025
193 8D+1 -0.00130 0.00017 0.00370 -0.00345 0.00187
194 8D-1 -0.00133 -0.00130 -0.00213 0.00187 -0.00130
195 8D+2 -0.00042 0.00299 0.00062 0.00428 0.00238
196 8D-2 0.00299 -0.00387 -0.00107 -0.00257 0.00428
197 9D 0 -0.01723 0.02984 -0.03162 0.01578 -0.00911
198 9D+1 0.01980 -0.01860 -0.02340 0.01842 -0.01205
199 9D-1 0.00426 0.01980 0.01351 -0.01205 0.00451
200 9D+2 0.01160 -0.03675 -0.00260 -0.03340 -0.01443
201 9D-2 -0.03675 0.05403 0.00450 0.02414 -0.03340
202 10F 0 0.00082 -0.00142 0.00232 -0.00050 0.00029
203 10F+1 0.00337 -0.00560 -0.00084 -0.00427 0.00224
204 10F-1 -0.00171 0.00337 0.00049 0.00224 -0.00169
205 10F+2 -0.00111 -0.00132 -0.00112 -0.00137 -0.00079
206 10F-2 -0.00132 0.00041 0.00195 0.00080 -0.00137
207 10F+3 -0.00170 -0.00098 0.00000 -0.00146 -0.00252
208 10F-3 0.00266 -0.00461 -0.00385 -0.00146 0.00084
209 6 H 1S 0.02423 0.00000 -0.00491 0.00000 0.00061
210 2S -0.13127 0.00000 0.03475 0.00000 0.07681
211 3S 3.34547 0.00000 -0.27067 0.00000 -0.88813
212 4S 1.84483 0.00000 -0.33576 0.00000 -2.00600
213 5PX 0.00000 0.01573 0.00000 -0.01379 0.00000
214 5PY 0.00106 0.00000 -0.00479 0.00000 0.00297
215 5PZ -0.02040 0.00000 -0.00688 0.00000 -0.01365
216 6PX 0.00000 -0.06085 0.00000 0.05784 0.00000
217 6PY 0.00659 0.00000 0.02714 0.00000 -0.00975
218 6PZ 0.08383 0.00000 0.03660 0.00000 0.04797
219 7PX 0.00000 0.44393 0.00000 -0.53289 0.00000
220 7PY 1.13309 0.00000 -0.09250 0.00000 -0.40361
221 7PZ -0.10676 0.00000 -0.42070 0.00000 -0.24200
222 8D 0 0.00198 0.00000 0.00480 0.00000 -0.00050
223 8D+1 0.00000 0.00208 0.00000 -0.00022 0.00000
224 8D-1 -0.00091 0.00000 0.00427 0.00000 -0.00453
225 8D+2 0.00560 0.00000 -0.00124 0.00000 -0.00504
226 8D-2 0.00000 -0.00131 0.00000 0.00485 0.00000
227 9D 0 -0.03445 0.00000 -0.03162 0.00000 0.01822
228 9D+1 0.00000 -0.01570 0.00000 -0.00245 0.00000
229 9D-1 0.03003 0.00000 -0.02702 0.00000 0.02538
230 9D+2 -0.07525 0.00000 0.00519 0.00000 0.04342
231 9D-2 0.00000 0.00962 0.00000 -0.03371 0.00000
232 10F 0 -0.00164 0.00000 -0.00232 0.00000 0.00057
233 10F+1 0.00000 0.00024 0.00000 0.00039 0.00000
234 10F-1 -0.00754 0.00000 0.00097 0.00000 0.00556
235 10F+2 0.00118 0.00000 -0.00225 0.00000 -0.00159
236 10F-2 0.00000 -0.00187 0.00000 0.00158 0.00000
237 10F+3 0.00000 0.00196 0.00000 -0.00291 0.00000
238 10F-3 -0.00532 0.00000 0.00385 0.00000 0.00168
239 7 H 1S -0.01211 0.02098 -0.00491 0.00053 -0.00030
240 2S 0.06563 -0.11368 0.03475 0.06652 -0.03840
241 3S -1.67273 2.89726 -0.27067 -0.76914 0.44406
242 4S -0.92241 1.59767 -0.33576 -1.73725 1.00300
243 5PX 0.00635 0.00473 -0.00415 -0.00122 -0.00726
244 5PY 0.01206 0.00635 0.00239 -0.00726 -0.00960
245 5PZ 0.01020 -0.01766 -0.00688 -0.01182 0.00682
246 6PX -0.02920 -0.01027 0.02350 0.00714 0.02927
247 6PY -0.04399 -0.02920 -0.01357 0.02927 0.04094
248 6PZ -0.04192 0.07260 0.03660 0.04154 -0.02398
249 7PX -0.29842 0.96080 -0.08011 -0.43593 -0.05598
250 7PY 0.61622 -0.29842 0.04625 -0.05598 -0.50057
251 7PZ 0.05338 -0.09246 -0.42070 -0.20958 0.12100
252 8D 0 -0.00099 0.00171 0.00480 -0.00043 0.00025
253 8D+1 0.00130 -0.00017 0.00370 -0.00345 0.00187
254 8D-1 0.00133 0.00130 -0.00213 0.00187 -0.00130
255 8D+2 0.00042 -0.00299 0.00062 0.00428 0.00238
256 8D-2 -0.00299 0.00387 -0.00107 -0.00257 0.00428
257 9D 0 0.01723 -0.02984 -0.03162 0.01578 -0.00911
258 9D+1 -0.01980 0.01860 -0.02340 0.01842 -0.01205
259 9D-1 -0.00426 -0.01980 0.01351 -0.01205 0.00451
260 9D+2 -0.01160 0.03675 -0.00260 -0.03340 -0.01443
261 9D-2 0.03675 -0.05403 0.00450 0.02414 -0.03340
262 10F 0 0.00082 -0.00142 -0.00232 0.00050 -0.00029
263 10F+1 0.00337 -0.00560 0.00084 0.00427 -0.00224
264 10F-1 -0.00171 0.00337 -0.00049 -0.00224 0.00169
265 10F+2 -0.00111 -0.00132 0.00112 0.00137 0.00079
266 10F-2 -0.00132 0.00041 -0.00195 -0.00080 0.00137
267 10F+3 -0.00170 -0.00098 0.00000 0.00146 0.00252
268 10F-3 0.00266 -0.00461 0.00385 0.00146 -0.00084
269 8 H 1S -0.01211 -0.02098 -0.00491 -0.00053 -0.00030
270 2S 0.06563 0.11368 0.03475 -0.06652 -0.03840
271 3S -1.67273 -2.89726 -0.27067 0.76914 0.44406
272 4S -0.92241 -1.59767 -0.33576 1.73725 1.00300
273 5PX -0.00635 0.00473 0.00415 -0.00122 0.00726
274 5PY 0.01206 -0.00635 0.00239 0.00726 -0.00960
275 5PZ 0.01020 0.01766 -0.00688 0.01182 0.00682
276 6PX 0.02920 -0.01027 -0.02350 0.00714 -0.02927
277 6PY -0.04399 0.02920 -0.01357 -0.02927 0.04094
278 6PZ -0.04192 -0.07260 0.03660 -0.04154 -0.02398
279 7PX 0.29842 0.96080 0.08011 -0.43593 0.05598
280 7PY 0.61622 0.29842 0.04625 0.05598 -0.50057
281 7PZ 0.05338 0.09246 -0.42070 0.20958 0.12100
282 8D 0 -0.00099 -0.00171 0.00480 0.00043 0.00025
283 8D+1 -0.00130 -0.00017 -0.00370 -0.00345 -0.00187
284 8D-1 0.00133 -0.00130 -0.00213 -0.00187 -0.00130
285 8D+2 0.00042 0.00299 0.00062 -0.00428 0.00238
286 8D-2 0.00299 0.00387 0.00107 -0.00257 -0.00428
287 9D 0 0.01723 0.02984 -0.03162 -0.01578 -0.00911
288 9D+1 0.01980 0.01860 0.02340 0.01842 0.01205
289 9D-1 -0.00426 0.01980 0.01351 0.01205 0.00451
290 9D+2 -0.01160 -0.03675 -0.00260 0.03340 -0.01443
291 9D-2 -0.03675 -0.05403 -0.00450 0.02414 0.03340
292 10F 0 0.00082 0.00142 -0.00232 -0.00050 -0.00029
293 10F+1 -0.00337 -0.00560 -0.00084 0.00427 0.00224
294 10F-1 -0.00171 -0.00337 -0.00049 0.00224 0.00169
295 10F+2 -0.00111 0.00132 0.00112 -0.00137 0.00079
296 10F-2 0.00132 0.00041 0.00195 -0.00080 -0.00137
297 10F+3 0.00170 -0.00098 0.00000 0.00146 -0.00252
298 10F-3 0.00266 0.00461 0.00385 -0.00146 -0.00084
66 67 68 69 70
(A1G)--V (A2U)--V (A1U)--V (EU)--V (EU)--V
Eigenvalues -- 0.93451 0.95463 0.95516 0.97238 0.97238
1 1 Si 1S 0.02446 0.00976 0.00000 0.00000 0.00000
2 2S -0.04092 -0.06601 0.00000 0.00000 0.00000
3 3S 0.16837 -0.01506 0.00000 0.00000 0.00000
4 4S -0.47117 -2.71241 0.00000 0.00000 0.00000
5 5S 2.04125 6.57880 0.00000 0.00000 0.00000
6 6S 3.06986 6.97253 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 0.00000 0.11517
8 7PY 0.00000 0.00000 0.00000 0.11517 0.00000
9 7PZ -0.05177 -0.00465 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 0.00000 0.01669
11 8PY 0.00000 0.00000 0.00000 0.01669 0.00000
12 8PZ -0.02676 -0.02488 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 -0.59723
14 9PY 0.00000 0.00000 0.00000 -0.59723 0.00000
15 9PZ 0.05399 0.16489 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 3.02447
17 10PY 0.00000 0.00000 0.00000 3.02447 0.00000
18 10PZ 1.48417 -1.12313 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 -0.80969
20 11PY 0.00000 0.00000 0.00000 -0.80969 0.00000
21 11PZ 0.59773 -1.47668 0.00000 0.00000 0.00000
22 12D 0 -0.71195 0.52945 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.26034
24 12D-1 0.00000 0.00000 0.00000 0.26034 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.35121 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.35121
27 13D 0 -0.04011 -0.11342 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.70125
29 13D-1 0.00000 0.00000 0.00000 0.70125 0.00000
30 13D+2 0.00000 0.00000 0.00000 -0.87271 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 -0.87271
32 14D 0 0.05260 -0.04578 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 0.00000 -0.00514
34 14D-1 0.00000 0.00000 0.00000 -0.00514 0.00000
35 14D+2 0.00000 0.00000 0.00000 -0.00441 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 -0.00441
37 15F 0 -0.66023 -1.80790 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.00000 0.00000 0.00000 -0.35037
39 15F-1 0.00000 0.00000 0.00000 -0.35037 0.00000
40 15F+2 0.00000 0.00000 0.00000 0.13761 0.00000
41 15F-2 0.00000 0.00000 0.00000 0.00000 0.13761
42 15F+3 0.00000 0.00000 1.44173 0.00000 0.00000
43 15F-3 -1.24951 -1.53339 0.00000 0.00000 0.00000
44 16F 0 0.00477 -0.00467 0.00000 0.00000 0.00000
45 16F+1 0.00000 0.00000 0.00000 0.00000 -0.03457
46 16F-1 0.00000 0.00000 0.00000 -0.03457 0.00000
47 16F+2 0.00000 0.00000 0.00000 -0.08899 0.00000
48 16F-2 0.00000 0.00000 0.00000 0.00000 -0.08899
49 16F+3 0.00000 0.00000 -0.02237 0.00000 0.00000
50 16F-3 0.03329 -0.04817 0.00000 0.00000 0.00000
51 17G 0 0.00127 0.07872 0.00000 0.00000 0.00000
52 17G+1 0.00000 0.00000 0.00000 0.00000 -0.06687
53 17G-1 0.00000 0.00000 0.00000 -0.06687 0.00000
54 17G+2 0.00000 0.00000 0.00000 0.03714 0.00000
55 17G-2 0.00000 0.00000 0.00000 0.00000 0.03714
56 17G+3 0.00000 0.00000 0.15873 0.00000 0.00000
57 17G-3 -0.10692 -0.16670 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.00000 0.13716 0.00000
59 17G-4 0.00000 0.00000 0.00000 0.00000 -0.13716
60 2 Si 1S 0.02446 -0.00976 0.00000 0.00000 0.00000
61 2S -0.04092 0.06601 0.00000 0.00000 0.00000
62 3S 0.16837 0.01506 0.00000 0.00000 0.00000
63 4S -0.47117 2.71241 0.00000 0.00000 0.00000
64 5S 2.04125 -6.57880 0.00000 0.00000 0.00000
65 6S 3.06986 -6.97253 0.00000 0.00000 0.00000
66 7PX 0.00000 0.00000 0.00000 0.00000 0.11517
67 7PY 0.00000 0.00000 0.00000 0.11517 0.00000
68 7PZ 0.05177 -0.00465 0.00000 0.00000 0.00000
69 8PX 0.00000 0.00000 0.00000 0.00000 0.01669
70 8PY 0.00000 0.00000 0.00000 0.01669 0.00000
71 8PZ 0.02676 -0.02488 0.00000 0.00000 0.00000
72 9PX 0.00000 0.00000 0.00000 0.00000 -0.59723
73 9PY 0.00000 0.00000 0.00000 -0.59723 0.00000
74 9PZ -0.05399 0.16489 0.00000 0.00000 0.00000
75 10PX 0.00000 0.00000 0.00000 0.00000 3.02447
76 10PY 0.00000 0.00000 0.00000 3.02447 0.00000
77 10PZ -1.48417 -1.12313 0.00000 0.00000 0.00000
78 11PX 0.00000 0.00000 0.00000 0.00000 -0.80969
79 11PY 0.00000 0.00000 0.00000 -0.80969 0.00000
80 11PZ -0.59773 -1.47668 0.00000 0.00000 0.00000
81 12D 0 -0.71195 -0.52945 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.00000 0.00000 0.00000 -0.26034
83 12D-1 0.00000 0.00000 0.00000 -0.26034 0.00000
84 12D+2 0.00000 0.00000 0.00000 -0.35121 0.00000
85 12D-2 0.00000 0.00000 0.00000 0.00000 -0.35121
86 13D 0 -0.04011 0.11342 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.00000 0.00000 0.00000 -0.70125
88 13D-1 0.00000 0.00000 0.00000 -0.70125 0.00000
89 13D+2 0.00000 0.00000 0.00000 0.87271 0.00000
90 13D-2 0.00000 0.00000 0.00000 0.00000 0.87271
91 14D 0 0.05260 0.04578 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.00000 0.00000 0.00000 0.00514
93 14D-1 0.00000 0.00000 0.00000 0.00514 0.00000
94 14D+2 0.00000 0.00000 0.00000 0.00441 0.00000
95 14D-2 0.00000 0.00000 0.00000 0.00000 0.00441
96 15F 0 0.66023 -1.80790 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.00000 0.00000 0.00000 -0.35037
98 15F-1 0.00000 0.00000 0.00000 -0.35037 0.00000
99 15F+2 0.00000 0.00000 0.00000 0.13761 0.00000
100 15F-2 0.00000 0.00000 0.00000 0.00000 0.13761
101 15F+3 0.00000 0.00000 1.44173 0.00000 0.00000
102 15F-3 1.24951 -1.53339 0.00000 0.00000 0.00000
103 16F 0 -0.00477 -0.00467 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.00000 0.00000 0.00000 -0.03457
105 16F-1 0.00000 0.00000 0.00000 -0.03457 0.00000
106 16F+2 0.00000 0.00000 0.00000 -0.08899 0.00000
107 16F-2 0.00000 0.00000 0.00000 0.00000 -0.08899
108 16F+3 0.00000 0.00000 -0.02237 0.00000 0.00000
109 16F-3 -0.03329 -0.04817 0.00000 0.00000 0.00000
110 17G 0 0.00127 -0.07872 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.00000 0.00000 0.00000 0.06687
112 17G-1 0.00000 0.00000 0.00000 0.06687 0.00000
113 17G+2 0.00000 0.00000 0.00000 -0.03714 0.00000
114 17G-2 0.00000 0.00000 0.00000 0.00000 -0.03714
115 17G+3 0.00000 0.00000 -0.15873 0.00000 0.00000
116 17G-3 -0.10692 0.16670 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.00000 -0.13716 0.00000
118 17G-4 0.00000 0.00000 0.00000 0.00000 0.13716
119 3 H 1S 0.00315 0.00277 0.00000 -0.00619 0.00000
120 2S 0.09795 0.03602 0.00000 0.03525 0.00000
121 3S -1.84686 -2.94638 0.00000 -2.07078 0.00000
122 4S -0.72608 -0.40834 0.00000 0.79050 0.00000
123 5PX 0.00000 0.00000 0.01341 0.00000 -0.01749
124 5PY -0.00302 -0.02122 0.00000 -0.03006 0.00000
125 5PZ -0.01768 0.00028 0.00000 -0.01663 0.00000
126 6PX 0.00000 0.00000 -0.06972 0.00000 0.07358
127 6PY 0.02419 0.11220 0.00000 0.15122 0.00000
128 6PZ 0.07260 0.00578 0.00000 0.07608 0.00000
129 7PX 0.00000 0.00000 1.03520 0.00000 -0.71605
130 7PY 0.44277 0.57479 0.00000 0.35952 0.00000
131 7PZ -0.15404 0.42973 0.00000 0.24370 0.00000
132 8D 0 0.00273 0.00004 0.00000 -0.00091 0.00000
133 8D+1 0.00000 0.00000 0.00513 0.00000 -0.00534
134 8D-1 -0.00061 0.00136 0.00000 0.00806 0.00000
135 8D+2 0.00165 -0.00088 0.00000 -0.00438 0.00000
136 8D-2 0.00000 0.00000 0.01503 0.00000 -0.00707
137 9D 0 -0.00861 0.01452 0.00000 0.01836 0.00000
138 9D+1 0.00000 0.00000 -0.03889 0.00000 0.04139
139 9D-1 -0.00363 -0.03348 0.00000 -0.10110 0.00000
140 9D+2 0.00287 0.04158 0.00000 0.07930 0.00000
141 9D-2 0.00000 0.00000 -0.12416 0.00000 0.06183
142 10F 0 0.00290 -0.00143 0.00000 -0.00061 0.00000
143 10F+1 0.00000 0.00000 -0.00243 0.00000 0.00008
144 10F-1 -0.00334 0.00060 0.00000 0.00160 0.00000
145 10F+2 0.00217 -0.00185 0.00000 -0.00385 0.00000
146 10F-2 0.00000 0.00000 0.00455 0.00000 -0.00299
147 10F+3 0.00000 0.00000 -0.00919 0.00000 0.00379
148 10F-3 -0.00222 -0.00144 0.00000 -0.00156 0.00000
149 4 H 1S 0.00315 0.00277 0.00000 0.00309 0.00536
150 2S 0.09795 0.03602 0.00000 -0.01763 -0.03053
151 3S -1.84686 -2.94638 0.00000 1.03539 1.79335
152 4S -0.72608 -0.40834 0.00000 -0.39525 -0.68459
153 5PX 0.00262 0.01838 -0.00671 -0.00544 -0.02692
154 5PY 0.00151 0.01061 0.01161 -0.02063 -0.00544
155 5PZ -0.01768 0.00028 0.00000 0.00831 0.01440
156 6PX -0.02095 -0.09717 0.03486 0.03362 0.13181
157 6PY -0.01210 -0.05610 -0.06038 0.09299 0.03362
158 6PZ 0.07260 0.00578 0.00000 -0.03804 -0.06589
159 7PX -0.38345 -0.49778 -0.51760 0.46574 0.09063
160 7PY -0.22139 -0.28739 0.89651 -0.44716 0.46574
161 7PZ -0.15404 0.42973 0.00000 -0.12185 -0.21105
162 8D 0 0.00273 0.00004 0.00000 0.00046 0.00079
163 8D+1 0.00053 -0.00117 -0.00256 0.00580 0.00471
164 8D-1 0.00031 -0.00068 0.00444 -0.00199 0.00580
165 8D+2 -0.00083 0.00044 0.01302 -0.00640 0.00116
166 8D-2 -0.00143 0.00077 -0.00752 0.00116 -0.00505
167 9D 0 -0.00861 0.01452 0.00000 -0.00918 -0.01590
168 9D+1 0.00314 0.02900 0.01945 -0.06170 -0.06548
169 9D-1 0.00181 0.01674 -0.03368 0.00577 -0.06170
170 9D+2 -0.00144 -0.02079 -0.10753 0.06620 0.00756
171 9D-2 -0.00249 -0.03601 0.06208 0.00756 0.07493
172 10F 0 0.00290 -0.00143 0.00000 0.00030 0.00052
173 10F+1 0.00289 -0.00052 0.00122 0.00066 0.00122
174 10F-1 0.00167 -0.00030 -0.00211 0.00046 0.00066
175 10F+2 -0.00108 0.00092 0.00394 -0.00321 -0.00037
176 10F-2 -0.00188 0.00160 -0.00228 -0.00037 -0.00364
177 10F+3 0.00000 0.00000 -0.00919 0.00328 -0.00189
178 10F-3 -0.00222 -0.00144 0.00000 0.00078 0.00135
179 5 H 1S 0.00315 0.00277 0.00000 0.00309 -0.00536
180 2S 0.09795 0.03602 0.00000 -0.01763 0.03053
181 3S -1.84686 -2.94638 0.00000 1.03539 -1.79335
182 4S -0.72608 -0.40834 0.00000 -0.39525 0.68459
183 5PX -0.00262 -0.01838 -0.00671 0.00544 -0.02692
184 5PY 0.00151 0.01061 -0.01161 -0.02063 0.00544
185 5PZ -0.01768 0.00028 0.00000 0.00831 -0.01440
186 6PX 0.02095 0.09717 0.03486 -0.03362 0.13181
187 6PY -0.01210 -0.05610 0.06038 0.09299 -0.03362
188 6PZ 0.07260 0.00578 0.00000 -0.03804 0.06589
189 7PX 0.38345 0.49778 -0.51760 -0.46574 0.09063
190 7PY -0.22139 -0.28739 -0.89651 -0.44716 -0.46574
191 7PZ -0.15404 0.42973 0.00000 -0.12185 0.21105
192 8D 0 0.00273 0.00004 0.00000 0.00046 -0.00079
193 8D+1 -0.00053 0.00117 -0.00256 -0.00580 0.00471
194 8D-1 0.00031 -0.00068 -0.00444 -0.00199 -0.00580
195 8D+2 -0.00083 0.00044 -0.01302 -0.00640 -0.00116
196 8D-2 0.00143 -0.00077 -0.00752 -0.00116 -0.00505
197 9D 0 -0.00861 0.01452 0.00000 -0.00918 0.01590
198 9D+1 -0.00314 -0.02900 0.01945 0.06170 -0.06548
199 9D-1 0.00181 0.01674 0.03368 0.00577 0.06170
200 9D+2 -0.00144 -0.02079 0.10753 0.06620 -0.00756
201 9D-2 0.00249 0.03601 0.06208 -0.00756 0.07493
202 10F 0 0.00290 -0.00143 0.00000 0.00030 -0.00052
203 10F+1 -0.00289 0.00052 0.00122 -0.00066 0.00122
204 10F-1 0.00167 -0.00030 0.00211 0.00046 -0.00066
205 10F+2 -0.00108 0.00092 -0.00394 -0.00321 0.00037
206 10F-2 0.00188 -0.00160 -0.00228 0.00037 -0.00364
207 10F+3 0.00000 0.00000 -0.00919 -0.00328 -0.00189
208 10F-3 -0.00222 -0.00144 0.00000 0.00078 -0.00135
209 6 H 1S 0.00315 -0.00277 0.00000 0.00619 0.00000
210 2S 0.09795 -0.03602 0.00000 -0.03525 0.00000
211 3S -1.84686 2.94638 0.00000 2.07078 0.00000
212 4S -0.72608 0.40834 0.00000 -0.79050 0.00000
213 5PX 0.00000 0.00000 0.01341 0.00000 -0.01749
214 5PY 0.00302 -0.02122 0.00000 -0.03006 0.00000
215 5PZ 0.01768 0.00028 0.00000 -0.01663 0.00000
216 6PX 0.00000 0.00000 -0.06972 0.00000 0.07358
217 6PY -0.02419 0.11220 0.00000 0.15122 0.00000
218 6PZ -0.07260 0.00578 0.00000 0.07608 0.00000
219 7PX 0.00000 0.00000 1.03520 0.00000 -0.71605
220 7PY -0.44277 0.57479 0.00000 0.35952 0.00000
221 7PZ 0.15404 0.42973 0.00000 0.24370 0.00000
222 8D 0 0.00273 -0.00004 0.00000 0.00091 0.00000
223 8D+1 0.00000 0.00000 -0.00513 0.00000 0.00534
224 8D-1 -0.00061 -0.00136 0.00000 -0.00806 0.00000
225 8D+2 0.00165 0.00088 0.00000 0.00438 0.00000
226 8D-2 0.00000 0.00000 -0.01503 0.00000 0.00707
227 9D 0 -0.00861 -0.01452 0.00000 -0.01836 0.00000
228 9D+1 0.00000 0.00000 0.03889 0.00000 -0.04139
229 9D-1 -0.00363 0.03348 0.00000 0.10110 0.00000
230 9D+2 0.00287 -0.04158 0.00000 -0.07930 0.00000
231 9D-2 0.00000 0.00000 0.12416 0.00000 -0.06183
232 10F 0 -0.00290 -0.00143 0.00000 -0.00061 0.00000
233 10F+1 0.00000 0.00000 -0.00243 0.00000 0.00008
234 10F-1 0.00334 0.00060 0.00000 0.00160 0.00000
235 10F+2 -0.00217 -0.00185 0.00000 -0.00385 0.00000
236 10F-2 0.00000 0.00000 0.00455 0.00000 -0.00299
237 10F+3 0.00000 0.00000 -0.00919 0.00000 0.00379
238 10F-3 0.00222 -0.00144 0.00000 -0.00156 0.00000
239 7 H 1S 0.00315 -0.00277 0.00000 -0.00309 0.00536
240 2S 0.09795 -0.03602 0.00000 0.01763 -0.03053
241 3S -1.84686 2.94638 0.00000 -1.03539 1.79335
242 4S -0.72608 0.40834 0.00000 0.39525 -0.68459
243 5PX 0.00262 -0.01838 -0.00671 0.00544 -0.02692
244 5PY -0.00151 0.01061 -0.01161 -0.02063 0.00544
245 5PZ 0.01768 0.00028 0.00000 0.00831 -0.01440
246 6PX -0.02095 0.09717 0.03486 -0.03362 0.13181
247 6PY 0.01210 -0.05610 0.06038 0.09299 -0.03362
248 6PZ -0.07260 0.00578 0.00000 -0.03804 0.06589
249 7PX -0.38345 0.49778 -0.51760 -0.46574 0.09063
250 7PY 0.22139 -0.28739 -0.89651 -0.44716 -0.46574
251 7PZ 0.15404 0.42973 0.00000 -0.12185 0.21105
252 8D 0 0.00273 -0.00004 0.00000 -0.00046 0.00079
253 8D+1 -0.00053 -0.00117 0.00256 0.00580 -0.00471
254 8D-1 0.00031 0.00068 0.00444 0.00199 0.00580
255 8D+2 -0.00083 -0.00044 0.01302 0.00640 0.00116
256 8D-2 0.00143 0.00077 0.00752 0.00116 0.00505
257 9D 0 -0.00861 -0.01452 0.00000 0.00918 -0.01590
258 9D+1 -0.00314 0.02900 -0.01945 -0.06170 0.06548
259 9D-1 0.00181 -0.01674 -0.03368 -0.00577 -0.06170
260 9D+2 -0.00144 0.02079 -0.10753 -0.06620 0.00756
261 9D-2 0.00249 -0.03601 -0.06208 0.00756 -0.07493
262 10F 0 -0.00290 -0.00143 0.00000 0.00030 -0.00052
263 10F+1 0.00289 0.00052 0.00122 -0.00066 0.00122
264 10F-1 -0.00167 -0.00030 0.00211 0.00046 -0.00066
265 10F+2 0.00108 0.00092 -0.00394 -0.00321 0.00037
266 10F-2 -0.00188 -0.00160 -0.00228 0.00037 -0.00364
267 10F+3 0.00000 0.00000 -0.00919 -0.00328 -0.00189
268 10F-3 0.00222 -0.00144 0.00000 0.00078 -0.00135
269 8 H 1S 0.00315 -0.00277 0.00000 -0.00309 -0.00536
270 2S 0.09795 -0.03602 0.00000 0.01763 0.03053
271 3S -1.84686 2.94638 0.00000 -1.03539 -1.79335
272 4S -0.72608 0.40834 0.00000 0.39525 0.68459
273 5PX -0.00262 0.01838 -0.00671 -0.00544 -0.02692
274 5PY -0.00151 0.01061 0.01161 -0.02063 -0.00544
275 5PZ 0.01768 0.00028 0.00000 0.00831 0.01440
276 6PX 0.02095 -0.09717 0.03486 0.03362 0.13181
277 6PY 0.01210 -0.05610 -0.06038 0.09299 0.03362
278 6PZ -0.07260 0.00578 0.00000 -0.03804 -0.06589
279 7PX 0.38345 -0.49778 -0.51760 0.46574 0.09063
280 7PY 0.22139 -0.28739 0.89651 -0.44716 0.46574
281 7PZ 0.15404 0.42973 0.00000 -0.12185 -0.21105
282 8D 0 0.00273 -0.00004 0.00000 -0.00046 -0.00079
283 8D+1 0.00053 0.00117 0.00256 -0.00580 -0.00471
284 8D-1 0.00031 0.00068 -0.00444 0.00199 -0.00580
285 8D+2 -0.00083 -0.00044 -0.01302 0.00640 -0.00116
286 8D-2 -0.00143 -0.00077 0.00752 -0.00116 0.00505
287 9D 0 -0.00861 -0.01452 0.00000 0.00918 0.01590
288 9D+1 0.00314 -0.02900 -0.01945 0.06170 0.06548
289 9D-1 0.00181 -0.01674 0.03368 -0.00577 0.06170
290 9D+2 -0.00144 0.02079 0.10753 -0.06620 -0.00756
291 9D-2 -0.00249 0.03601 -0.06208 -0.00756 -0.07493
292 10F 0 -0.00290 -0.00143 0.00000 0.00030 0.00052
293 10F+1 -0.00289 -0.00052 0.00122 0.00066 0.00122
294 10F-1 -0.00167 -0.00030 -0.00211 0.00046 0.00066
295 10F+2 0.00108 0.00092 0.00394 -0.00321 -0.00037
296 10F-2 0.00188 0.00160 -0.00228 -0.00037 -0.00364
297 10F+3 0.00000 0.00000 -0.00919 0.00328 -0.00189
298 10F-3 0.00222 -0.00144 0.00000 0.00078 0.00135
71 72 73 74 75
(A2U)--V (EU)--V (EU)--V (EG)--V (EG)--V
Eigenvalues -- 0.97364 1.03265 1.03265 1.05041 1.05041
1 1 Si 1S 0.02442 0.00000 0.00000 0.00000 0.00000
2 2S -0.01098 0.00000 0.00000 0.00000 0.00000
3 3S 0.21245 0.00000 0.00000 0.00000 0.00000
4 4S -0.65957 0.00000 0.00000 0.00000 0.00000
5 5S 4.13095 0.00000 0.00000 0.00000 0.00000
6 6S -2.20486 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 -0.09461 0.00000 0.07704 0.00000
8 7PY 0.00000 0.00000 -0.09461 0.00000 0.07704
9 7PZ 0.12775 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.02190 0.00000 0.00171 0.00000
11 8PY 0.00000 0.00000 -0.02190 0.00000 0.00171
12 8PZ 0.01807 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.17081 0.00000 -0.47628 0.00000
14 9PY 0.00000 0.00000 0.17081 0.00000 -0.47628
15 9PZ -0.68446 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 1.40301 0.00000 3.70329 0.00000
17 10PY 0.00000 0.00000 1.40301 0.00000 3.70329
18 10PZ 5.51270 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.42005 0.00000 0.01693 0.00000
20 11PY 0.00000 0.00000 0.42005 0.00000 0.01693
21 11PZ 2.30329 0.00000 0.00000 0.00000 0.00000
22 12D 0 -3.13887 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.91729 0.00000 -0.82758 0.00000
24 12D-1 0.00000 0.00000 0.91729 0.00000 -0.82758
25 12D+2 0.00000 0.00000 -0.08207 0.00000 0.05305
26 12D-2 0.00000 -0.08207 0.00000 0.05305 0.00000
27 13D 0 -0.55005 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 -0.38047 0.00000 1.06142 0.00000
29 13D-1 0.00000 0.00000 -0.38047 0.00000 1.06142
30 13D+2 0.00000 0.00000 0.23496 0.00000 -0.50225
31 13D-2 0.00000 0.23496 0.00000 -0.50225 0.00000
32 14D 0 0.21616 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.01726 0.00000 0.00375 0.00000
34 14D-1 0.00000 0.00000 0.01726 0.00000 0.00375
35 14D+2 0.00000 0.00000 0.04012 0.00000 0.03394
36 14D-2 0.00000 0.04012 0.00000 0.03394 0.00000
37 15F 0 0.27698 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 -0.63644 0.00000 -0.32017 0.00000
39 15F-1 0.00000 0.00000 -0.63644 0.00000 -0.32017
40 15F+2 0.00000 0.00000 -0.19306 0.00000 0.34600
41 15F-2 0.00000 -0.19306 0.00000 0.34600 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -1.08164 0.00000 0.00000 0.00000 0.00000
44 16F 0 -0.04670 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 0.05128 0.00000 -0.02663 0.00000
46 16F-1 0.00000 0.00000 0.05128 0.00000 -0.02663
47 16F+2 0.00000 0.00000 0.03904 0.00000 -0.08253
48 16F-2 0.00000 0.03904 0.00000 -0.08253 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 -0.07306 0.00000 0.00000 0.00000 0.00000
51 17G 0 -0.05127 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 -0.04187 0.00000 -0.09629 0.00000
53 17G-1 0.00000 0.00000 -0.04187 0.00000 -0.09629
54 17G+2 0.00000 0.00000 0.01437 0.00000 0.05078
55 17G-2 0.00000 0.01437 0.00000 0.05078 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.08440 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.03559 0.00000 0.12874
59 17G-4 0.00000 -0.03559 0.00000 -0.12874 0.00000
60 2 Si 1S -0.02442 0.00000 0.00000 0.00000 0.00000
61 2S 0.01098 0.00000 0.00000 0.00000 0.00000
62 3S -0.21245 0.00000 0.00000 0.00000 0.00000
63 4S 0.65957 0.00000 0.00000 0.00000 0.00000
64 5S -4.13095 0.00000 0.00000 0.00000 0.00000
65 6S 2.20486 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 -0.09461 0.00000 -0.07704 0.00000
67 7PY 0.00000 0.00000 -0.09461 0.00000 -0.07704
68 7PZ 0.12775 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 -0.02190 0.00000 -0.00171 0.00000
70 8PY 0.00000 0.00000 -0.02190 0.00000 -0.00171
71 8PZ 0.01807 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 0.17081 0.00000 0.47628 0.00000
73 9PY 0.00000 0.00000 0.17081 0.00000 0.47628
74 9PZ -0.68446 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 1.40301 0.00000 -3.70329 0.00000
76 10PY 0.00000 0.00000 1.40301 0.00000 -3.70329
77 10PZ 5.51270 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 0.42005 0.00000 -0.01693 0.00000
79 11PY 0.00000 0.00000 0.42005 0.00000 -0.01693
80 11PZ 2.30329 0.00000 0.00000 0.00000 0.00000
81 12D 0 3.13887 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 -0.91729 0.00000 -0.82758 0.00000
83 12D-1 0.00000 0.00000 -0.91729 0.00000 -0.82758
84 12D+2 0.00000 0.00000 0.08207 0.00000 0.05305
85 12D-2 0.00000 0.08207 0.00000 0.05305 0.00000
86 13D 0 0.55005 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.38047 0.00000 1.06142 0.00000
88 13D-1 0.00000 0.00000 0.38047 0.00000 1.06142
89 13D+2 0.00000 0.00000 -0.23496 0.00000 -0.50225
90 13D-2 0.00000 -0.23496 0.00000 -0.50225 0.00000
91 14D 0 -0.21616 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 -0.01726 0.00000 0.00375 0.00000
93 14D-1 0.00000 0.00000 -0.01726 0.00000 0.00375
94 14D+2 0.00000 0.00000 -0.04012 0.00000 0.03394
95 14D-2 0.00000 -0.04012 0.00000 0.03394 0.00000
96 15F 0 0.27698 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 -0.63644 0.00000 0.32017 0.00000
98 15F-1 0.00000 0.00000 -0.63644 0.00000 0.32017
99 15F+2 0.00000 0.00000 -0.19306 0.00000 -0.34600
100 15F-2 0.00000 -0.19306 0.00000 -0.34600 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 -1.08164 0.00000 0.00000 0.00000 0.00000
103 16F 0 -0.04670 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.05128 0.00000 0.02663 0.00000
105 16F-1 0.00000 0.00000 0.05128 0.00000 0.02663
106 16F+2 0.00000 0.00000 0.03904 0.00000 0.08253
107 16F-2 0.00000 0.03904 0.00000 0.08253 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 -0.07306 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.05127 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.04187 0.00000 -0.09629 0.00000
112 17G-1 0.00000 0.00000 0.04187 0.00000 -0.09629
113 17G+2 0.00000 0.00000 -0.01437 0.00000 0.05078
114 17G-2 0.00000 -0.01437 0.00000 0.05078 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.08440 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 -0.03559 0.00000 0.12874
118 17G-4 0.00000 0.03559 0.00000 -0.12874 0.00000
119 3 H 1S -0.01052 0.00000 -0.00572 0.00000 -0.00938
120 2S 0.06169 0.00000 0.03908 0.00000 0.00742
121 3S -2.28131 0.00000 -0.77793 0.00000 -1.90226
122 4S -1.36442 0.00000 -0.67319 0.00000 -0.13381
123 5PX 0.00000 -0.02860 0.00000 -0.02598 0.00000
124 5PY 0.00572 0.00000 0.01013 0.00000 -0.01783
125 5PZ 0.01623 0.00000 -0.00646 0.00000 0.00112
126 6PX 0.00000 0.12709 0.00000 0.12234 0.00000
127 6PY -0.01823 0.00000 -0.03629 0.00000 0.09745
128 6PZ -0.06787 0.00000 0.01536 0.00000 0.00142
129 7PX 0.00000 -0.77173 0.00000 -0.93712 0.00000
130 7PY 1.07254 0.00000 0.21405 0.00000 0.63291
131 7PZ 0.83357 0.00000 0.02033 0.00000 0.80308
132 8D 0 -0.00086 0.00000 0.00740 0.00000 0.00342
133 8D+1 0.00000 -0.00080 0.00000 -0.00454 0.00000
134 8D-1 0.00523 0.00000 0.00079 0.00000 0.01074
135 8D+2 -0.00568 0.00000 0.00214 0.00000 -0.00748
136 8D-2 0.00000 -0.00240 0.00000 -0.00887 0.00000
137 9D 0 0.01871 0.00000 -0.05081 0.00000 -0.00563
138 9D+1 0.00000 0.00475 0.00000 0.03466 0.00000
139 9D-1 -0.05459 0.00000 -0.00847 0.00000 -0.12191
140 9D+2 0.06489 0.00000 -0.01664 0.00000 0.09833
141 9D-2 0.00000 0.01824 0.00000 0.07172 0.00000
142 10F 0 -0.00131 0.00000 -0.00045 0.00000 -0.00192
143 10F+1 0.00000 -0.00070 0.00000 0.00059 0.00000
144 10F-1 -0.00090 0.00000 0.00071 0.00000 -0.00140
145 10F+2 -0.00322 0.00000 -0.00108 0.00000 -0.00555
146 10F-2 0.00000 -0.00462 0.00000 -0.00398 0.00000
147 10F+3 0.00000 0.00579 0.00000 0.00912 0.00000
148 10F-3 -0.00468 0.00000 0.00231 0.00000 -0.00263
149 4 H 1S -0.01052 0.00495 0.00286 0.00812 0.00469
150 2S 0.06169 -0.03385 -0.01954 -0.00642 -0.00371
151 3S -2.28131 0.67371 0.38897 1.64741 0.95113
152 4S -1.36442 0.58300 0.33660 0.11588 0.06690
153 5PX -0.00496 0.00045 0.01677 -0.01987 0.00353
154 5PY -0.00286 0.01677 -0.01892 0.00353 -0.02394
155 5PZ 0.01623 0.00559 0.00323 -0.00097 -0.00056
156 6PX 0.01579 0.00455 -0.07075 0.10367 -0.01077
157 6PY 0.00912 -0.07075 0.08624 -0.01077 0.11611
158 6PZ -0.06787 -0.01330 -0.00768 -0.00123 -0.00071
159 7PX -0.92884 -0.03240 0.42686 0.24040 0.67984
160 7PY -0.53627 0.42686 -0.52529 0.67984 -0.54461
161 7PZ 0.83357 -0.01761 -0.01017 -0.69548 -0.40154
162 8D 0 -0.00086 -0.00640 -0.00370 -0.00296 -0.00171
163 8D+1 -0.00453 0.00040 0.00069 0.00692 0.00662
164 8D-1 -0.00261 0.00069 -0.00040 0.00662 -0.00072
165 8D+2 0.00284 0.00197 -0.00127 0.00061 -0.00853
166 8D-2 0.00492 0.00100 0.00197 -0.00783 0.00061
167 9D 0 0.01871 0.04400 0.02541 0.00487 0.00281
168 9D+1 0.04728 -0.00516 -0.00573 -0.08277 -0.06780
169 9D-1 0.02730 -0.00573 0.00145 -0.06780 -0.00448
170 9D+2 -0.03245 -0.01510 0.00952 0.01152 0.07838
171 9D-2 -0.05620 -0.00792 -0.01510 0.09168 0.01152
172 10F 0 -0.00131 0.00039 0.00023 0.00167 0.00096
173 10F+1 0.00078 0.00036 0.00061 -0.00090 -0.00086
174 10F-1 0.00045 0.00061 -0.00035 -0.00086 0.00009
175 10F+2 0.00161 0.00153 -0.00374 -0.00068 -0.00438
176 10F-2 0.00279 -0.00197 0.00153 -0.00516 -0.00068
177 10F+3 0.00000 -0.00290 0.00502 -0.00456 0.00790
178 10F-3 -0.00468 -0.00200 -0.00115 0.00228 0.00132
179 5 H 1S -0.01052 -0.00495 0.00286 -0.00812 0.00469
180 2S 0.06169 0.03385 -0.01954 0.00642 -0.00371
181 3S -2.28131 -0.67371 0.38897 -1.64741 0.95113
182 4S -1.36442 -0.58300 0.33660 -0.11588 0.06690
183 5PX 0.00496 0.00045 -0.01677 -0.01987 -0.00353
184 5PY -0.00286 -0.01677 -0.01892 -0.00353 -0.02394
185 5PZ 0.01623 -0.00559 0.00323 0.00097 -0.00056
186 6PX -0.01579 0.00455 0.07075 0.10367 0.01077
187 6PY 0.00912 0.07075 0.08624 0.01077 0.11611
188 6PZ -0.06787 0.01330 -0.00768 0.00123 -0.00071
189 7PX 0.92884 -0.03240 -0.42686 0.24040 -0.67984
190 7PY -0.53627 -0.42686 -0.52529 -0.67984 -0.54461
191 7PZ 0.83357 0.01761 -0.01017 0.69548 -0.40154
192 8D 0 -0.00086 0.00640 -0.00370 0.00296 -0.00171
193 8D+1 0.00453 0.00040 -0.00069 0.00692 -0.00662
194 8D-1 -0.00261 -0.00069 -0.00040 -0.00662 -0.00072
195 8D+2 0.00284 -0.00197 -0.00127 -0.00061 -0.00853
196 8D-2 -0.00492 0.00100 -0.00197 -0.00783 -0.00061
197 9D 0 0.01871 -0.04400 0.02541 -0.00487 0.00281
198 9D+1 -0.04728 -0.00516 0.00573 -0.08277 0.06780
199 9D-1 0.02730 0.00573 0.00145 0.06780 -0.00448
200 9D+2 -0.03245 0.01510 0.00952 -0.01152 0.07838
201 9D-2 0.05620 -0.00792 0.01510 0.09168 -0.01152
202 10F 0 -0.00131 -0.00039 0.00023 -0.00167 0.00096
203 10F+1 -0.00078 0.00036 -0.00061 -0.00090 0.00086
204 10F-1 0.00045 -0.00061 -0.00035 0.00086 0.00009
205 10F+2 0.00161 -0.00153 -0.00374 0.00068 -0.00438
206 10F-2 -0.00279 -0.00197 -0.00153 -0.00516 0.00068
207 10F+3 0.00000 -0.00290 -0.00502 -0.00456 -0.00790
208 10F-3 -0.00468 0.00200 -0.00115 -0.00228 0.00132
209 6 H 1S 0.01052 0.00000 0.00572 0.00000 -0.00938
210 2S -0.06169 0.00000 -0.03908 0.00000 0.00742
211 3S 2.28131 0.00000 0.77793 0.00000 -1.90226
212 4S 1.36442 0.00000 0.67319 0.00000 -0.13381
213 5PX 0.00000 -0.02860 0.00000 0.02598 0.00000
214 5PY 0.00572 0.00000 0.01013 0.00000 0.01783
215 5PZ 0.01623 0.00000 -0.00646 0.00000 -0.00112
216 6PX 0.00000 0.12709 0.00000 -0.12234 0.00000
217 6PY -0.01823 0.00000 -0.03629 0.00000 -0.09745
218 6PZ -0.06787 0.00000 0.01536 0.00000 -0.00142
219 7PX 0.00000 -0.77173 0.00000 0.93712 0.00000
220 7PY 1.07254 0.00000 0.21405 0.00000 -0.63291
221 7PZ 0.83357 0.00000 0.02033 0.00000 -0.80308
222 8D 0 0.00086 0.00000 -0.00740 0.00000 0.00342
223 8D+1 0.00000 0.00080 0.00000 -0.00454 0.00000
224 8D-1 -0.00523 0.00000 -0.00079 0.00000 0.01074
225 8D+2 0.00568 0.00000 -0.00214 0.00000 -0.00748
226 8D-2 0.00000 0.00240 0.00000 -0.00887 0.00000
227 9D 0 -0.01871 0.00000 0.05081 0.00000 -0.00563
228 9D+1 0.00000 -0.00475 0.00000 0.03466 0.00000
229 9D-1 0.05459 0.00000 0.00847 0.00000 -0.12191
230 9D+2 -0.06489 0.00000 0.01664 0.00000 0.09833
231 9D-2 0.00000 -0.01824 0.00000 0.07172 0.00000
232 10F 0 -0.00131 0.00000 -0.00045 0.00000 0.00192
233 10F+1 0.00000 -0.00070 0.00000 -0.00059 0.00000
234 10F-1 -0.00090 0.00000 0.00071 0.00000 0.00140
235 10F+2 -0.00322 0.00000 -0.00108 0.00000 0.00555
236 10F-2 0.00000 -0.00462 0.00000 0.00398 0.00000
237 10F+3 0.00000 0.00579 0.00000 -0.00912 0.00000
238 10F-3 -0.00468 0.00000 0.00231 0.00000 0.00263
239 7 H 1S 0.01052 0.00495 -0.00286 -0.00812 0.00469
240 2S -0.06169 -0.03385 0.01954 0.00642 -0.00371
241 3S 2.28131 0.67371 -0.38897 -1.64741 0.95113
242 4S 1.36442 0.58300 -0.33660 -0.11588 0.06690
243 5PX 0.00496 0.00045 -0.01677 0.01987 0.00353
244 5PY -0.00286 -0.01677 -0.01892 0.00353 0.02394
245 5PZ 0.01623 -0.00559 0.00323 -0.00097 0.00056
246 6PX -0.01579 0.00455 0.07075 -0.10367 -0.01077
247 6PY 0.00912 0.07075 0.08624 -0.01077 -0.11611
248 6PZ -0.06787 0.01330 -0.00768 -0.00123 0.00071
249 7PX 0.92884 -0.03240 -0.42686 -0.24040 0.67984
250 7PY -0.53627 -0.42686 -0.52529 0.67984 0.54461
251 7PZ 0.83357 0.01761 -0.01017 -0.69548 0.40154
252 8D 0 0.00086 -0.00640 0.00370 0.00296 -0.00171
253 8D+1 -0.00453 -0.00040 0.00069 0.00692 -0.00662
254 8D-1 0.00261 0.00069 0.00040 -0.00662 -0.00072
255 8D+2 -0.00284 0.00197 0.00127 -0.00061 -0.00853
256 8D-2 0.00492 -0.00100 0.00197 -0.00783 -0.00061
257 9D 0 -0.01871 0.04400 -0.02541 -0.00487 0.00281
258 9D+1 0.04728 0.00516 -0.00573 -0.08277 0.06780
259 9D-1 -0.02730 -0.00573 -0.00145 0.06780 -0.00448
260 9D+2 0.03245 -0.01510 -0.00952 -0.01152 0.07838
261 9D-2 -0.05620 0.00792 -0.01510 0.09168 -0.01152
262 10F 0 -0.00131 -0.00039 0.00023 0.00167 -0.00096
263 10F+1 -0.00078 0.00036 -0.00061 0.00090 -0.00086
264 10F-1 0.00045 -0.00061 -0.00035 -0.00086 -0.00009
265 10F+2 0.00161 -0.00153 -0.00374 -0.00068 0.00438
266 10F-2 -0.00279 -0.00197 -0.00153 0.00516 -0.00068
267 10F+3 0.00000 -0.00290 -0.00502 0.00456 0.00790
268 10F-3 -0.00468 0.00200 -0.00115 0.00228 -0.00132
269 8 H 1S 0.01052 -0.00495 -0.00286 0.00812 0.00469
270 2S -0.06169 0.03385 0.01954 -0.00642 -0.00371
271 3S 2.28131 -0.67371 -0.38897 1.64741 0.95113
272 4S 1.36442 -0.58300 -0.33660 0.11588 0.06690
273 5PX -0.00496 0.00045 0.01677 0.01987 -0.00353
274 5PY -0.00286 0.01677 -0.01892 -0.00353 0.02394
275 5PZ 0.01623 0.00559 0.00323 0.00097 0.00056
276 6PX 0.01579 0.00455 -0.07075 -0.10367 0.01077
277 6PY 0.00912 -0.07075 0.08624 0.01077 -0.11611
278 6PZ -0.06787 -0.01330 -0.00768 0.00123 0.00071
279 7PX -0.92884 -0.03240 0.42686 -0.24040 -0.67984
280 7PY -0.53627 0.42686 -0.52529 -0.67984 0.54461
281 7PZ 0.83357 -0.01761 -0.01017 0.69548 0.40154
282 8D 0 0.00086 0.00640 0.00370 -0.00296 -0.00171
283 8D+1 0.00453 -0.00040 -0.00069 0.00692 0.00662
284 8D-1 0.00261 -0.00069 0.00040 0.00662 -0.00072
285 8D+2 -0.00284 -0.00197 0.00127 0.00061 -0.00853
286 8D-2 -0.00492 -0.00100 -0.00197 -0.00783 0.00061
287 9D 0 -0.01871 -0.04400 -0.02541 0.00487 0.00281
288 9D+1 -0.04728 0.00516 0.00573 -0.08277 -0.06780
289 9D-1 -0.02730 0.00573 -0.00145 -0.06780 -0.00448
290 9D+2 0.03245 0.01510 -0.00952 0.01152 0.07838
291 9D-2 0.05620 0.00792 0.01510 0.09168 0.01152
292 10F 0 -0.00131 0.00039 0.00023 -0.00167 -0.00096
293 10F+1 0.00078 0.00036 0.00061 0.00090 0.00086
294 10F-1 0.00045 0.00061 -0.00035 0.00086 -0.00009
295 10F+2 0.00161 0.00153 -0.00374 0.00068 0.00438
296 10F-2 0.00279 -0.00197 0.00153 0.00516 0.00068
297 10F+3 0.00000 -0.00290 0.00502 0.00456 -0.00790
298 10F-3 -0.00468 -0.00200 -0.00115 -0.00228 -0.00132
76 77 78 79 80
(A1G)--V (EG)--V (EG)--V (EG)--V (EG)--V
Eigenvalues -- 1.05098 1.08105 1.08105 1.19266 1.19266
1 1 Si 1S -0.00108 0.00000 0.00000 0.00000 0.00000
2 2S 0.00241 0.00000 0.00000 0.00000 0.00000
3 3S -0.01066 0.00000 0.00000 0.00000 0.00000
4 4S -1.26311 0.00000 0.00000 0.00000 0.00000
5 5S 4.59439 0.00000 0.00000 0.00000 0.00000
6 6S -0.31224 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 0.04494 0.00000 0.13896 0.00000
8 7PY 0.00000 0.00000 -0.04494 0.00000 -0.13896
9 7PZ 0.01794 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00969 0.00000 0.02680 0.00000
11 8PY 0.00000 0.00000 -0.00969 0.00000 -0.02680
12 8PZ 0.00882 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 -0.24461 0.00000 -0.63385 0.00000
14 9PY 0.00000 0.00000 0.24461 0.00000 0.63385
15 9PZ -0.14447 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.65562 0.00000 0.76191 0.00000
17 10PY 0.00000 0.00000 -0.65562 0.00000 -0.76191
18 10PZ 1.73607 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 -0.78771 0.00000 -0.07663 0.00000
20 11PY 0.00000 0.00000 0.78771 0.00000 0.07663
21 11PZ 0.19084 0.00000 0.00000 0.00000 0.00000
22 12D 0 -0.08336 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.92216 0.00000 1.05854 0.00000
24 12D-1 0.00000 0.00000 -0.92216 0.00000 -1.05854
25 12D+2 0.00000 0.00000 -0.32004 0.00000 1.19203
26 12D-2 0.00000 0.32004 0.00000 -1.19203 0.00000
27 13D 0 0.07083 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.30675 0.00000 0.29592 0.00000
29 13D-1 0.00000 0.00000 -0.30675 0.00000 -0.29592
30 13D+2 0.00000 0.00000 0.12567 0.00000 0.50376
31 13D-2 0.00000 -0.12567 0.00000 -0.50376 0.00000
32 14D 0 -0.00810 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.03967 0.00000 -0.01227 0.00000
34 14D-1 0.00000 0.00000 -0.03967 0.00000 0.01227
35 14D+2 0.00000 0.00000 0.02678 0.00000 -0.01639
36 14D-2 0.00000 -0.02678 0.00000 0.01639 0.00000
37 15F 0 0.01782 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.90134 0.00000 -1.23187 0.00000
39 15F-1 0.00000 0.00000 -0.90134 0.00000 1.23187
40 15F+2 0.00000 0.00000 0.57959 0.00000 0.72233
41 15F-2 0.00000 -0.57959 0.00000 -0.72233 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.39597 0.00000 0.00000 0.00000 0.00000
44 16F 0 -0.08768 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 -0.03088 0.00000 0.06116 0.00000
46 16F-1 0.00000 0.00000 0.03088 0.00000 -0.06116
47 16F+2 0.00000 0.00000 0.02926 0.00000 0.00797
48 16F-2 0.00000 -0.02926 0.00000 -0.00797 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 -0.10928 0.00000 0.00000 0.00000 0.00000
51 17G 0 -0.05435 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 -0.07517 0.00000 -0.03400 0.00000
53 17G-1 0.00000 0.00000 0.07517 0.00000 0.03400
54 17G+2 0.00000 0.00000 0.07736 0.00000 -0.02851
55 17G-2 0.00000 -0.07736 0.00000 0.02851 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.02557 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.00149 0.00000 -0.06827
59 17G-4 0.00000 0.00149 0.00000 -0.06827 0.00000
60 2 Si 1S -0.00108 0.00000 0.00000 0.00000 0.00000
61 2S 0.00241 0.00000 0.00000 0.00000 0.00000
62 3S -0.01066 0.00000 0.00000 0.00000 0.00000
63 4S -1.26311 0.00000 0.00000 0.00000 0.00000
64 5S 4.59439 0.00000 0.00000 0.00000 0.00000
65 6S -0.31224 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 -0.04494 0.00000 -0.13896 0.00000
67 7PY 0.00000 0.00000 0.04494 0.00000 0.13896
68 7PZ -0.01794 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 -0.00969 0.00000 -0.02680 0.00000
70 8PY 0.00000 0.00000 0.00969 0.00000 0.02680
71 8PZ -0.00882 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 0.24461 0.00000 0.63385 0.00000
73 9PY 0.00000 0.00000 -0.24461 0.00000 -0.63385
74 9PZ 0.14447 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 -0.65562 0.00000 -0.76191 0.00000
76 10PY 0.00000 0.00000 0.65562 0.00000 0.76191
77 10PZ -1.73607 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 0.78771 0.00000 0.07663 0.00000
79 11PY 0.00000 0.00000 -0.78771 0.00000 -0.07663
80 11PZ -0.19084 0.00000 0.00000 0.00000 0.00000
81 12D 0 -0.08336 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.92216 0.00000 1.05854 0.00000
83 12D-1 0.00000 0.00000 -0.92216 0.00000 -1.05854
84 12D+2 0.00000 0.00000 -0.32004 0.00000 1.19203
85 12D-2 0.00000 0.32004 0.00000 -1.19203 0.00000
86 13D 0 0.07083 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.30675 0.00000 0.29592 0.00000
88 13D-1 0.00000 0.00000 -0.30675 0.00000 -0.29592
89 13D+2 0.00000 0.00000 0.12567 0.00000 0.50376
90 13D-2 0.00000 -0.12567 0.00000 -0.50376 0.00000
91 14D 0 -0.00810 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.03967 0.00000 -0.01227 0.00000
93 14D-1 0.00000 0.00000 -0.03967 0.00000 0.01227
94 14D+2 0.00000 0.00000 0.02678 0.00000 -0.01639
95 14D-2 0.00000 -0.02678 0.00000 0.01639 0.00000
96 15F 0 -0.01782 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 -0.90134 0.00000 1.23187 0.00000
98 15F-1 0.00000 0.00000 0.90134 0.00000 -1.23187
99 15F+2 0.00000 0.00000 -0.57959 0.00000 -0.72233
100 15F-2 0.00000 0.57959 0.00000 0.72233 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 -0.39597 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.08768 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.03088 0.00000 -0.06116 0.00000
105 16F-1 0.00000 0.00000 -0.03088 0.00000 0.06116
106 16F+2 0.00000 0.00000 -0.02926 0.00000 -0.00797
107 16F-2 0.00000 0.02926 0.00000 0.00797 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.10928 0.00000 0.00000 0.00000 0.00000
110 17G 0 -0.05435 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 -0.07517 0.00000 -0.03400 0.00000
112 17G-1 0.00000 0.00000 0.07517 0.00000 0.03400
113 17G+2 0.00000 0.00000 0.07736 0.00000 -0.02851
114 17G-2 0.00000 -0.07736 0.00000 0.02851 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 -0.02557 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.00149 0.00000 -0.06827
118 17G-4 0.00000 0.00149 0.00000 -0.06827 0.00000
119 3 H 1S -0.01925 0.00000 -0.00132 0.00000 -0.01488
120 2S -0.01450 0.00000 -0.10839 0.00000 -0.14516
121 3S -0.81614 0.00000 0.91667 0.00000 1.91842
122 4S -0.33567 0.00000 -0.71503 0.00000 -0.04812
123 5PX 0.00000 -0.01130 0.00000 0.02423 0.00000
124 5PY 0.01957 0.00000 0.00787 0.00000 0.03910
125 5PZ -0.01638 0.00000 0.03799 0.00000 0.01076
126 6PX 0.00000 0.04118 0.00000 -0.11891 0.00000
127 6PY -0.09811 0.00000 -0.03035 0.00000 -0.20242
128 6PZ 0.06745 0.00000 -0.17713 0.00000 -0.05600
129 7PX 0.00000 -0.25430 0.00000 0.68863 0.00000
130 7PY 1.07248 0.00000 -0.34371 0.00000 0.48992
131 7PZ -0.36486 0.00000 1.34921 0.00000 -0.26117
132 8D 0 -0.00602 0.00000 0.00422 0.00000 -0.00333
133 8D+1 0.00000 -0.00136 0.00000 -0.00176 0.00000
134 8D-1 0.00215 0.00000 0.00917 0.00000 -0.00414
135 8D+2 -0.00915 0.00000 0.00542 0.00000 -0.00403
136 8D-2 0.00000 0.00149 0.00000 0.00192 0.00000
137 9D 0 0.04997 0.00000 -0.04540 0.00000 0.01891
138 9D+1 0.00000 0.01248 0.00000 0.01343 0.00000
139 9D-1 -0.02535 0.00000 -0.06041 0.00000 0.05174
140 9D+2 0.08240 0.00000 -0.05330 0.00000 0.00535
141 9D-2 0.00000 -0.00977 0.00000 0.00106 0.00000
142 10F 0 -0.00196 0.00000 -0.00263 0.00000 -0.00168
143 10F+1 0.00000 -0.00007 0.00000 -0.00258 0.00000
144 10F-1 -0.00729 0.00000 0.00853 0.00000 -0.00250
145 10F+2 -0.00271 0.00000 -0.00445 0.00000 -0.00348
146 10F-2 0.00000 -0.00282 0.00000 -0.00280 0.00000
147 10F+3 0.00000 0.00025 0.00000 -0.00296 0.00000
148 10F-3 -0.00574 0.00000 0.00273 0.00000 -0.00593
149 4 H 1S -0.01925 -0.00114 0.00066 -0.01289 0.00744
150 2S -0.01450 -0.09387 0.05419 -0.12571 0.07258
151 3S -0.81614 0.79386 -0.45833 1.66140 -0.95921
152 4S -0.33567 -0.61923 0.35751 -0.04167 0.02406
153 5PX -0.01694 -0.00873 -0.00148 -0.02327 0.02742
154 5PY -0.00978 0.00148 0.01044 -0.02742 -0.00840
155 5PZ -0.01638 0.03290 -0.01900 0.00932 -0.00538
156 6PX 0.08497 0.03306 0.00469 0.12209 -0.13914
157 6PY 0.04906 -0.00469 -0.03847 0.13914 0.03858
158 6PZ 0.06745 -0.15340 0.08856 -0.04849 0.02800
159 7PX -0.92879 0.19421 -0.25895 -0.19528 0.51033
160 7PY -0.53624 0.25895 0.10479 -0.51033 -0.39399
161 7PZ -0.36486 1.16845 -0.67460 -0.22618 0.13058
162 8D 0 -0.00602 0.00366 -0.00211 -0.00288 0.00167
163 8D+1 -0.00186 -0.00722 0.00338 0.00266 -0.00255
164 8D-1 -0.00108 -0.00338 0.00331 0.00255 0.00029
165 8D+2 0.00457 -0.00299 0.00024 0.00091 -0.00245
166 8D-2 0.00792 -0.00369 0.00299 0.00350 -0.00091
167 9D 0 0.04997 -0.03931 0.02270 0.01638 -0.00945
168 9D+1 0.02196 0.04843 -0.02076 -0.03545 0.02822
169 9D-1 0.01268 0.02076 -0.02446 -0.02822 0.00286
170 9D+2 -0.04120 0.02731 -0.00600 -0.00277 0.00054
171 9D-2 -0.07136 0.03753 -0.02731 -0.00375 0.00277
172 10F 0 -0.00196 -0.00228 0.00132 -0.00145 0.00084
173 10F+1 0.00631 -0.00641 0.00366 0.00123 -0.00220
174 10F-1 0.00364 -0.00366 0.00218 0.00220 0.00131
175 10F+2 0.00135 0.00315 0.00100 0.00272 0.00123
176 10F-2 0.00235 0.00263 -0.00315 0.00191 -0.00272
177 10F+3 0.00000 -0.00012 -0.00021 0.00148 0.00257
178 10F-3 -0.00574 0.00236 -0.00136 -0.00513 0.00296
179 5 H 1S -0.01925 0.00114 0.00066 0.01289 0.00744
180 2S -0.01450 0.09387 0.05419 0.12571 0.07258
181 3S -0.81614 -0.79386 -0.45833 -1.66140 -0.95921
182 4S -0.33567 0.61923 0.35751 0.04167 0.02406
183 5PX 0.01694 -0.00873 0.00148 -0.02327 -0.02742
184 5PY -0.00978 -0.00148 0.01044 0.02742 -0.00840
185 5PZ -0.01638 -0.03290 -0.01900 -0.00932 -0.00538
186 6PX -0.08497 0.03306 -0.00469 0.12209 0.13914
187 6PY 0.04906 0.00469 -0.03847 -0.13914 0.03858
188 6PZ 0.06745 0.15340 0.08856 0.04849 0.02800
189 7PX 0.92879 0.19421 0.25895 -0.19528 -0.51033
190 7PY -0.53624 -0.25895 0.10479 0.51033 -0.39399
191 7PZ -0.36486 -1.16845 -0.67460 0.22618 0.13058
192 8D 0 -0.00602 -0.00366 -0.00211 0.00288 0.00167
193 8D+1 0.00186 -0.00722 -0.00338 0.00266 0.00255
194 8D-1 -0.00108 0.00338 0.00331 -0.00255 0.00029
195 8D+2 0.00457 0.00299 0.00024 -0.00091 -0.00245
196 8D-2 -0.00792 -0.00369 -0.00299 0.00350 0.00091
197 9D 0 0.04997 0.03931 0.02270 -0.01638 -0.00945
198 9D+1 -0.02196 0.04843 0.02076 -0.03545 -0.02822
199 9D-1 0.01268 -0.02076 -0.02446 0.02822 0.00286
200 9D+2 -0.04120 -0.02731 -0.00600 0.00277 0.00054
201 9D-2 0.07136 0.03753 0.02731 -0.00375 -0.00277
202 10F 0 -0.00196 0.00228 0.00132 0.00145 0.00084
203 10F+1 -0.00631 -0.00641 -0.00366 0.00123 0.00220
204 10F-1 0.00364 0.00366 0.00218 -0.00220 0.00131
205 10F+2 0.00135 -0.00315 0.00100 -0.00272 0.00123
206 10F-2 -0.00235 0.00263 0.00315 0.00191 0.00272
207 10F+3 0.00000 -0.00012 0.00021 0.00148 -0.00257
208 10F-3 -0.00574 -0.00236 -0.00136 0.00513 0.00296
209 6 H 1S -0.01925 0.00000 -0.00132 0.00000 -0.01488
210 2S -0.01450 0.00000 -0.10839 0.00000 -0.14516
211 3S -0.81614 0.00000 0.91667 0.00000 1.91842
212 4S -0.33567 0.00000 -0.71503 0.00000 -0.04812
213 5PX 0.00000 0.01130 0.00000 -0.02423 0.00000
214 5PY -0.01957 0.00000 -0.00787 0.00000 -0.03910
215 5PZ 0.01638 0.00000 -0.03799 0.00000 -0.01076
216 6PX 0.00000 -0.04118 0.00000 0.11891 0.00000
217 6PY 0.09811 0.00000 0.03035 0.00000 0.20242
218 6PZ -0.06745 0.00000 0.17713 0.00000 0.05600
219 7PX 0.00000 0.25430 0.00000 -0.68863 0.00000
220 7PY -1.07248 0.00000 0.34371 0.00000 -0.48992
221 7PZ 0.36486 0.00000 -1.34921 0.00000 0.26117
222 8D 0 -0.00602 0.00000 0.00422 0.00000 -0.00333
223 8D+1 0.00000 -0.00136 0.00000 -0.00176 0.00000
224 8D-1 0.00215 0.00000 0.00917 0.00000 -0.00414
225 8D+2 -0.00915 0.00000 0.00542 0.00000 -0.00403
226 8D-2 0.00000 0.00149 0.00000 0.00192 0.00000
227 9D 0 0.04997 0.00000 -0.04540 0.00000 0.01891
228 9D+1 0.00000 0.01248 0.00000 0.01343 0.00000
229 9D-1 -0.02535 0.00000 -0.06041 0.00000 0.05174
230 9D+2 0.08240 0.00000 -0.05330 0.00000 0.00535
231 9D-2 0.00000 -0.00977 0.00000 0.00106 0.00000
232 10F 0 0.00196 0.00000 0.00263 0.00000 0.00168
233 10F+1 0.00000 0.00007 0.00000 0.00258 0.00000
234 10F-1 0.00729 0.00000 -0.00853 0.00000 0.00250
235 10F+2 0.00271 0.00000 0.00445 0.00000 0.00348
236 10F-2 0.00000 0.00282 0.00000 0.00280 0.00000
237 10F+3 0.00000 -0.00025 0.00000 0.00296 0.00000
238 10F-3 0.00574 0.00000 -0.00273 0.00000 0.00593
239 7 H 1S -0.01925 0.00114 0.00066 0.01289 0.00744
240 2S -0.01450 0.09387 0.05419 0.12571 0.07258
241 3S -0.81614 -0.79386 -0.45833 -1.66140 -0.95921
242 4S -0.33567 0.61923 0.35751 0.04167 0.02406
243 5PX -0.01694 0.00873 -0.00148 0.02327 0.02742
244 5PY 0.00978 0.00148 -0.01044 -0.02742 0.00840
245 5PZ 0.01638 0.03290 0.01900 0.00932 0.00538
246 6PX 0.08497 -0.03306 0.00469 -0.12209 -0.13914
247 6PY -0.04906 -0.00469 0.03847 0.13914 -0.03858
248 6PZ -0.06745 -0.15340 -0.08856 -0.04849 -0.02800
249 7PX -0.92879 -0.19421 -0.25895 0.19528 0.51033
250 7PY 0.53624 0.25895 -0.10479 -0.51033 0.39399
251 7PZ 0.36486 1.16845 0.67460 -0.22618 -0.13058
252 8D 0 -0.00602 -0.00366 -0.00211 0.00288 0.00167
253 8D+1 0.00186 -0.00722 -0.00338 0.00266 0.00255
254 8D-1 -0.00108 0.00338 0.00331 -0.00255 0.00029
255 8D+2 0.00457 0.00299 0.00024 -0.00091 -0.00245
256 8D-2 -0.00792 -0.00369 -0.00299 0.00350 0.00091
257 9D 0 0.04997 0.03931 0.02270 -0.01638 -0.00945
258 9D+1 -0.02196 0.04843 0.02076 -0.03545 -0.02822
259 9D-1 0.01268 -0.02076 -0.02446 0.02822 0.00286
260 9D+2 -0.04120 -0.02731 -0.00600 0.00277 0.00054
261 9D-2 0.07136 0.03753 0.02731 -0.00375 -0.00277
262 10F 0 0.00196 -0.00228 -0.00132 -0.00145 -0.00084
263 10F+1 0.00631 0.00641 0.00366 -0.00123 -0.00220
264 10F-1 -0.00364 -0.00366 -0.00218 0.00220 -0.00131
265 10F+2 -0.00135 0.00315 -0.00100 0.00272 -0.00123
266 10F-2 0.00235 -0.00263 -0.00315 -0.00191 -0.00272
267 10F+3 0.00000 0.00012 -0.00021 -0.00148 0.00257
268 10F-3 0.00574 0.00236 0.00136 -0.00513 -0.00296
269 8 H 1S -0.01925 -0.00114 0.00066 -0.01289 0.00744
270 2S -0.01450 -0.09387 0.05419 -0.12571 0.07258
271 3S -0.81614 0.79386 -0.45833 1.66140 -0.95921
272 4S -0.33567 -0.61923 0.35751 -0.04167 0.02406
273 5PX 0.01694 0.00873 0.00148 0.02327 -0.02742
274 5PY 0.00978 -0.00148 -0.01044 0.02742 0.00840
275 5PZ 0.01638 -0.03290 0.01900 -0.00932 0.00538
276 6PX -0.08497 -0.03306 -0.00469 -0.12209 0.13914
277 6PY -0.04906 0.00469 0.03847 -0.13914 -0.03858
278 6PZ -0.06745 0.15340 -0.08856 0.04849 -0.02800
279 7PX 0.92879 -0.19421 0.25895 0.19528 -0.51033
280 7PY 0.53624 -0.25895 -0.10479 0.51033 0.39399
281 7PZ 0.36486 -1.16845 0.67460 0.22618 -0.13058
282 8D 0 -0.00602 0.00366 -0.00211 -0.00288 0.00167
283 8D+1 -0.00186 -0.00722 0.00338 0.00266 -0.00255
284 8D-1 -0.00108 -0.00338 0.00331 0.00255 0.00029
285 8D+2 0.00457 -0.00299 0.00024 0.00091 -0.00245
286 8D-2 0.00792 -0.00369 0.00299 0.00350 -0.00091
287 9D 0 0.04997 -0.03931 0.02270 0.01638 -0.00945
288 9D+1 0.02196 0.04843 -0.02076 -0.03545 0.02822
289 9D-1 0.01268 0.02076 -0.02446 -0.02822 0.00286
290 9D+2 -0.04120 0.02731 -0.00600 -0.00277 0.00054
291 9D-2 -0.07136 0.03753 -0.02731 -0.00375 0.00277
292 10F 0 0.00196 0.00228 -0.00132 0.00145 -0.00084
293 10F+1 -0.00631 0.00641 -0.00366 -0.00123 0.00220
294 10F-1 -0.00364 0.00366 -0.00218 -0.00220 -0.00131
295 10F+2 -0.00135 -0.00315 -0.00100 -0.00272 -0.00123
296 10F-2 -0.00235 -0.00263 0.00315 -0.00191 0.00272
297 10F+3 0.00000 0.00012 0.00021 -0.00148 -0.00257
298 10F-3 0.00574 -0.00236 0.00136 0.00513 -0.00296
81 82 83 84 85
(A2U)--V (A2G)--V (EU)--V (EU)--V (A1G)--V
Eigenvalues -- 1.20406 1.22762 1.23671 1.23671 1.23807
1 1 Si 1S 0.00821 0.00000 0.00000 0.00000 0.04432
2 2S -0.04243 0.00000 0.00000 0.00000 -0.06377
3 3S 0.00994 0.00000 0.00000 0.00000 0.33744
4 4S -3.41472 0.00000 0.00000 0.00000 -2.17070
5 5S 11.41120 0.00000 0.00000 0.00000 9.65267
6 6S 0.60583 0.00000 0.00000 0.00000 4.82318
7 7PX 0.00000 0.00000 0.00000 0.04485 0.00000
8 7PY 0.00000 0.00000 -0.04485 0.00000 0.00000
9 7PZ -0.08700 0.00000 0.00000 0.00000 -0.09274
10 8PX 0.00000 0.00000 0.00000 0.01002 0.00000
11 8PY 0.00000 0.00000 -0.01002 0.00000 0.00000
12 8PZ -0.04539 0.00000 0.00000 0.00000 -0.05945
13 9PX 0.00000 0.00000 0.00000 -0.48958 0.00000
14 9PY 0.00000 0.00000 0.48958 0.00000 0.00000
15 9PZ 0.29634 0.00000 0.00000 0.00000 0.36110
16 10PX 0.00000 0.00000 0.00000 3.77133 0.00000
17 10PY 0.00000 0.00000 -3.77133 0.00000 0.00000
18 10PZ 2.06522 0.00000 0.00000 0.00000 3.06639
19 11PX 0.00000 0.00000 0.00000 0.75973 0.00000
20 11PY 0.00000 0.00000 -0.75973 0.00000 0.00000
21 11PZ 0.46414 0.00000 0.00000 0.00000 0.49410
22 12D 0 0.46096 0.00000 0.00000 0.00000 -1.30138
23 12D+1 0.00000 0.00000 0.00000 1.30312 0.00000
24 12D-1 0.00000 0.00000 -1.30312 0.00000 0.00000
25 12D+2 0.00000 0.00000 2.97969 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 -2.97969 0.00000
27 13D 0 -0.42259 0.00000 0.00000 0.00000 -1.43560
28 13D+1 0.00000 0.00000 0.00000 -0.11566 0.00000
29 13D-1 0.00000 0.00000 0.11566 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.93134 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 -0.93134 0.00000
32 14D 0 -0.02459 0.00000 0.00000 0.00000 -0.01098
33 14D+1 0.00000 0.00000 0.00000 -0.02099 0.00000
34 14D-1 0.00000 0.00000 0.02099 0.00000 0.00000
35 14D+2 0.00000 0.00000 -0.04429 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.04429 0.00000
37 15F 0 -1.48808 0.00000 0.00000 0.00000 -0.69464
38 15F+1 0.00000 0.00000 0.00000 -0.84493 0.00000
39 15F-1 0.00000 0.00000 0.84493 0.00000 0.00000
40 15F+2 0.00000 0.00000 1.27893 0.00000 0.00000
41 15F-2 0.00000 0.00000 0.00000 -1.27893 0.00000
42 15F+3 0.00000 2.01927 0.00000 0.00000 0.00000
43 15F-3 -0.42206 0.00000 0.00000 0.00000 -1.83482
44 16F 0 -0.07317 0.00000 0.00000 0.00000 -0.04592
45 16F+1 0.00000 0.00000 0.00000 -0.00003 0.00000
46 16F-1 0.00000 0.00000 0.00003 0.00000 0.00000
47 16F+2 0.00000 0.00000 -0.02942 0.00000 0.00000
48 16F-2 0.00000 0.00000 0.00000 0.02942 0.00000
49 16F+3 0.00000 -0.00882 0.00000 0.00000 0.00000
50 16F-3 -0.15232 0.00000 0.00000 0.00000 -0.08312
51 17G 0 -0.01074 0.00000 0.00000 0.00000 0.05673
52 17G+1 0.00000 0.00000 0.00000 -0.08296 0.00000
53 17G-1 0.00000 0.00000 0.08296 0.00000 0.00000
54 17G+2 0.00000 0.00000 -0.05165 0.00000 0.00000
55 17G-2 0.00000 0.00000 0.00000 0.05165 0.00000
56 17G+3 0.00000 0.18252 0.00000 0.00000 0.00000
57 17G-3 -0.12760 0.00000 0.00000 0.00000 -0.10449
58 17G+4 0.00000 0.00000 -0.05250 0.00000 0.00000
59 17G-4 0.00000 0.00000 0.00000 -0.05250 0.00000
60 2 Si 1S -0.00821 0.00000 0.00000 0.00000 0.04432
61 2S 0.04243 0.00000 0.00000 0.00000 -0.06377
62 3S -0.00994 0.00000 0.00000 0.00000 0.33744
63 4S 3.41472 0.00000 0.00000 0.00000 -2.17070
64 5S -11.41120 0.00000 0.00000 0.00000 9.65267
65 6S -0.60583 0.00000 0.00000 0.00000 4.82318
66 7PX 0.00000 0.00000 0.00000 0.04485 0.00000
67 7PY 0.00000 0.00000 -0.04485 0.00000 0.00000
68 7PZ -0.08700 0.00000 0.00000 0.00000 0.09274
69 8PX 0.00000 0.00000 0.00000 0.01002 0.00000
70 8PY 0.00000 0.00000 -0.01002 0.00000 0.00000
71 8PZ -0.04539 0.00000 0.00000 0.00000 0.05945
72 9PX 0.00000 0.00000 0.00000 -0.48958 0.00000
73 9PY 0.00000 0.00000 0.48958 0.00000 0.00000
74 9PZ 0.29634 0.00000 0.00000 0.00000 -0.36110
75 10PX 0.00000 0.00000 0.00000 3.77133 0.00000
76 10PY 0.00000 0.00000 -3.77133 0.00000 0.00000
77 10PZ 2.06522 0.00000 0.00000 0.00000 -3.06639
78 11PX 0.00000 0.00000 0.00000 0.75973 0.00000
79 11PY 0.00000 0.00000 -0.75973 0.00000 0.00000
80 11PZ 0.46414 0.00000 0.00000 0.00000 -0.49410
81 12D 0 -0.46096 0.00000 0.00000 0.00000 -1.30138
82 12D+1 0.00000 0.00000 0.00000 -1.30312 0.00000
83 12D-1 0.00000 0.00000 1.30312 0.00000 0.00000
84 12D+2 0.00000 0.00000 -2.97969 0.00000 0.00000
85 12D-2 0.00000 0.00000 0.00000 2.97969 0.00000
86 13D 0 0.42259 0.00000 0.00000 0.00000 -1.43560
87 13D+1 0.00000 0.00000 0.00000 0.11566 0.00000
88 13D-1 0.00000 0.00000 -0.11566 0.00000 0.00000
89 13D+2 0.00000 0.00000 -0.93134 0.00000 0.00000
90 13D-2 0.00000 0.00000 0.00000 0.93134 0.00000
91 14D 0 0.02459 0.00000 0.00000 0.00000 -0.01098
92 14D+1 0.00000 0.00000 0.00000 0.02099 0.00000
93 14D-1 0.00000 0.00000 -0.02099 0.00000 0.00000
94 14D+2 0.00000 0.00000 0.04429 0.00000 0.00000
95 14D-2 0.00000 0.00000 0.00000 -0.04429 0.00000
96 15F 0 -1.48808 0.00000 0.00000 0.00000 0.69464
97 15F+1 0.00000 0.00000 0.00000 -0.84493 0.00000
98 15F-1 0.00000 0.00000 0.84493 0.00000 0.00000
99 15F+2 0.00000 0.00000 1.27893 0.00000 0.00000
100 15F-2 0.00000 0.00000 0.00000 -1.27893 0.00000
101 15F+3 0.00000 -2.01927 0.00000 0.00000 0.00000
102 15F-3 -0.42206 0.00000 0.00000 0.00000 1.83482
103 16F 0 -0.07317 0.00000 0.00000 0.00000 0.04592
104 16F+1 0.00000 0.00000 0.00000 -0.00003 0.00000
105 16F-1 0.00000 0.00000 0.00003 0.00000 0.00000
106 16F+2 0.00000 0.00000 -0.02942 0.00000 0.00000
107 16F-2 0.00000 0.00000 0.00000 0.02942 0.00000
108 16F+3 0.00000 0.00882 0.00000 0.00000 0.00000
109 16F-3 -0.15232 0.00000 0.00000 0.00000 0.08312
110 17G 0 0.01074 0.00000 0.00000 0.00000 0.05673
111 17G+1 0.00000 0.00000 0.00000 0.08296 0.00000
112 17G-1 0.00000 0.00000 -0.08296 0.00000 0.00000
113 17G+2 0.00000 0.00000 0.05165 0.00000 0.00000
114 17G-2 0.00000 0.00000 0.00000 -0.05165 0.00000
115 17G+3 0.00000 0.18252 0.00000 0.00000 0.00000
116 17G-3 0.12760 0.00000 0.00000 0.00000 -0.10449
117 17G+4 0.00000 0.00000 0.05250 0.00000 0.00000
118 17G-4 0.00000 0.00000 0.00000 0.05250 0.00000
119 3 H 1S -0.01985 0.00000 0.00409 0.00000 -0.02539
120 2S -0.01414 0.00000 -0.14437 0.00000 0.06992
121 3S -2.92128 0.00000 3.96003 0.00000 -4.13974
122 4S -0.89964 0.00000 1.31076 0.00000 -1.82060
123 5PX 0.00000 0.01426 0.00000 0.03279 0.00000
124 5PY 0.01812 0.00000 0.03229 0.00000 0.01294
125 5PZ -0.01447 0.00000 0.00087 0.00000 0.01113
126 6PX 0.00000 -0.09331 0.00000 -0.15937 0.00000
127 6PY -0.09395 0.00000 -0.17186 0.00000 -0.07990
128 6PZ 0.06792 0.00000 0.00487 0.00000 -0.06613
129 7PX 0.00000 1.21042 0.00000 1.23382 0.00000
130 7PY 2.03561 0.00000 -0.25158 0.00000 1.94116
131 7PZ 0.01824 0.00000 -0.50473 0.00000 1.14540
132 8D 0 -0.00752 0.00000 -0.00196 0.00000 -0.00107
133 8D+1 0.00000 0.00207 0.00000 0.00172 0.00000
134 8D-1 0.00500 0.00000 -0.00353 0.00000 0.01023
135 8D+2 -0.01199 0.00000 -0.00173 0.00000 -0.00833
136 8D-2 0.00000 0.01710 0.00000 0.00560 0.00000
137 9D 0 0.06708 0.00000 0.00229 0.00000 0.01801
138 9D+1 0.00000 -0.01954 0.00000 -0.01244 0.00000
139 9D-1 -0.06379 0.00000 0.05509 0.00000 -0.10106
140 9D+2 0.12739 0.00000 -0.02030 0.00000 0.09084
141 9D-2 0.00000 -0.14355 0.00000 -0.03070 0.00000
142 10F 0 -0.00549 0.00000 0.00164 0.00000 -0.00497
143 10F+1 0.00000 -0.00198 0.00000 -0.00301 0.00000
144 10F-1 -0.00697 0.00000 -0.00666 0.00000 0.00182
145 10F+2 -0.00651 0.00000 0.00141 0.00000 -0.01030
146 10F-2 0.00000 0.00569 0.00000 0.00003 0.00000
147 10F+3 0.00000 -0.01100 0.00000 -0.00588 0.00000
148 10F-3 -0.00758 0.00000 -0.00707 0.00000 -0.00672
149 4 H 1S -0.01985 0.00000 -0.00205 0.00355 -0.02539
150 2S -0.01414 0.00000 0.07219 -0.12503 0.06992
151 3S -2.92128 0.00000 -1.98001 3.42948 -4.13974
152 4S -0.89964 0.00000 -0.65538 1.13515 -1.82060
153 5PX -0.01569 -0.00713 0.02818 -0.01602 -0.01120
154 5PY -0.00906 0.01235 -0.01652 -0.02818 -0.00647
155 5PZ -0.01447 0.00000 -0.00044 0.00076 0.01113
156 6PX 0.08136 0.04665 -0.14342 0.08905 0.06920
157 6PY 0.04697 -0.08080 0.07656 0.14342 0.03995
158 6PZ 0.06792 0.00000 -0.00243 0.00422 -0.06613
159 7PX -1.76289 -0.60521 0.42532 0.49714 -1.68110
160 7PY -1.01781 1.04825 -0.98826 -0.42532 -0.97058
161 7PZ 0.01824 0.00000 0.25237 -0.43711 1.14540
162 8D 0 -0.00752 0.00000 0.00098 -0.00170 -0.00107
163 8D+1 -0.00433 -0.00103 -0.00078 0.00307 -0.00886
164 8D-1 -0.00250 0.00179 -0.00217 0.00078 -0.00512
165 8D+2 0.00599 0.01481 -0.00463 -0.00168 0.00416
166 8D-2 0.01038 -0.00855 0.00168 0.00270 0.00721
167 9D 0 0.06708 0.00000 -0.00114 0.00198 0.01801
168 9D+1 0.05525 0.00977 0.01847 -0.04442 0.08752
169 9D-1 0.03190 -0.01692 0.02310 -0.01847 0.05053
170 9D+2 -0.06370 -0.12432 0.01795 0.02209 -0.04542
171 9D-2 -0.11032 0.07177 -0.02209 0.00755 -0.07867
172 10F 0 -0.00549 0.00000 -0.00082 0.00142 -0.00497
173 10F+1 0.00604 0.00099 -0.00419 0.00424 -0.00158
174 10F-1 0.00349 -0.00171 0.00060 0.00419 -0.00091
175 10F+2 0.00326 0.00493 0.00033 -0.00062 0.00515
176 10F-2 0.00564 -0.00284 0.00062 -0.00105 0.00892
177 10F+3 0.00000 -0.01100 0.00509 0.00294 0.00000
178 10F-3 -0.00758 0.00000 0.00353 -0.00612 -0.00672
179 5 H 1S -0.01985 0.00000 -0.00205 -0.00355 -0.02539
180 2S -0.01414 0.00000 0.07219 0.12503 0.06992
181 3S -2.92128 0.00000 -1.98001 -3.42948 -4.13974
182 4S -0.89964 0.00000 -0.65538 -1.13515 -1.82060
183 5PX 0.01569 -0.00713 -0.02818 -0.01602 0.01120
184 5PY -0.00906 -0.01235 -0.01652 0.02818 -0.00647
185 5PZ -0.01447 0.00000 -0.00044 -0.00076 0.01113
186 6PX -0.08136 0.04665 0.14342 0.08905 -0.06920
187 6PY 0.04697 0.08080 0.07656 -0.14342 0.03995
188 6PZ 0.06792 0.00000 -0.00243 -0.00422 -0.06613
189 7PX 1.76289 -0.60521 -0.42532 0.49714 1.68110
190 7PY -1.01781 -1.04825 -0.98826 0.42532 -0.97058
191 7PZ 0.01824 0.00000 0.25237 0.43711 1.14540
192 8D 0 -0.00752 0.00000 0.00098 0.00170 -0.00107
193 8D+1 0.00433 -0.00103 0.00078 0.00307 0.00886
194 8D-1 -0.00250 -0.00179 -0.00217 -0.00078 -0.00512
195 8D+2 0.00599 -0.01481 -0.00463 0.00168 0.00416
196 8D-2 -0.01038 -0.00855 -0.00168 0.00270 -0.00721
197 9D 0 0.06708 0.00000 -0.00114 -0.00198 0.01801
198 9D+1 -0.05525 0.00977 -0.01847 -0.04442 -0.08752
199 9D-1 0.03190 0.01692 0.02310 0.01847 0.05053
200 9D+2 -0.06370 0.12432 0.01795 -0.02209 -0.04542
201 9D-2 0.11032 0.07177 0.02209 0.00755 0.07867
202 10F 0 -0.00549 0.00000 -0.00082 -0.00142 -0.00497
203 10F+1 -0.00604 0.00099 0.00419 0.00424 0.00158
204 10F-1 0.00349 0.00171 0.00060 -0.00419 -0.00091
205 10F+2 0.00326 -0.00493 0.00033 0.00062 0.00515
206 10F-2 -0.00564 -0.00284 -0.00062 -0.00105 -0.00892
207 10F+3 0.00000 -0.01100 -0.00509 0.00294 0.00000
208 10F-3 -0.00758 0.00000 0.00353 0.00612 -0.00672
209 6 H 1S 0.01985 0.00000 -0.00409 0.00000 -0.02539
210 2S 0.01414 0.00000 0.14437 0.00000 0.06992
211 3S 2.92128 0.00000 -3.96003 0.00000 -4.13974
212 4S 0.89964 0.00000 -1.31076 0.00000 -1.82060
213 5PX 0.00000 -0.01426 0.00000 0.03279 0.00000
214 5PY 0.01812 0.00000 0.03229 0.00000 -0.01294
215 5PZ -0.01447 0.00000 0.00087 0.00000 -0.01113
216 6PX 0.00000 0.09331 0.00000 -0.15937 0.00000
217 6PY -0.09395 0.00000 -0.17186 0.00000 0.07990
218 6PZ 0.06792 0.00000 0.00487 0.00000 0.06613
219 7PX 0.00000 -1.21042 0.00000 1.23382 0.00000
220 7PY 2.03561 0.00000 -0.25158 0.00000 -1.94116
221 7PZ 0.01824 0.00000 -0.50473 0.00000 -1.14540
222 8D 0 0.00752 0.00000 0.00196 0.00000 -0.00107
223 8D+1 0.00000 0.00207 0.00000 -0.00172 0.00000
224 8D-1 -0.00500 0.00000 0.00353 0.00000 0.01023
225 8D+2 0.01199 0.00000 0.00173 0.00000 -0.00833
226 8D-2 0.00000 0.01710 0.00000 -0.00560 0.00000
227 9D 0 -0.06708 0.00000 -0.00229 0.00000 0.01801
228 9D+1 0.00000 -0.01954 0.00000 0.01244 0.00000
229 9D-1 0.06379 0.00000 -0.05509 0.00000 -0.10106
230 9D+2 -0.12739 0.00000 0.02030 0.00000 0.09084
231 9D-2 0.00000 -0.14355 0.00000 0.03070 0.00000
232 10F 0 -0.00549 0.00000 0.00164 0.00000 0.00497
233 10F+1 0.00000 0.00198 0.00000 -0.00301 0.00000
234 10F-1 -0.00697 0.00000 -0.00666 0.00000 -0.00182
235 10F+2 -0.00651 0.00000 0.00141 0.00000 0.01030
236 10F-2 0.00000 -0.00569 0.00000 0.00003 0.00000
237 10F+3 0.00000 0.01100 0.00000 -0.00588 0.00000
238 10F-3 -0.00758 0.00000 -0.00707 0.00000 0.00672
239 7 H 1S 0.01985 0.00000 0.00205 0.00355 -0.02539
240 2S 0.01414 0.00000 -0.07219 -0.12503 0.06992
241 3S 2.92128 0.00000 1.98001 3.42948 -4.13974
242 4S 0.89964 0.00000 0.65538 1.13515 -1.82060
243 5PX 0.01569 0.00713 -0.02818 -0.01602 -0.01120
244 5PY -0.00906 0.01235 -0.01652 0.02818 0.00647
245 5PZ -0.01447 0.00000 -0.00044 -0.00076 -0.01113
246 6PX -0.08136 -0.04665 0.14342 0.08905 0.06920
247 6PY 0.04697 -0.08080 0.07656 -0.14342 -0.03995
248 6PZ 0.06792 0.00000 -0.00243 -0.00422 0.06613
249 7PX 1.76289 0.60521 -0.42532 0.49714 -1.68110
250 7PY -1.01781 1.04825 -0.98826 0.42532 0.97058
251 7PZ 0.01824 0.00000 0.25237 0.43711 -1.14540
252 8D 0 0.00752 0.00000 -0.00098 -0.00170 -0.00107
253 8D+1 -0.00433 -0.00103 -0.00078 -0.00307 0.00886
254 8D-1 0.00250 -0.00179 0.00217 0.00078 -0.00512
255 8D+2 -0.00599 -0.01481 0.00463 -0.00168 0.00416
256 8D-2 0.01038 -0.00855 0.00168 -0.00270 -0.00721
257 9D 0 -0.06708 0.00000 0.00114 0.00198 0.01801
258 9D+1 0.05525 0.00977 0.01847 0.04442 -0.08752
259 9D-1 -0.03190 0.01692 -0.02310 -0.01847 0.05053
260 9D+2 0.06370 0.12432 -0.01795 0.02209 -0.04542
261 9D-2 -0.11032 0.07177 -0.02209 -0.00755 0.07867
262 10F 0 -0.00549 0.00000 -0.00082 -0.00142 0.00497
263 10F+1 -0.00604 -0.00099 0.00419 0.00424 -0.00158
264 10F-1 0.00349 -0.00171 0.00060 -0.00419 0.00091
265 10F+2 0.00326 0.00493 0.00033 0.00062 -0.00515
266 10F-2 -0.00564 0.00284 -0.00062 -0.00105 0.00892
267 10F+3 0.00000 0.01100 -0.00509 0.00294 0.00000
268 10F-3 -0.00758 0.00000 0.00353 0.00612 0.00672
269 8 H 1S 0.01985 0.00000 0.00205 -0.00355 -0.02539
270 2S 0.01414 0.00000 -0.07219 0.12503 0.06992
271 3S 2.92128 0.00000 1.98001 -3.42948 -4.13974
272 4S 0.89964 0.00000 0.65538 -1.13515 -1.82060
273 5PX -0.01569 0.00713 0.02818 -0.01602 0.01120
274 5PY -0.00906 -0.01235 -0.01652 -0.02818 0.00647
275 5PZ -0.01447 0.00000 -0.00044 0.00076 -0.01113
276 6PX 0.08136 -0.04665 -0.14342 0.08905 -0.06920
277 6PY 0.04697 0.08080 0.07656 0.14342 -0.03995
278 6PZ 0.06792 0.00000 -0.00243 0.00422 0.06613
279 7PX -1.76289 0.60521 0.42532 0.49714 1.68110
280 7PY -1.01781 -1.04825 -0.98826 -0.42532 0.97058
281 7PZ 0.01824 0.00000 0.25237 -0.43711 -1.14540
282 8D 0 0.00752 0.00000 -0.00098 0.00170 -0.00107
283 8D+1 0.00433 -0.00103 0.00078 -0.00307 -0.00886
284 8D-1 0.00250 0.00179 0.00217 -0.00078 -0.00512
285 8D+2 -0.00599 0.01481 0.00463 0.00168 0.00416
286 8D-2 -0.01038 -0.00855 -0.00168 -0.00270 0.00721
287 9D 0 -0.06708 0.00000 0.00114 -0.00198 0.01801
288 9D+1 -0.05525 0.00977 -0.01847 0.04442 0.08752
289 9D-1 -0.03190 -0.01692 -0.02310 0.01847 0.05053
290 9D+2 0.06370 -0.12432 -0.01795 -0.02209 -0.04542
291 9D-2 0.11032 0.07177 0.02209 -0.00755 -0.07867
292 10F 0 -0.00549 0.00000 -0.00082 0.00142 0.00497
293 10F+1 0.00604 -0.00099 -0.00419 0.00424 0.00158
294 10F-1 0.00349 0.00171 0.00060 0.00419 0.00091
295 10F+2 0.00326 -0.00493 0.00033 -0.00062 -0.00515
296 10F-2 0.00564 0.00284 0.00062 -0.00105 -0.00892
297 10F+3 0.00000 0.01100 0.00509 0.00294 0.00000
298 10F-3 -0.00758 0.00000 0.00353 -0.00612 0.00672
86 87 88 89 90
(EG)--V (EG)--V (A2U)--V (EU)--V (EU)--V
Eigenvalues -- 1.25914 1.25914 1.26914 1.35233 1.35233
1 1 Si 1S 0.00000 0.00000 0.04414 0.00000 0.00000
2 2S 0.00000 0.00000 -0.03890 0.00000 0.00000
3 3S 0.00000 0.00000 0.39734 0.00000 0.00000
4 4S 0.00000 0.00000 2.51642 0.00000 0.00000
5 5S 0.00000 0.00000 -5.65372 0.00000 0.00000
6 6S 0.00000 0.00000 11.33118 0.00000 0.00000
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140 9D+2 0.00000 0.13513 -0.11216 -0.04590 0.00000
141 9D-2 -0.00291 0.00000 0.00000 0.00000 0.04462
142 10F 0 0.00000 -0.00065 -0.00034 -0.00415 0.00000
143 10F+1 -0.00049 0.00000 0.00000 0.00000 0.00170
144 10F-1 0.00000 -0.00136 0.00282 0.00639 0.00000
145 10F+2 0.00000 -0.00433 -0.00253 -0.00895 0.00000
146 10F-2 0.00193 0.00000 0.00000 0.00000 0.00385
147 10F+3 -0.00498 0.00000 0.00000 0.00000 0.00211
148 10F-3 0.00000 -0.00343 0.00253 0.00006 0.00000
149 4 H 1S 0.01289 0.00744 -0.01099 0.00806 0.01397
150 2S 0.00029 0.00017 0.04210 0.09757 0.16899
151 3S 2.53623 1.46429 1.68773 -0.98914 -1.71325
152 4S 0.71062 0.41028 -0.74646 0.28159 0.48773
153 5PX -0.01222 -0.01435 -0.02549 0.00594 0.01414
154 5PY -0.01435 0.00435 -0.01472 0.00728 0.00594
155 5PZ -0.01288 -0.00743 0.01224 -0.01827 -0.03165
156 6PX 0.05517 0.07308 0.15260 -0.03846 -0.06927
157 6PY 0.07308 -0.02922 0.08811 -0.02486 -0.03846
158 6PZ 0.04722 0.02726 -0.07453 0.10355 0.17936
159 7PX 1.02190 0.30523 0.36746 -0.17798 -0.50186
160 7PY 0.30523 0.66945 0.21215 -0.29635 -0.17798
161 7PZ -0.55602 -0.32102 0.04964 -0.74154 -1.28438
162 8D 0 0.00951 0.00549 0.00453 -0.00607 -0.01051
163 8D+1 0.00405 0.00016 -0.00130 0.00581 0.00692
164 8D-1 0.00016 0.00386 -0.00075 0.00021 0.00581
165 8D+2 -0.00504 -0.00203 -0.00370 -0.00370 0.00352
166 8D-2 -0.00785 -0.00504 -0.00640 0.00352 0.00036
167 9D 0 -0.09818 -0.05668 -0.06127 0.04791 0.08299
168 9D+1 -0.04992 -0.01652 -0.01561 -0.03838 -0.04247
169 9D-1 -0.01652 -0.03085 -0.00901 0.00185 -0.03838
170 9D+2 0.05977 0.03160 0.05608 0.02199 -0.03920
171 9D-2 0.10062 0.05977 0.09713 -0.03920 -0.02327
172 10F 0 0.00056 0.00033 -0.00034 0.00208 0.00360
173 10F+1 -0.00114 -0.00038 -0.00244 0.00203 0.00522
174 10F-1 -0.00038 -0.00070 -0.00141 0.00287 0.00203
175 10F+2 -0.00271 0.00036 0.00126 0.00065 -0.00554
176 10F-2 -0.00277 -0.00271 0.00219 -0.00554 -0.00575
177 10F+3 0.00249 -0.00431 0.00000 0.00183 -0.00105
178 10F-3 0.00297 0.00171 0.00253 -0.00003 -0.00005
179 5 H 1S -0.01289 0.00744 -0.01099 0.00806 -0.01397
180 2S -0.00029 0.00017 0.04210 0.09757 -0.16899
181 3S -2.53623 1.46429 1.68773 -0.98914 1.71325
182 4S -0.71062 0.41028 -0.74646 0.28159 -0.48773
183 5PX -0.01222 0.01435 0.02549 -0.00594 0.01414
184 5PY 0.01435 0.00435 -0.01472 0.00728 -0.00594
185 5PZ 0.01288 -0.00743 0.01224 -0.01827 0.03165
186 6PX 0.05517 -0.07308 -0.15260 0.03846 -0.06927
187 6PY -0.07308 -0.02922 0.08811 -0.02486 0.03846
188 6PZ -0.04722 0.02726 -0.07453 0.10355 -0.17936
189 7PX 1.02190 -0.30523 -0.36746 0.17798 -0.50186
190 7PY -0.30523 0.66945 0.21215 -0.29635 0.17798
191 7PZ 0.55602 -0.32102 0.04964 -0.74154 1.28438
192 8D 0 -0.00951 0.00549 0.00453 -0.00607 0.01051
193 8D+1 0.00405 -0.00016 0.00130 -0.00581 0.00692
194 8D-1 -0.00016 0.00386 -0.00075 0.00021 -0.00581
195 8D+2 0.00504 -0.00203 -0.00370 -0.00370 -0.00352
196 8D-2 -0.00785 0.00504 0.00640 -0.00352 0.00036
197 9D 0 0.09818 -0.05668 -0.06127 0.04791 -0.08299
198 9D+1 -0.04992 0.01652 0.01561 0.03838 -0.04247
199 9D-1 0.01652 -0.03085 -0.00901 0.00185 0.03838
200 9D+2 -0.05977 0.03160 0.05608 0.02199 0.03920
201 9D-2 0.10062 -0.05977 -0.09713 0.03920 -0.02327
202 10F 0 -0.00056 0.00033 -0.00034 0.00208 -0.00360
203 10F+1 -0.00114 0.00038 0.00244 -0.00203 0.00522
204 10F-1 0.00038 -0.00070 -0.00141 0.00287 -0.00203
205 10F+2 0.00271 0.00036 0.00126 0.00065 0.00554
206 10F-2 -0.00277 0.00271 -0.00219 0.00554 -0.00575
207 10F+3 0.00249 0.00431 0.00000 -0.00183 -0.00105
208 10F-3 -0.00297 0.00171 0.00253 -0.00003 0.00005
209 6 H 1S 0.00000 -0.01489 0.01099 0.01613 0.00000
210 2S 0.00000 -0.00034 -0.04210 0.19514 0.00000
211 3S 0.00000 -2.92859 -1.68773 -1.97829 0.00000
212 4S 0.00000 -0.82055 0.74646 0.56318 0.00000
213 5PX -0.01263 0.00000 0.00000 0.00000 0.00384
214 5PY 0.00000 0.02051 0.02943 0.01757 0.00000
215 5PZ 0.00000 -0.01487 0.01224 0.03655 0.00000
216 6PX 0.07141 0.00000 0.00000 0.00000 -0.00266
217 6PY 0.00000 -0.09736 -0.17621 -0.09147 0.00000
218 6PZ 0.00000 0.05453 -0.07453 -0.20711 0.00000
219 7PX -0.49323 0.00000 0.00000 0.00000 -0.19359
220 7PY 0.00000 -1.19813 -0.42430 -0.60461 0.00000
221 7PZ 0.00000 -0.64204 0.04964 1.48307 0.00000
222 8D 0 0.00000 -0.01098 -0.00453 -0.01214 0.00000
223 8D+1 0.00377 0.00000 0.00000 0.00000 0.00314
224 8D-1 0.00000 0.00414 -0.00150 -0.01027 0.00000
225 8D+2 0.00000 -0.01076 -0.00739 -0.00239 0.00000
226 8D-2 0.00088 0.00000 0.00000 0.00000 0.00573
227 9D 0 0.00000 0.11337 0.06127 0.09583 0.00000
228 9D+1 -0.02131 0.00000 0.00000 0.00000 -0.02401
229 9D-1 0.00000 -0.05946 -0.01803 0.06463 0.00000
230 9D+2 0.00000 0.13513 0.11216 0.04590 0.00000
231 9D-2 -0.00291 0.00000 0.00000 0.00000 -0.04462
232 10F 0 0.00000 0.00065 -0.00034 -0.00415 0.00000
233 10F+1 0.00049 0.00000 0.00000 0.00000 0.00170
234 10F-1 0.00000 0.00136 0.00282 0.00639 0.00000
235 10F+2 0.00000 0.00433 -0.00253 -0.00895 0.00000
236 10F-2 -0.00193 0.00000 0.00000 0.00000 0.00385
237 10F+3 0.00498 0.00000 0.00000 0.00000 0.00211
238 10F-3 0.00000 0.00343 0.00253 0.00006 0.00000
239 7 H 1S -0.01289 0.00744 0.01099 -0.00806 0.01397
240 2S -0.00029 0.00017 -0.04210 -0.09757 0.16899
241 3S -2.53623 1.46429 -1.68773 0.98914 -1.71325
242 4S -0.71062 0.41028 0.74646 -0.28159 0.48773
243 5PX 0.01222 -0.01435 0.02549 -0.00594 0.01414
244 5PY -0.01435 -0.00435 -0.01472 0.00728 -0.00594
245 5PZ -0.01288 0.00743 0.01224 -0.01827 0.03165
246 6PX -0.05517 0.07308 -0.15260 0.03846 -0.06927
247 6PY 0.07308 0.02922 0.08811 -0.02486 0.03846
248 6PZ 0.04722 -0.02726 -0.07453 0.10355 -0.17936
249 7PX -1.02190 0.30523 -0.36746 0.17798 -0.50186
250 7PY 0.30523 -0.66945 0.21215 -0.29635 0.17798
251 7PZ -0.55602 0.32102 0.04964 -0.74154 1.28438
252 8D 0 -0.00951 0.00549 -0.00453 0.00607 -0.01051
253 8D+1 0.00405 -0.00016 -0.00130 0.00581 -0.00692
254 8D-1 -0.00016 0.00386 0.00075 -0.00021 0.00581
255 8D+2 0.00504 -0.00203 0.00370 0.00370 0.00352
256 8D-2 -0.00785 0.00504 -0.00640 0.00352 -0.00036
257 9D 0 0.09818 -0.05668 0.06127 -0.04791 0.08299
258 9D+1 -0.04992 0.01652 -0.01561 -0.03838 0.04247
259 9D-1 0.01652 -0.03085 0.00901 -0.00185 -0.03838
260 9D+2 -0.05977 0.03160 -0.05608 -0.02199 -0.03920
261 9D-2 0.10062 -0.05977 0.09713 -0.03920 0.02327
262 10F 0 0.00056 -0.00033 -0.00034 0.00208 -0.00360
263 10F+1 0.00114 -0.00038 0.00244 -0.00203 0.00522
264 10F-1 -0.00038 0.00070 -0.00141 0.00287 -0.00203
265 10F+2 -0.00271 -0.00036 0.00126 0.00065 0.00554
266 10F-2 0.00277 -0.00271 -0.00219 0.00554 -0.00575
267 10F+3 -0.00249 -0.00431 0.00000 -0.00183 -0.00105
268 10F-3 0.00297 -0.00171 0.00253 -0.00003 0.00005
269 8 H 1S 0.01289 0.00744 0.01099 -0.00806 -0.01397
270 2S 0.00029 0.00017 -0.04210 -0.09757 -0.16899
271 3S 2.53623 1.46429 -1.68773 0.98914 1.71325
272 4S 0.71062 0.41028 0.74646 -0.28159 -0.48773
273 5PX 0.01222 0.01435 -0.02549 0.00594 0.01414
274 5PY 0.01435 -0.00435 -0.01472 0.00728 0.00594
275 5PZ 0.01288 0.00743 0.01224 -0.01827 -0.03165
276 6PX -0.05517 -0.07308 0.15260 -0.03846 -0.06927
277 6PY -0.07308 0.02922 0.08811 -0.02486 -0.03846
278 6PZ -0.04722 -0.02726 -0.07453 0.10355 0.17936
279 7PX -1.02190 -0.30523 0.36746 -0.17798 -0.50186
280 7PY -0.30523 -0.66945 0.21215 -0.29635 -0.17798
281 7PZ 0.55602 0.32102 0.04964 -0.74154 -1.28438
282 8D 0 0.00951 0.00549 -0.00453 0.00607 0.01051
283 8D+1 0.00405 0.00016 0.00130 -0.00581 -0.00692
284 8D-1 0.00016 0.00386 0.00075 -0.00021 -0.00581
285 8D+2 -0.00504 -0.00203 0.00370 0.00370 -0.00352
286 8D-2 -0.00785 -0.00504 0.00640 -0.00352 -0.00036
287 9D 0 -0.09818 -0.05668 0.06127 -0.04791 -0.08299
288 9D+1 -0.04992 -0.01652 0.01561 0.03838 0.04247
289 9D-1 -0.01652 -0.03085 0.00901 -0.00185 0.03838
290 9D+2 0.05977 0.03160 -0.05608 -0.02199 0.03920
291 9D-2 0.10062 0.05977 -0.09713 0.03920 0.02327
292 10F 0 -0.00056 -0.00033 -0.00034 0.00208 0.00360
293 10F+1 0.00114 0.00038 -0.00244 0.00203 0.00522
294 10F-1 0.00038 0.00070 -0.00141 0.00287 0.00203
295 10F+2 0.00271 -0.00036 0.00126 0.00065 -0.00554
296 10F-2 0.00277 0.00271 0.00219 -0.00554 -0.00575
297 10F+3 -0.00249 0.00431 0.00000 0.00183 -0.00105
298 10F-3 -0.00297 -0.00171 0.00253 -0.00003 -0.00005
91 92 93 94 95
(A2U)--V (A1G)--V (EU)--V (EU)--V (EG)--V
Eigenvalues -- 1.44257 1.44873 1.47652 1.47652 1.49323
1 1 Si 1S -0.02049 -0.03892 0.00000 0.00000 0.00000
2 2S 0.01087 -0.01628 0.00000 0.00000 0.00000
3 3S -0.20230 -0.44822 0.00000 0.00000 0.00000
4 4S -2.63394 -6.63980 0.00000 0.00000 0.00000
5 5S 6.68220 17.51974 0.00000 0.00000 0.00000
6 6S -1.39448 -0.09989 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 -0.27815 -0.28254
8 7PY 0.00000 0.00000 0.27815 0.00000 0.00000
9 7PZ -0.14713 0.16456 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 -0.11197 -0.12799
11 8PY 0.00000 0.00000 0.11197 0.00000 0.00000
12 8PZ -0.03611 0.03795 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 1.06768 1.15535
14 9PY 0.00000 0.00000 -1.06768 0.00000 0.00000
15 9PZ 0.46314 -0.98540 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 5.06110 4.54704
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102 15F-3 -1.24706 2.49417 0.00000 0.00000 0.00000
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109 16F-3 -0.05773 0.29474 0.00000 0.00000 0.00000
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144 10F-1 0.00610 -0.00382 0.00876 0.00000 0.00000
145 10F+2 -0.00863 -0.00510 0.01006 0.00000 0.00000
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147 10F+3 0.00000 0.00000 0.00000 -0.00746 -0.00679
148 10F-3 -0.00437 -0.01228 0.01482 0.00000 0.00000
149 4 H 1S -0.01708 -0.00175 -0.01849 0.03203 0.03244
150 2S -0.10129 0.18142 0.01628 -0.02820 -0.14314
151 3S -2.42426 -5.47029 -2.54695 4.41145 4.56123
152 4S -0.70975 -0.36963 -1.01039 1.75004 1.76433
153 5PX 0.00262 0.03552 -0.00638 0.01266 0.01085
154 5PY 0.00151 0.02051 -0.00529 0.00638 0.00393
155 5PZ 0.01366 0.00024 0.00125 -0.00217 -0.00390
156 6PX 0.00144 -0.18706 0.05615 -0.12213 -0.11885
157 6PY 0.00083 -0.10800 0.05730 -0.05615 -0.05149
158 6PZ -0.08338 -0.01888 -0.01373 0.02377 0.04556
159 7PX -0.82975 -1.28615 -0.99632 2.08111 1.95185
160 7PY -0.47906 -0.74256 -0.93066 0.99632 0.90636
161 7PZ 1.03232 0.99195 0.25346 -0.43901 -0.80324
162 8D 0 -0.00257 -0.00221 -0.00684 0.01185 0.00223
163 8D+1 -0.00770 -0.00837 -0.00052 0.00535 0.00742
164 8D-1 -0.00445 -0.00483 -0.00475 0.00052 0.00489
165 8D+2 0.00387 0.00686 -0.00131 -0.00828 -0.00847
166 8D-2 0.00670 0.01188 0.00828 -0.00826 -0.01008
167 9D 0 0.02567 0.07208 0.05917 -0.10248 -0.03676
168 9D+1 0.07855 0.10743 0.01502 -0.05777 -0.07735
169 9D-1 0.04535 0.06203 0.04043 -0.01502 -0.04746
170 9D+2 -0.04158 -0.09851 0.00713 0.08608 0.08374
171 9D-2 -0.07201 -0.17062 -0.08608 0.09226 0.10288
172 10F 0 -0.00387 -0.00160 -0.00463 0.00802 0.00820
173 10F+1 -0.00528 0.00331 0.00333 -0.00683 -0.00658
174 10F-1 -0.00305 0.00191 0.00299 -0.00333 -0.00289
175 10F+2 0.00432 0.00255 0.00037 -0.00559 -0.00659
176 10F-2 0.00748 0.00442 0.00559 -0.00683 -0.00818
177 10F+3 0.00000 0.00000 0.00646 0.00373 0.00340
178 10F-3 -0.00437 -0.01228 -0.00741 0.01284 0.01355
179 5 H 1S -0.01708 -0.00175 -0.01849 -0.03203 -0.03244
180 2S -0.10129 0.18142 0.01628 0.02820 0.14314
181 3S -2.42426 -5.47029 -2.54695 -4.41145 -4.56123
182 4S -0.70975 -0.36963 -1.01039 -1.75004 -1.76433
183 5PX -0.00262 -0.03552 0.00638 0.01266 0.01085
184 5PY 0.00151 0.02051 -0.00529 -0.00638 -0.00393
185 5PZ 0.01366 0.00024 0.00125 0.00217 0.00390
186 6PX -0.00144 0.18706 -0.05615 -0.12213 -0.11885
187 6PY 0.00083 -0.10800 0.05730 0.05615 0.05149
188 6PZ -0.08338 -0.01888 -0.01373 -0.02377 -0.04556
189 7PX 0.82975 1.28615 0.99632 2.08111 1.95185
190 7PY -0.47906 -0.74256 -0.93066 -0.99632 -0.90636
191 7PZ 1.03232 0.99195 0.25346 0.43901 0.80324
192 8D 0 -0.00257 -0.00221 -0.00684 -0.01185 -0.00223
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194 8D-1 -0.00445 -0.00483 -0.00475 -0.00052 -0.00489
195 8D+2 0.00387 0.00686 -0.00131 0.00828 0.00847
196 8D-2 -0.00670 -0.01188 -0.00828 -0.00826 -0.01008
197 9D 0 0.02567 0.07208 0.05917 0.10248 0.03676
198 9D+1 -0.07855 -0.10743 -0.01502 -0.05777 -0.07735
199 9D-1 0.04535 0.06203 0.04043 0.01502 0.04746
200 9D+2 -0.04158 -0.09851 0.00713 -0.08608 -0.08374
201 9D-2 0.07201 0.17062 0.08608 0.09226 0.10288
202 10F 0 -0.00387 -0.00160 -0.00463 -0.00802 -0.00820
203 10F+1 0.00528 -0.00331 -0.00333 -0.00683 -0.00658
204 10F-1 -0.00305 0.00191 0.00299 0.00333 0.00289
205 10F+2 0.00432 0.00255 0.00037 0.00559 0.00659
206 10F-2 -0.00748 -0.00442 -0.00559 -0.00683 -0.00818
207 10F+3 0.00000 0.00000 -0.00646 0.00373 0.00340
208 10F-3 -0.00437 -0.01228 -0.00741 -0.01284 -0.01355
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210 2S 0.10129 0.18142 0.03256 0.00000 0.00000
211 3S 2.42426 -5.47029 -5.09391 0.00000 0.00000
212 4S 0.70975 -0.36963 -2.02078 0.00000 0.00000
213 5PX 0.00000 0.00000 0.00000 0.00161 -0.00405
214 5PY -0.00303 0.04102 -0.01635 0.00000 0.00000
215 5PZ 0.01366 -0.00024 -0.00250 0.00000 0.00000
216 6PX 0.00000 0.00000 0.00000 -0.02488 0.02966
217 6PY -0.00166 -0.21600 0.15455 0.00000 0.00000
218 6PZ -0.08338 0.01888 0.02745 0.00000 0.00000
219 7PX 0.00000 0.00000 0.00000 0.35543 -0.38198
220 7PY 0.95811 -1.48512 -2.65634 0.00000 0.00000
221 7PZ 1.03232 -0.99195 -0.50692 0.00000 0.00000
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224 8D-1 -0.00890 0.00966 0.00565 0.00000 0.00000
225 8D+2 0.00774 -0.01372 -0.01304 0.00000 0.00000
226 8D-2 0.00000 0.00000 0.00000 -0.00609 0.00460
227 9D 0 -0.02567 0.07208 0.11833 0.00000 0.00000
228 9D+1 0.00000 0.00000 0.00000 0.03176 0.00486
229 9D-1 0.09070 -0.12405 -0.06644 0.00000 0.00000
230 9D+2 -0.08315 0.19701 0.14196 0.00000 0.00000
231 9D-2 0.00000 0.00000 0.00000 0.05683 -0.04216
232 10F 0 -0.00387 0.00160 0.00926 0.00000 0.00000
233 10F+1 0.00000 0.00000 0.00000 -0.00106 0.00157
234 10F-1 0.00610 0.00382 0.00876 0.00000 0.00000
235 10F+2 -0.00863 0.00510 0.01006 0.00000 0.00000
236 10F-2 0.00000 0.00000 0.00000 0.00286 -0.00323
237 10F+3 0.00000 0.00000 0.00000 -0.00746 0.00679
238 10F-3 -0.00437 0.01228 0.01482 0.00000 0.00000
239 7 H 1S 0.01708 -0.00175 0.01849 0.03203 -0.03244
240 2S 0.10129 0.18142 -0.01628 -0.02820 0.14314
241 3S 2.42426 -5.47029 2.54695 4.41145 -4.56123
242 4S 0.70975 -0.36963 1.01039 1.75004 -1.76433
243 5PX -0.00262 0.03552 0.00638 0.01266 -0.01085
244 5PY 0.00151 -0.02051 -0.00529 -0.00638 0.00393
245 5PZ 0.01366 -0.00024 0.00125 0.00217 -0.00390
246 6PX -0.00144 -0.18706 -0.05615 -0.12213 0.11885
247 6PY 0.00083 0.10800 0.05730 0.05615 -0.05149
248 6PZ -0.08338 0.01888 -0.01373 -0.02377 0.04556
249 7PX 0.82975 -1.28615 0.99632 2.08111 -1.95185
250 7PY -0.47906 0.74256 -0.93066 -0.99632 0.90636
251 7PZ 1.03232 -0.99195 0.25346 0.43901 -0.80324
252 8D 0 0.00257 -0.00221 0.00684 0.01185 -0.00223
253 8D+1 -0.00770 0.00837 -0.00052 -0.00535 0.00742
254 8D-1 0.00445 -0.00483 0.00475 0.00052 -0.00489
255 8D+2 -0.00387 0.00686 0.00131 -0.00828 0.00847
256 8D-2 0.00670 -0.01188 0.00828 0.00826 -0.01008
257 9D 0 -0.02567 0.07208 -0.05917 -0.10248 0.03676
258 9D+1 0.07855 -0.10743 0.01502 0.05777 -0.07735
259 9D-1 -0.04535 0.06203 -0.04043 -0.01502 0.04746
260 9D+2 0.04158 -0.09851 -0.00713 0.08608 -0.08374
261 9D-2 -0.07201 0.17062 -0.08608 -0.09226 0.10288
262 10F 0 -0.00387 0.00160 -0.00463 -0.00802 0.00820
263 10F+1 0.00528 0.00331 -0.00333 -0.00683 0.00658
264 10F-1 -0.00305 -0.00191 0.00299 0.00333 -0.00289
265 10F+2 0.00432 -0.00255 0.00037 0.00559 -0.00659
266 10F-2 -0.00748 0.00442 -0.00559 -0.00683 0.00818
267 10F+3 0.00000 0.00000 -0.00646 0.00373 -0.00340
268 10F-3 -0.00437 0.01228 -0.00741 -0.01284 0.01355
269 8 H 1S 0.01708 -0.00175 0.01849 -0.03203 0.03244
270 2S 0.10129 0.18142 -0.01628 0.02820 -0.14314
271 3S 2.42426 -5.47029 2.54695 -4.41145 4.56123
272 4S 0.70975 -0.36963 1.01039 -1.75004 1.76433
273 5PX 0.00262 -0.03552 -0.00638 0.01266 -0.01085
274 5PY 0.00151 -0.02051 -0.00529 0.00638 -0.00393
275 5PZ 0.01366 -0.00024 0.00125 -0.00217 0.00390
276 6PX 0.00144 0.18706 0.05615 -0.12213 0.11885
277 6PY 0.00083 0.10800 0.05730 -0.05615 0.05149
278 6PZ -0.08338 0.01888 -0.01373 0.02377 -0.04556
279 7PX -0.82975 1.28615 -0.99632 2.08111 -1.95185
280 7PY -0.47906 0.74256 -0.93066 0.99632 -0.90636
281 7PZ 1.03232 -0.99195 0.25346 -0.43901 0.80324
282 8D 0 0.00257 -0.00221 0.00684 -0.01185 0.00223
283 8D+1 0.00770 -0.00837 0.00052 -0.00535 0.00742
284 8D-1 0.00445 -0.00483 0.00475 -0.00052 0.00489
285 8D+2 -0.00387 0.00686 0.00131 0.00828 -0.00847
286 8D-2 -0.00670 0.01188 -0.00828 0.00826 -0.01008
287 9D 0 -0.02567 0.07208 -0.05917 0.10248 -0.03676
288 9D+1 -0.07855 0.10743 -0.01502 0.05777 -0.07735
289 9D-1 -0.04535 0.06203 -0.04043 0.01502 -0.04746
290 9D+2 0.04158 -0.09851 -0.00713 -0.08608 0.08374
291 9D-2 0.07201 -0.17062 0.08608 -0.09226 0.10288
292 10F 0 -0.00387 0.00160 -0.00463 0.00802 -0.00820
293 10F+1 -0.00528 -0.00331 0.00333 -0.00683 0.00658
294 10F-1 -0.00305 -0.00191 0.00299 -0.00333 0.00289
295 10F+2 0.00432 -0.00255 0.00037 -0.00559 0.00659
296 10F-2 0.00748 -0.00442 0.00559 -0.00683 0.00818
297 10F+3 0.00000 0.00000 0.00646 0.00373 -0.00340
298 10F-3 -0.00437 0.01228 -0.00741 0.01284 -0.01355
96 97 98 99 100
(EG)--V (A1G)--V (A2U)--V (A1G)--V (EU)--V
Eigenvalues -- 1.49323 1.64079 1.70477 1.87317 1.89791
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2 2S 0.00000 -0.01417 0.04791 0.02980 0.00000
3 3S 0.00000 -0.56105 0.60263 -0.14102 0.00000
4 4S 0.00000 -4.50452 2.92098 -5.30804 0.00000
5 5S 0.00000 8.12384 -2.44783 15.58940 0.00000
6 6S 0.00000 1.14191 -5.24039 1.35286 0.00000
7 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
8 7PY 0.28254 0.00000 0.00000 0.00000 0.14075
9 7PZ 0.00000 -0.29895 0.14743 -0.18355 0.00000
10 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
11 8PY 0.12799 0.00000 0.00000 0.00000 0.10088
12 8PZ 0.00000 -0.13558 0.06891 -0.09654 0.00000
13 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
14 9PY -1.15535 0.00000 0.00000 0.00000 -0.53656
15 9PZ 0.00000 1.27460 -1.33247 0.74143 0.00000
16 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
17 10PY -4.54704 0.00000 0.00000 0.00000 -4.73295
18 10PZ 0.00000 1.72686 9.06865 4.02587 0.00000
19 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
20 11PY -0.79530 0.00000 0.00000 0.00000 -0.60842
21 11PZ 0.00000 -0.27919 1.92311 0.17678 0.00000
22 12D 0 0.00000 0.28043 -3.19543 -1.12025 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
24 12D-1 -1.47972 0.00000 0.00000 0.00000 -1.01381
25 12D+2 1.67767 0.00000 0.00000 0.00000 1.84953
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 -1.27717 -1.41825 -1.38414 0.00000
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101 102 103 104 105
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59 17G-4 -0.17026 -0.14814 0.00000 0.00000 0.03328
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61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
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63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
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83 12D-1 0.00000 0.00000 -0.05667 0.67296 0.00000
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85 12D-2 1.84953 -1.13965 0.00000 0.00000 1.40856
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88 13D-1 0.00000 0.00000 -1.21032 0.11876 0.00000
89 13D+2 0.00000 0.00000 1.39792 -0.33993 0.00000
90 13D-2 1.11146 -1.39792 0.00000 0.00000 0.33993
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93 14D-1 0.00000 0.00000 0.17371 0.14257 0.00000
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95 14D-2 -0.00628 -0.02029 0.00000 0.00000 0.14559
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98 15F-1 0.00000 0.00000 0.13798 0.49845 0.00000
99 15F+2 0.00000 0.00000 -0.37447 0.23015 0.00000
100 15F-2 -0.26549 0.37447 0.00000 0.00000 -0.23015
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 -0.24692 0.08852 0.00000 0.00000 0.34251
105 16F-1 0.00000 0.00000 -0.08852 -0.34251 0.00000
106 16F+2 0.00000 0.00000 -0.27381 0.14271 0.00000
107 16F-2 -0.18303 0.27381 0.00000 0.00000 -0.14271
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
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112 17G-1 0.00000 0.00000 0.14577 -0.27616 0.00000
113 17G+2 0.00000 0.00000 0.02672 0.06028 0.00000
114 17G-2 -0.03290 -0.02672 0.00000 0.00000 -0.06028
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
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118 17G-4 0.17026 -0.14814 0.00000 0.00000 -0.03328
119 3 H 1S 0.00000 0.00000 -0.00312 0.00268 0.00000
120 2S 0.00000 0.00000 -1.30362 -0.39313 0.00000
121 3S 0.00000 0.00000 6.08426 2.64479 0.00000
122 4S 0.00000 0.00000 0.66183 0.84333 0.00000
123 5PX -0.01090 -0.00685 0.00000 0.00000 0.00652
124 5PY 0.00000 0.00000 0.02722 -0.00913 0.00000
125 5PZ 0.00000 0.00000 0.00901 0.02633 0.00000
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127 6PY 0.00000 0.00000 -0.10763 0.09083 0.00000
128 6PZ 0.00000 0.00000 -0.05399 -0.16528 0.00000
129 7PX -0.05381 -0.21114 0.00000 0.00000 0.19711
130 7PY 0.00000 0.00000 -2.03184 -0.71780 0.00000
131 7PZ 0.00000 0.00000 -0.92141 -0.33483 0.00000
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133 8D+1 -0.00907 -0.00638 0.00000 0.00000 -0.01397
134 8D-1 0.00000 0.00000 -0.00120 0.00164 0.00000
135 8D+2 0.00000 0.00000 -0.00303 0.01560 0.00000
136 8D-2 0.00800 0.00730 0.00000 0.00000 -0.00320
137 9D 0 0.00000 0.00000 -0.13461 0.26562 0.00000
138 9D+1 0.06608 0.04800 0.00000 0.00000 0.10605
139 9D-1 0.00000 0.00000 0.06503 0.02028 0.00000
140 9D+2 0.00000 0.00000 -0.06699 -0.11685 0.00000
141 9D-2 -0.04958 -0.03743 0.00000 0.00000 0.03526
142 10F 0 0.00000 0.00000 0.00844 0.00635 0.00000
143 10F+1 0.00118 0.00026 0.00000 0.00000 -0.00028
144 10F-1 0.00000 0.00000 0.00887 0.01108 0.00000
145 10F+2 0.00000 0.00000 0.01200 0.00372 0.00000
146 10F-2 -0.00226 -0.00207 0.00000 0.00000 0.00136
147 10F+3 0.00472 0.00544 0.00000 0.00000 0.00013
148 10F-3 0.00000 0.00000 0.01652 0.00324 0.00000
149 4 H 1S -0.00096 -0.00270 0.00156 -0.00134 0.00232
150 2S -1.04952 -1.12897 0.65181 0.19657 -0.34046
151 3S 4.85148 5.26913 -3.04213 -1.32240 2.29046
152 4S 1.00881 0.57317 -0.33092 -0.42167 0.73035
153 5PX -0.02162 -0.02213 0.00882 -0.00113 0.00848
154 5PY -0.00619 -0.00882 0.01194 -0.00717 0.00113
155 5PZ -0.00635 0.00780 -0.00450 -0.01317 0.02280
156 6PX 0.09368 0.08951 -0.03137 0.02384 -0.07707
157 6PY 0.01064 0.03137 -0.05328 0.04954 -0.02384
158 6PZ 0.06513 -0.04676 0.02699 0.08264 -0.14313
159 7PX 1.24782 1.47110 -0.97124 -0.22546 0.58763
160 7PY 0.75149 0.97124 -0.34961 -0.32728 0.22546
161 7PZ -0.79804 -0.79796 0.46070 0.16741 -0.28997
162 8D 0 0.00946 0.01094 -0.00632 0.01810 -0.03135
163 8D+1 -0.00623 -0.00069 -0.00328 -0.00534 -0.00473
164 8D-1 0.00164 0.00328 0.00448 0.01089 0.00534
165 8D+2 -0.00309 -0.00185 -0.00624 0.00630 -0.00537
166 8D-2 0.00264 0.00410 0.00185 0.00537 -0.01250
167 9D 0 -0.08727 -0.11657 0.06730 -0.13281 0.23004
168 9D+1 0.01021 -0.03677 0.04894 0.05470 0.01130
169 9D-1 -0.03226 -0.04894 -0.01975 -0.07447 -0.05470
170 9D+2 0.04639 0.04521 0.01133 -0.05566 0.03533
171 9D-2 0.03078 0.04088 -0.04521 -0.03533 0.09645
172 10F 0 0.00824 0.00731 -0.00422 -0.00318 0.00550
173 10F+1 0.00342 -0.00659 0.00395 0.00468 -0.00838
174 10F-1 0.00129 -0.00395 0.00202 0.00298 -0.00468
175 10F+2 -0.00603 -0.00430 0.00455 -0.00009 -0.00220
176 10F-2 -0.01271 -0.00952 0.00430 0.00220 -0.00245
177 10F+3 -0.00236 -0.00272 -0.00471 -0.00011 -0.00007
178 10F-3 0.01156 0.01431 -0.00826 -0.00162 0.00280
179 5 H 1S 0.00096 0.00270 0.00156 -0.00134 -0.00232
180 2S 1.04952 1.12897 0.65181 0.19657 0.34046
181 3S -4.85148 -5.26913 -3.04213 -1.32240 -2.29046
182 4S -1.00881 -0.57317 -0.33092 -0.42167 -0.73035
183 5PX -0.02162 -0.02213 -0.00882 0.00113 0.00848
184 5PY 0.00619 0.00882 0.01194 -0.00717 -0.00113
185 5PZ 0.00635 -0.00780 -0.00450 -0.01317 -0.02280
186 6PX 0.09368 0.08951 0.03137 -0.02384 -0.07707
187 6PY -0.01064 -0.03137 -0.05328 0.04954 0.02384
188 6PZ -0.06513 0.04676 0.02699 0.08264 0.14313
189 7PX 1.24782 1.47110 0.97124 0.22546 0.58763
190 7PY -0.75149 -0.97124 -0.34961 -0.32728 -0.22546
191 7PZ 0.79804 0.79796 0.46070 0.16741 0.28997
192 8D 0 -0.00946 -0.01094 -0.00632 0.01810 0.03135
193 8D+1 -0.00623 -0.00069 0.00328 0.00534 -0.00473
194 8D-1 -0.00164 -0.00328 0.00448 0.01089 -0.00534
195 8D+2 0.00309 0.00185 -0.00624 0.00630 0.00537
196 8D-2 0.00264 0.00410 -0.00185 -0.00537 -0.01250
197 9D 0 0.08727 0.11657 0.06730 -0.13281 -0.23004
198 9D+1 0.01021 -0.03677 -0.04894 -0.05470 0.01130
199 9D-1 0.03226 0.04894 -0.01975 -0.07447 0.05470
200 9D+2 -0.04639 -0.04521 0.01133 -0.05566 -0.03533
201 9D-2 0.03078 0.04088 0.04521 0.03533 0.09645
202 10F 0 -0.00824 -0.00731 -0.00422 -0.00318 -0.00550
203 10F+1 0.00342 -0.00659 -0.00395 -0.00468 -0.00838
204 10F-1 -0.00129 0.00395 0.00202 0.00298 0.00468
205 10F+2 0.00603 0.00430 0.00455 -0.00009 0.00220
206 10F-2 -0.01271 -0.00952 -0.00430 -0.00220 -0.00245
207 10F+3 -0.00236 -0.00272 0.00471 0.00011 -0.00007
208 10F-3 -0.01156 -0.01431 -0.00826 -0.00162 -0.00280
209 6 H 1S 0.00000 0.00000 -0.00312 -0.00268 0.00000
210 2S 0.00000 0.00000 -1.30362 0.39313 0.00000
211 3S 0.00000 0.00000 6.08426 -2.64479 0.00000
212 4S 0.00000 0.00000 0.66183 -0.84333 0.00000
213 5PX -0.01090 0.00685 0.00000 0.00000 0.00652
214 5PY 0.00000 0.00000 -0.02722 -0.00913 0.00000
215 5PZ 0.00000 0.00000 -0.00901 0.02633 0.00000
216 6PX 0.07526 -0.03517 0.00000 0.00000 -0.03577
217 6PY 0.00000 0.00000 0.10763 0.09083 0.00000
218 6PZ 0.00000 0.00000 0.05399 -0.16528 0.00000
219 7PX -0.05381 0.21114 0.00000 0.00000 0.19711
220 7PY 0.00000 0.00000 2.03184 -0.71780 0.00000
221 7PZ 0.00000 0.00000 0.92141 -0.33483 0.00000
222 8D 0 0.00000 0.00000 0.01264 0.03620 0.00000
223 8D+1 0.00907 -0.00638 0.00000 0.00000 0.01397
224 8D-1 0.00000 0.00000 -0.00120 -0.00164 0.00000
225 8D+2 0.00000 0.00000 -0.00303 -0.01560 0.00000
226 8D-2 -0.00800 0.00730 0.00000 0.00000 0.00320
227 9D 0 0.00000 0.00000 -0.13461 -0.26562 0.00000
228 9D+1 -0.06608 0.04800 0.00000 0.00000 -0.10605
229 9D-1 0.00000 0.00000 0.06503 -0.02028 0.00000
230 9D+2 0.00000 0.00000 -0.06699 0.11685 0.00000
231 9D-2 0.04958 -0.03743 0.00000 0.00000 -0.03526
232 10F 0 0.00000 0.00000 -0.00844 0.00635 0.00000
233 10F+1 0.00118 -0.00026 0.00000 0.00000 -0.00028
234 10F-1 0.00000 0.00000 -0.00887 0.01108 0.00000
235 10F+2 0.00000 0.00000 -0.01200 0.00372 0.00000
236 10F-2 -0.00226 0.00207 0.00000 0.00000 0.00136
237 10F+3 0.00472 -0.00544 0.00000 0.00000 0.00013
238 10F-3 0.00000 0.00000 -0.01652 0.00324 0.00000
239 7 H 1S -0.00096 0.00270 0.00156 0.00134 0.00232
240 2S -1.04952 1.12897 0.65181 -0.19657 -0.34046
241 3S 4.85148 -5.26913 -3.04213 1.32240 2.29046
242 4S 1.00881 -0.57317 -0.33092 0.42167 0.73035
243 5PX -0.02162 0.02213 0.00882 0.00113 0.00848
244 5PY 0.00619 -0.00882 -0.01194 -0.00717 -0.00113
245 5PZ 0.00635 0.00780 0.00450 -0.01317 -0.02280
246 6PX 0.09368 -0.08951 -0.03137 -0.02384 -0.07707
247 6PY -0.01064 0.03137 0.05328 0.04954 0.02384
248 6PZ -0.06513 -0.04676 -0.02699 0.08264 0.14313
249 7PX 1.24782 -1.47110 -0.97124 0.22546 0.58763
250 7PY -0.75149 0.97124 0.34961 -0.32728 -0.22546
251 7PZ 0.79804 -0.79796 -0.46070 0.16741 0.28997
252 8D 0 0.00946 -0.01094 -0.00632 -0.01810 -0.03135
253 8D+1 0.00623 -0.00069 0.00328 -0.00534 0.00473
254 8D-1 0.00164 -0.00328 0.00448 -0.01089 0.00534
255 8D+2 -0.00309 0.00185 -0.00624 -0.00630 -0.00537
256 8D-2 -0.00264 0.00410 -0.00185 0.00537 0.01250
257 9D 0 -0.08727 0.11657 0.06730 0.13281 0.23004
258 9D+1 -0.01021 -0.03677 -0.04894 0.05470 -0.01130
259 9D-1 -0.03226 0.04894 -0.01975 0.07447 -0.05470
260 9D+2 0.04639 -0.04521 0.01133 0.05566 0.03533
261 9D-2 -0.03078 0.04088 0.04521 -0.03533 -0.09645
262 10F 0 -0.00824 0.00731 0.00422 -0.00318 -0.00550
263 10F+1 0.00342 0.00659 0.00395 -0.00468 -0.00838
264 10F-1 -0.00129 -0.00395 -0.00202 0.00298 0.00468
265 10F+2 0.00603 -0.00430 -0.00455 -0.00009 0.00220
266 10F-2 -0.01271 0.00952 0.00430 -0.00220 -0.00245
267 10F+3 -0.00236 0.00272 -0.00471 0.00011 -0.00007
268 10F-3 -0.01156 0.01431 0.00826 -0.00162 -0.00280
269 8 H 1S 0.00096 -0.00270 0.00156 0.00134 -0.00232
270 2S 1.04952 -1.12897 0.65181 -0.19657 0.34046
271 3S -4.85148 5.26913 -3.04213 1.32240 -2.29046
272 4S -1.00881 0.57317 -0.33092 0.42167 -0.73035
273 5PX -0.02162 0.02213 -0.00882 -0.00113 0.00848
274 5PY -0.00619 0.00882 -0.01194 -0.00717 0.00113
275 5PZ -0.00635 -0.00780 0.00450 -0.01317 0.02280
276 6PX 0.09368 -0.08951 0.03137 0.02384 -0.07707
277 6PY 0.01064 -0.03137 0.05328 0.04954 -0.02384
278 6PZ 0.06513 0.04676 -0.02699 0.08264 -0.14313
279 7PX 1.24782 -1.47110 0.97124 -0.22546 0.58763
280 7PY 0.75149 -0.97124 0.34961 -0.32728 0.22546
281 7PZ -0.79804 0.79796 -0.46070 0.16741 -0.28997
282 8D 0 -0.00946 0.01094 -0.00632 -0.01810 0.03135
283 8D+1 0.00623 -0.00069 -0.00328 0.00534 0.00473
284 8D-1 -0.00164 0.00328 0.00448 -0.01089 -0.00534
285 8D+2 0.00309 -0.00185 -0.00624 -0.00630 0.00537
286 8D-2 -0.00264 0.00410 0.00185 -0.00537 0.01250
287 9D 0 0.08727 -0.11657 0.06730 0.13281 -0.23004
288 9D+1 -0.01021 -0.03677 0.04894 -0.05470 -0.01130
289 9D-1 0.03226 -0.04894 -0.01975 0.07447 0.05470
290 9D+2 -0.04639 0.04521 0.01133 0.05566 -0.03533
291 9D-2 -0.03078 0.04088 -0.04521 0.03533 -0.09645
292 10F 0 0.00824 -0.00731 0.00422 -0.00318 0.00550
293 10F+1 0.00342 0.00659 -0.00395 0.00468 -0.00838
294 10F-1 0.00129 0.00395 -0.00202 0.00298 -0.00468
295 10F+2 -0.00603 0.00430 -0.00455 -0.00009 -0.00220
296 10F-2 -0.01271 0.00952 -0.00430 0.00220 -0.00245
297 10F+3 -0.00236 0.00272 0.00471 -0.00011 -0.00007
298 10F-3 0.01156 -0.01431 0.00826 -0.00162 0.00280
106 107 108 109 110
(A1U)--V (A2G)--V (EG)--V (EG)--V (A2U)--V
Eigenvalues -- 1.95951 2.02014 2.02634 2.02634 2.11893
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2 2S 0.00000 0.00000 0.00000 0.00000 0.02001
3 3S 0.00000 0.00000 0.00000 0.00000 -0.43402
4 4S 0.00000 0.00000 0.00000 0.00000 -7.77765
5 5S 0.00000 0.00000 0.00000 0.00000 19.81777
6 6S 0.00000 0.00000 0.00000 0.00000 1.43570
7 7PX 0.00000 0.00000 0.00000 0.00381 0.00000
8 7PY 0.00000 0.00000 0.00381 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.17730
10 8PX 0.00000 0.00000 0.00000 -0.00033 0.00000
11 8PY 0.00000 0.00000 -0.00033 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 -0.09387
13 9PX 0.00000 0.00000 0.00000 -0.00061 0.00000
14 9PY 0.00000 0.00000 -0.00061 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 1.08368
16 10PX 0.00000 0.00000 0.00000 -0.21524 0.00000
17 10PY 0.00000 0.00000 -0.21524 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.76284
19 11PX 0.00000 0.00000 0.00000 -0.33385 0.00000
20 11PY 0.00000 0.00000 -0.33385 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.42640
22 12D 0 0.00000 0.00000 0.00000 0.00000 0.08000
23 12D+1 0.00000 0.00000 0.00000 0.87820 0.00000
24 12D-1 0.00000 0.00000 0.87820 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.14913 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.14913 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.83428
28 13D+1 0.00000 0.00000 0.00000 -0.28175 0.00000
29 13D-1 0.00000 0.00000 -0.28175 0.00000 0.00000
30 13D+2 0.00000 0.00000 -0.13390 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 -0.13390 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.14558
33 14D+1 0.00000 0.00000 0.00000 0.35635 0.00000
34 14D-1 0.00000 0.00000 0.35635 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.16656 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.16656 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 -1.73391
38 15F+1 0.00000 0.00000 0.00000 -0.05947 0.00000
39 15F-1 0.00000 0.00000 -0.05947 0.00000 0.00000
40 15F+2 0.00000 0.00000 -0.12522 0.00000 0.00000
41 15F-2 0.00000 0.00000 0.00000 -0.12522 0.00000
42 15F+3 -0.32154 -0.39536 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 -1.28387
44 16F 0 0.00000 0.00000 0.00000 0.00000 -0.00742
45 16F+1 0.00000 0.00000 0.00000 -0.09283 0.00000
46 16F-1 0.00000 0.00000 -0.09283 0.00000 0.00000
47 16F+2 0.00000 0.00000 0.14678 0.00000 0.00000
48 16F-2 0.00000 0.00000 0.00000 0.14678 0.00000
49 16F+3 0.46963 0.42050 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 -0.66085
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.18349
52 17G+1 0.00000 0.00000 0.00000 0.06424 0.00000
53 17G-1 0.00000 0.00000 0.06424 0.00000 0.00000
54 17G+2 0.00000 0.00000 -0.26107 0.00000 0.00000
55 17G-2 0.00000 0.00000 0.00000 -0.26107 0.00000
56 17G+3 0.02437 0.09707 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 -0.22287
58 17G+4 0.00000 0.00000 0.19632 0.00000 0.00000
59 17G-4 0.00000 0.00000 0.00000 -0.19632 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.03797
61 2S 0.00000 0.00000 0.00000 0.00000 -0.02001
62 3S 0.00000 0.00000 0.00000 0.00000 0.43402
63 4S 0.00000 0.00000 0.00000 0.00000 7.77765
64 5S 0.00000 0.00000 0.00000 0.00000 -19.81777
65 6S 0.00000 0.00000 0.00000 0.00000 -1.43570
66 7PX 0.00000 0.00000 0.00000 -0.00381 0.00000
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72 9PX 0.00000 0.00000 0.00000 0.00061 0.00000
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74 9PZ 0.00000 0.00000 0.00000 0.00000 1.08368
75 10PX 0.00000 0.00000 0.00000 0.21524 0.00000
76 10PY 0.00000 0.00000 0.21524 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.76284
78 11PX 0.00000 0.00000 0.00000 0.33385 0.00000
79 11PY 0.00000 0.00000 0.33385 0.00000 0.00000
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81 12D 0 0.00000 0.00000 0.00000 0.00000 -0.08000
82 12D+1 0.00000 0.00000 0.00000 0.87820 0.00000
83 12D-1 0.00000 0.00000 0.87820 0.00000 0.00000
84 12D+2 0.00000 0.00000 0.14913 0.00000 0.00000
85 12D-2 0.00000 0.00000 0.00000 0.14913 0.00000
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87 13D+1 0.00000 0.00000 0.00000 -0.28175 0.00000
88 13D-1 0.00000 0.00000 -0.28175 0.00000 0.00000
89 13D+2 0.00000 0.00000 -0.13390 0.00000 0.00000
90 13D-2 0.00000 0.00000 0.00000 -0.13390 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 -0.14558
92 14D+1 0.00000 0.00000 0.00000 0.35635 0.00000
93 14D-1 0.00000 0.00000 0.35635 0.00000 0.00000
94 14D+2 0.00000 0.00000 0.16656 0.00000 0.00000
95 14D-2 0.00000 0.00000 0.00000 0.16656 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 -1.73391
97 15F+1 0.00000 0.00000 0.00000 0.05947 0.00000
98 15F-1 0.00000 0.00000 0.05947 0.00000 0.00000
99 15F+2 0.00000 0.00000 0.12522 0.00000 0.00000
100 15F-2 0.00000 0.00000 0.00000 0.12522 0.00000
101 15F+3 -0.32154 0.39536 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 -1.28387
103 16F 0 0.00000 0.00000 0.00000 0.00000 -0.00742
104 16F+1 0.00000 0.00000 0.00000 0.09283 0.00000
105 16F-1 0.00000 0.00000 0.09283 0.00000 0.00000
106 16F+2 0.00000 0.00000 -0.14678 0.00000 0.00000
107 16F-2 0.00000 0.00000 0.00000 -0.14678 0.00000
108 16F+3 0.46963 -0.42050 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 -0.66085
110 17G 0 0.00000 0.00000 0.00000 0.00000 -0.18349
111 17G+1 0.00000 0.00000 0.00000 0.06424 0.00000
112 17G-1 0.00000 0.00000 0.06424 0.00000 0.00000
113 17G+2 0.00000 0.00000 -0.26107 0.00000 0.00000
114 17G-2 0.00000 0.00000 0.00000 -0.26107 0.00000
115 17G+3 -0.02437 0.09707 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.22287
117 17G+4 0.00000 0.00000 0.19632 0.00000 0.00000
118 17G-4 0.00000 0.00000 0.00000 -0.19632 0.00000
119 3 H 1S 0.00000 0.00000 0.00130 0.00000 -0.00203
120 2S 0.00000 0.00000 -0.02143 0.00000 0.80011
121 3S 0.00000 0.00000 -0.10719 0.00000 -6.25138
122 4S 0.00000 0.00000 0.08301 0.00000 -0.14353
123 5PX 0.04525 0.04301 0.00000 -0.01227 0.00000
124 5PY 0.00000 0.00000 -0.00356 0.00000 -0.02412
125 5PZ 0.00000 0.00000 0.01283 0.00000 0.01015
126 6PX -0.30481 -0.29914 0.00000 0.08819 0.00000
127 6PY 0.00000 0.00000 0.02919 0.00000 0.10619
128 6PZ 0.00000 0.00000 -0.09237 0.00000 -0.10745
129 7PX 0.12337 0.08926 0.00000 -0.18991 0.00000
130 7PY 0.00000 0.00000 0.00737 0.00000 2.38852
131 7PZ 0.00000 0.00000 -0.18908 0.00000 1.01466
132 8D 0 0.00000 0.00000 -0.02557 0.00000 -0.00543
133 8D+1 -0.00115 0.01503 0.00000 0.03366 0.00000
134 8D-1 0.00000 0.00000 0.01096 0.00000 0.00542
135 8D+2 0.00000 0.00000 0.02072 0.00000 -0.00672
136 8D-2 -0.02151 -0.02369 0.00000 -0.00247 0.00000
137 9D 0 0.00000 0.00000 0.18720 0.00000 0.08600
138 9D+1 0.02236 -0.09945 0.00000 -0.24686 0.00000
139 9D-1 0.00000 0.00000 -0.06998 0.00000 -0.12633
140 9D+2 0.00000 0.00000 -0.15333 0.00000 0.14582
141 9D-2 0.17853 0.19160 0.00000 0.01582 0.00000
142 10F 0 0.00000 0.00000 0.00443 0.00000 -0.01986
143 10F+1 -0.00174 -0.00225 0.00000 -0.00394 0.00000
144 10F-1 0.00000 0.00000 0.00567 0.00000 0.00122
145 10F+2 0.00000 0.00000 0.00088 0.00000 -0.02325
146 10F-2 0.00513 0.00507 0.00000 -0.01112 0.00000
147 10F+3 -0.01118 -0.01225 0.00000 0.00231 0.00000
148 10F-3 0.00000 0.00000 -0.00363 0.00000 -0.01293
149 4 H 1S 0.00000 0.00000 -0.00065 -0.00112 -0.00203
150 2S 0.00000 0.00000 0.01071 0.01855 0.80011
151 3S 0.00000 0.00000 0.05359 0.09283 -6.25138
152 4S 0.00000 0.00000 -0.04151 -0.07189 -0.14353
153 5PX -0.02263 -0.02151 0.00377 -0.00574 0.02089
154 5PY 0.03919 0.03725 -0.01009 0.00377 0.01206
155 5PZ 0.00000 0.00000 -0.00641 -0.01111 0.01015
156 6PX 0.15241 0.14957 -0.02555 0.04394 -0.09196
157 6PY -0.26397 -0.25907 0.07344 -0.02555 -0.05309
158 6PZ 0.00000 0.00000 0.04619 0.08000 -0.10745
159 7PX -0.06168 -0.04463 0.08543 -0.04195 -2.06852
160 7PY 0.10684 0.07730 -0.14059 0.08543 -1.19426
161 7PZ 0.00000 0.00000 0.09454 0.16375 1.01466
162 8D 0 0.00000 0.00000 0.01279 0.02215 -0.00543
163 8D+1 0.00057 -0.00751 -0.00983 0.01663 -0.00469
164 8D-1 -0.00100 0.01301 0.02799 -0.00983 -0.00271
165 8D+2 -0.01863 -0.02052 0.00333 0.01004 0.00336
166 8D-2 0.01076 0.01185 0.01004 0.01492 0.00582
167 9D 0 0.00000 0.00000 -0.09360 -0.16212 0.08600
168 9D+1 -0.01118 0.04972 0.07659 -0.11420 0.10940
169 9D-1 0.01936 -0.08612 -0.20264 0.07659 0.06316
170 9D+2 0.15461 0.16593 -0.02647 -0.07324 -0.07291
171 9D-2 -0.08927 -0.09580 -0.07324 -0.11104 -0.12628
172 10F 0 0.00000 0.00000 -0.00222 -0.00384 -0.01986
173 10F+1 0.00087 0.00113 0.00416 0.00327 -0.00106
174 10F-1 -0.00151 -0.00195 -0.00154 0.00416 -0.00061
175 10F+2 0.00444 0.00439 -0.00812 0.00519 0.01163
176 10F-2 -0.00257 -0.00254 0.00519 -0.00212 0.02014
177 10F+3 -0.01118 -0.01225 0.00200 -0.00115 0.00000
178 10F-3 0.00000 0.00000 0.00182 0.00314 -0.01293
179 5 H 1S 0.00000 0.00000 -0.00065 0.00112 -0.00203
180 2S 0.00000 0.00000 0.01071 -0.01855 0.80011
181 3S 0.00000 0.00000 0.05359 -0.09283 -6.25138
182 4S 0.00000 0.00000 -0.04151 0.07189 -0.14353
183 5PX -0.02263 -0.02151 -0.00377 -0.00574 -0.02089
184 5PY -0.03919 -0.03725 -0.01009 -0.00377 0.01206
185 5PZ 0.00000 0.00000 -0.00641 0.01111 0.01015
186 6PX 0.15241 0.14957 0.02555 0.04394 0.09196
187 6PY 0.26397 0.25907 0.07344 0.02555 -0.05309
188 6PZ 0.00000 0.00000 0.04619 -0.08000 -0.10745
189 7PX -0.06168 -0.04463 -0.08543 -0.04195 2.06852
190 7PY -0.10684 -0.07730 -0.14059 -0.08543 -1.19426
191 7PZ 0.00000 0.00000 0.09454 -0.16375 1.01466
192 8D 0 0.00000 0.00000 0.01279 -0.02215 -0.00543
193 8D+1 0.00057 -0.00751 0.00983 0.01663 0.00469
194 8D-1 0.00100 -0.01301 0.02799 0.00983 -0.00271
195 8D+2 0.01863 0.02052 0.00333 -0.01004 0.00336
196 8D-2 0.01076 0.01185 -0.01004 0.01492 -0.00582
197 9D 0 0.00000 0.00000 -0.09360 0.16212 0.08600
198 9D+1 -0.01118 0.04972 -0.07659 -0.11420 -0.10940
199 9D-1 -0.01936 0.08612 -0.20264 -0.07659 0.06316
200 9D+2 -0.15461 -0.16593 -0.02647 0.07324 -0.07291
201 9D-2 -0.08927 -0.09580 0.07324 -0.11104 0.12628
202 10F 0 0.00000 0.00000 -0.00222 0.00384 -0.01986
203 10F+1 0.00087 0.00113 -0.00416 0.00327 0.00106
204 10F-1 0.00151 0.00195 -0.00154 -0.00416 -0.00061
205 10F+2 -0.00444 -0.00439 -0.00812 -0.00519 0.01163
206 10F-2 -0.00257 -0.00254 -0.00519 -0.00212 -0.02014
207 10F+3 -0.01118 -0.01225 -0.00200 -0.00115 0.00000
208 10F-3 0.00000 0.00000 0.00182 -0.00314 -0.01293
209 6 H 1S 0.00000 0.00000 0.00130 0.00000 0.00203
210 2S 0.00000 0.00000 -0.02143 0.00000 -0.80011
211 3S 0.00000 0.00000 -0.10719 0.00000 6.25138
212 4S 0.00000 0.00000 0.08301 0.00000 0.14353
213 5PX 0.04525 -0.04301 0.00000 0.01227 0.00000
214 5PY 0.00000 0.00000 0.00356 0.00000 -0.02412
215 5PZ 0.00000 0.00000 -0.01283 0.00000 0.01015
216 6PX -0.30481 0.29914 0.00000 -0.08819 0.00000
217 6PY 0.00000 0.00000 -0.02919 0.00000 0.10619
218 6PZ 0.00000 0.00000 0.09237 0.00000 -0.10745
219 7PX 0.12337 -0.08926 0.00000 0.18991 0.00000
220 7PY 0.00000 0.00000 -0.00737 0.00000 2.38852
221 7PZ 0.00000 0.00000 0.18908 0.00000 1.01466
222 8D 0 0.00000 0.00000 -0.02557 0.00000 0.00543
223 8D+1 0.00115 0.01503 0.00000 0.03366 0.00000
224 8D-1 0.00000 0.00000 0.01096 0.00000 -0.00542
225 8D+2 0.00000 0.00000 0.02072 0.00000 0.00672
226 8D-2 0.02151 -0.02369 0.00000 -0.00247 0.00000
227 9D 0 0.00000 0.00000 0.18720 0.00000 -0.08600
228 9D+1 -0.02236 -0.09945 0.00000 -0.24686 0.00000
229 9D-1 0.00000 0.00000 -0.06998 0.00000 0.12633
230 9D+2 0.00000 0.00000 -0.15333 0.00000 -0.14582
231 9D-2 -0.17853 0.19160 0.00000 0.01582 0.00000
232 10F 0 0.00000 0.00000 -0.00443 0.00000 -0.01986
233 10F+1 -0.00174 0.00225 0.00000 0.00394 0.00000
234 10F-1 0.00000 0.00000 -0.00567 0.00000 0.00122
235 10F+2 0.00000 0.00000 -0.00088 0.00000 -0.02325
236 10F-2 0.00513 -0.00507 0.00000 0.01112 0.00000
237 10F+3 -0.01118 0.01225 0.00000 -0.00231 0.00000
238 10F-3 0.00000 0.00000 0.00363 0.00000 -0.01293
239 7 H 1S 0.00000 0.00000 -0.00065 0.00112 0.00203
240 2S 0.00000 0.00000 0.01071 -0.01855 -0.80011
241 3S 0.00000 0.00000 0.05359 -0.09283 6.25138
242 4S 0.00000 0.00000 -0.04151 0.07189 0.14353
243 5PX -0.02263 0.02151 0.00377 0.00574 -0.02089
244 5PY -0.03919 0.03725 0.01009 0.00377 0.01206
245 5PZ 0.00000 0.00000 0.00641 -0.01111 0.01015
246 6PX 0.15241 -0.14957 -0.02555 -0.04394 0.09196
247 6PY 0.26397 -0.25907 -0.07344 -0.02555 -0.05309
248 6PZ 0.00000 0.00000 -0.04619 0.08000 -0.10745
249 7PX -0.06168 0.04463 0.08543 0.04195 2.06852
250 7PY -0.10684 0.07730 0.14059 0.08543 -1.19426
251 7PZ 0.00000 0.00000 -0.09454 0.16375 1.01466
252 8D 0 0.00000 0.00000 0.01279 -0.02215 0.00543
253 8D+1 -0.00057 -0.00751 0.00983 0.01663 -0.00469
254 8D-1 -0.00100 -0.01301 0.02799 0.00983 0.00271
255 8D+2 -0.01863 0.02052 0.00333 -0.01004 -0.00336
256 8D-2 -0.01076 0.01185 -0.01004 0.01492 0.00582
257 9D 0 0.00000 0.00000 -0.09360 0.16212 -0.08600
258 9D+1 0.01118 0.04972 -0.07659 -0.11420 0.10940
259 9D-1 0.01936 0.08612 -0.20264 -0.07659 -0.06316
260 9D+2 0.15461 -0.16593 -0.02647 0.07324 0.07291
261 9D-2 0.08927 -0.09580 0.07324 -0.11104 -0.12628
262 10F 0 0.00000 0.00000 0.00222 -0.00384 -0.01986
263 10F+1 0.00087 -0.00113 0.00416 -0.00327 0.00106
264 10F-1 0.00151 -0.00195 0.00154 0.00416 -0.00061
265 10F+2 -0.00444 0.00439 0.00812 0.00519 0.01163
266 10F-2 -0.00257 0.00254 0.00519 0.00212 -0.02014
267 10F+3 -0.01118 0.01225 0.00200 0.00115 0.00000
268 10F-3 0.00000 0.00000 -0.00182 0.00314 -0.01293
269 8 H 1S 0.00000 0.00000 -0.00065 -0.00112 0.00203
270 2S 0.00000 0.00000 0.01071 0.01855 -0.80011
271 3S 0.00000 0.00000 0.05359 0.09283 6.25138
272 4S 0.00000 0.00000 -0.04151 -0.07189 0.14353
273 5PX -0.02263 0.02151 -0.00377 0.00574 0.02089
274 5PY 0.03919 -0.03725 0.01009 -0.00377 0.01206
275 5PZ 0.00000 0.00000 0.00641 0.01111 0.01015
276 6PX 0.15241 -0.14957 0.02555 -0.04394 -0.09196
277 6PY -0.26397 0.25907 -0.07344 0.02555 -0.05309
278 6PZ 0.00000 0.00000 -0.04619 -0.08000 -0.10745
279 7PX -0.06168 0.04463 -0.08543 0.04195 -2.06852
280 7PY 0.10684 -0.07730 0.14059 -0.08543 -1.19426
281 7PZ 0.00000 0.00000 -0.09454 -0.16375 1.01466
282 8D 0 0.00000 0.00000 0.01279 0.02215 0.00543
283 8D+1 -0.00057 -0.00751 -0.00983 0.01663 0.00469
284 8D-1 0.00100 0.01301 0.02799 -0.00983 0.00271
285 8D+2 0.01863 -0.02052 0.00333 0.01004 -0.00336
286 8D-2 -0.01076 0.01185 0.01004 0.01492 -0.00582
287 9D 0 0.00000 0.00000 -0.09360 -0.16212 -0.08600
288 9D+1 0.01118 0.04972 0.07659 -0.11420 -0.10940
289 9D-1 -0.01936 -0.08612 -0.20264 0.07659 -0.06316
290 9D+2 -0.15461 0.16593 -0.02647 -0.07324 0.07291
291 9D-2 0.08927 -0.09580 -0.07324 -0.11104 0.12628
292 10F 0 0.00000 0.00000 0.00222 0.00384 -0.01986
293 10F+1 0.00087 -0.00113 -0.00416 -0.00327 -0.00106
294 10F-1 -0.00151 0.00195 0.00154 -0.00416 -0.00061
295 10F+2 0.00444 -0.00439 0.00812 -0.00519 0.01163
296 10F-2 -0.00257 0.00254 -0.00519 0.00212 0.02014
297 10F+3 -0.01118 0.01225 -0.00200 0.00115 0.00000
298 10F-3 0.00000 0.00000 -0.00182 -0.00314 -0.01293
111 112 113 114 115
(EG)--V (EG)--V (EU)--V (EU)--V (A1G)--V
Eigenvalues -- 2.14345 2.14345 2.22035 2.22035 2.23653
1 1 Si 1S 0.00000 0.00000 0.00000 0.00000 -0.00308
2 2S 0.00000 0.00000 0.00000 0.00000 0.04823
3 3S 0.00000 0.00000 0.00000 0.00000 0.02212
4 4S 0.00000 0.00000 0.00000 0.00000 -0.97128
5 5S 0.00000 0.00000 0.00000 0.00000 4.57519
6 6S 0.00000 0.00000 0.00000 0.00000 0.12578
7 7PX 0.00000 0.05366 0.00000 -0.03472 0.00000
8 7PY 0.05366 0.00000 -0.03472 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.04739
10 8PX 0.00000 0.00072 0.00000 0.00691 0.00000
11 8PY 0.00072 0.00000 0.00691 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.03803
13 9PX 0.00000 -0.37752 0.00000 0.31333 0.00000
14 9PY -0.37752 0.00000 0.31333 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 -0.23465
16 10PX 0.00000 0.97808 0.00000 -0.46860 0.00000
17 10PY 0.97808 0.00000 -0.46860 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.74105
19 11PX 0.00000 0.93917 0.00000 -0.22566 0.00000
20 11PY 0.93917 0.00000 -0.22566 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.59451
22 12D 0 0.00000 0.00000 0.00000 0.00000 -1.13093
23 12D+1 0.00000 -0.75847 0.00000 -0.45387 0.00000
24 12D-1 -0.75847 0.00000 -0.45387 0.00000 0.00000
25 12D+2 -0.47944 0.00000 0.08875 0.00000 0.00000
26 12D-2 0.00000 -0.47944 0.00000 0.08875 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.10269
28 13D+1 0.00000 -0.02990 0.00000 0.74342 0.00000
29 13D-1 -0.02990 0.00000 0.74342 0.00000 0.00000
30 13D+2 0.16754 0.00000 0.06946 0.00000 0.00000
31 13D-2 0.00000 0.16754 0.00000 0.06946 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 -0.28200
33 14D+1 0.00000 0.09336 0.00000 -0.56465 0.00000
34 14D-1 0.09336 0.00000 -0.56465 0.00000 0.00000
35 14D+2 -0.18480 0.00000 -0.06859 0.00000 0.00000
36 14D-2 0.00000 -0.18480 0.00000 -0.06859 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.70501
38 15F+1 0.00000 0.29260 0.00000 0.35345 0.00000
39 15F-1 0.29260 0.00000 0.35345 0.00000 0.00000
40 15F+2 -0.31945 0.00000 0.16154 0.00000 0.00000
41 15F-2 0.00000 -0.31945 0.00000 0.16154 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 -0.30415
44 16F 0 0.00000 0.00000 0.00000 0.00000 -0.78988
45 16F+1 0.00000 -0.23303 0.00000 -0.24020 0.00000
46 16F-1 -0.23303 0.00000 -0.24020 0.00000 0.00000
47 16F+2 0.39666 0.00000 -0.41458 0.00000 0.00000
48 16F-2 0.00000 0.39666 0.00000 -0.41458 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 -0.13209
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.03461
52 17G+1 0.00000 -0.05448 0.00000 0.14324 0.00000
53 17G-1 -0.05448 0.00000 0.14324 0.00000 0.00000
54 17G+2 0.20567 0.00000 -0.02934 0.00000 0.00000
55 17G-2 0.00000 0.20567 0.00000 -0.02934 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.16901
58 17G+4 0.04392 0.00000 -0.23843 0.00000 0.00000
59 17G-4 0.00000 -0.04392 0.00000 0.23843 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 -0.00308
61 2S 0.00000 0.00000 0.00000 0.00000 0.04823
62 3S 0.00000 0.00000 0.00000 0.00000 0.02212
63 4S 0.00000 0.00000 0.00000 0.00000 -0.97128
64 5S 0.00000 0.00000 0.00000 0.00000 4.57519
65 6S 0.00000 0.00000 0.00000 0.00000 0.12578
66 7PX 0.00000 -0.05366 0.00000 -0.03472 0.00000
67 7PY -0.05366 0.00000 -0.03472 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 -0.04739
69 8PX 0.00000 -0.00072 0.00000 0.00691 0.00000
70 8PY -0.00072 0.00000 0.00691 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 -0.03803
72 9PX 0.00000 0.37752 0.00000 0.31333 0.00000
73 9PY 0.37752 0.00000 0.31333 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.23465
75 10PX 0.00000 -0.97808 0.00000 -0.46860 0.00000
76 10PY -0.97808 0.00000 -0.46860 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 -0.74105
78 11PX 0.00000 -0.93917 0.00000 -0.22566 0.00000
79 11PY -0.93917 0.00000 -0.22566 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 -0.59451
81 12D 0 0.00000 0.00000 0.00000 0.00000 -1.13093
82 12D+1 0.00000 -0.75847 0.00000 0.45387 0.00000
83 12D-1 -0.75847 0.00000 0.45387 0.00000 0.00000
84 12D+2 -0.47944 0.00000 -0.08875 0.00000 0.00000
85 12D-2 0.00000 -0.47944 0.00000 -0.08875 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.10269
87 13D+1 0.00000 -0.02990 0.00000 -0.74342 0.00000
88 13D-1 -0.02990 0.00000 -0.74342 0.00000 0.00000
89 13D+2 0.16754 0.00000 -0.06946 0.00000 0.00000
90 13D-2 0.00000 0.16754 0.00000 -0.06946 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 -0.28200
92 14D+1 0.00000 0.09336 0.00000 0.56465 0.00000
93 14D-1 0.09336 0.00000 0.56465 0.00000 0.00000
94 14D+2 -0.18480 0.00000 0.06859 0.00000 0.00000
95 14D-2 0.00000 -0.18480 0.00000 0.06859 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 -0.70501
97 15F+1 0.00000 -0.29260 0.00000 0.35345 0.00000
98 15F-1 -0.29260 0.00000 0.35345 0.00000 0.00000
99 15F+2 0.31945 0.00000 0.16154 0.00000 0.00000
100 15F-2 0.00000 0.31945 0.00000 0.16154 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.30415
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.78988
104 16F+1 0.00000 0.23303 0.00000 -0.24020 0.00000
105 16F-1 0.23303 0.00000 -0.24020 0.00000 0.00000
106 16F+2 -0.39666 0.00000 -0.41458 0.00000 0.00000
107 16F-2 0.00000 -0.39666 0.00000 -0.41458 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.13209
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.03461
111 17G+1 0.00000 -0.05448 0.00000 -0.14324 0.00000
112 17G-1 -0.05448 0.00000 -0.14324 0.00000 0.00000
113 17G+2 0.20567 0.00000 0.02934 0.00000 0.00000
114 17G-2 0.00000 0.20567 0.00000 0.02934 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.16901
117 17G+4 0.04392 0.00000 0.23843 0.00000 0.00000
118 17G-4 0.00000 -0.04392 0.00000 -0.23843 0.00000
119 3 H 1S -0.00200 0.00000 -0.00309 0.00000 -0.01170
120 2S 0.03775 0.00000 0.08044 0.00000 0.11563
121 3S -0.26911 0.00000 0.02111 0.00000 -1.09792
122 4S -0.56408 0.00000 0.26947 0.00000 -0.41854
123 5PX 0.00000 -0.03192 0.00000 0.03044 0.00000
124 5PY -0.01625 0.00000 0.00760 0.00000 0.02797
125 5PZ 0.04773 0.00000 -0.01182 0.00000 0.00116
126 6PX 0.00000 0.23721 0.00000 -0.23681 0.00000
127 6PY 0.12851 0.00000 -0.09637 0.00000 -0.28452
128 6PZ -0.33909 0.00000 0.09445 0.00000 -0.04020
129 7PX 0.00000 -0.04343 0.00000 0.27165 0.00000
130 7PY -0.14329 0.00000 0.31447 0.00000 0.74869
131 7PZ 0.39242 0.00000 -0.13832 0.00000 0.39731
132 8D 0 -0.01353 0.00000 -0.00044 0.00000 0.00083
133 8D+1 0.00000 -0.01784 0.00000 -0.02702 0.00000
134 8D-1 -0.01402 0.00000 -0.00638 0.00000 0.00728
135 8D+2 -0.00125 0.00000 -0.01281 0.00000 -0.01082
136 8D-2 0.00000 0.01306 0.00000 -0.00003 0.00000
137 9D 0 0.10391 0.00000 0.02921 0.00000 -0.01645
138 9D+1 0.00000 0.14140 0.00000 0.20300 0.00000
139 9D-1 0.13100 0.00000 0.06756 0.00000 -0.06418
140 9D+2 -0.00558 0.00000 0.13165 0.00000 0.09369
141 9D-2 0.00000 -0.10572 0.00000 0.00638 0.00000
142 10F 0 -0.00287 0.00000 0.00317 0.00000 -0.00311
143 10F+1 0.00000 0.00175 0.00000 0.00553 0.00000
144 10F-1 0.01678 0.00000 -0.01555 0.00000 -0.00283
145 10F+2 -0.00850 0.00000 0.00423 0.00000 -0.00687
146 10F-2 0.00000 -0.00704 0.00000 0.01365 0.00000
147 10F+3 0.00000 0.00967 0.00000 -0.00858 0.00000
148 10F-3 0.00922 0.00000 -0.00884 0.00000 -0.01335
149 4 H 1S 0.00100 0.00173 0.00155 0.00268 -0.01170
150 2S -0.01887 -0.03269 -0.04022 -0.06966 0.11563
151 3S 0.13456 0.23306 -0.01055 -0.01828 -1.09792
152 4S 0.28204 0.48850 -0.13473 -0.23336 -0.41854
153 5PX 0.00679 -0.02017 -0.00989 0.01331 -0.02422
154 5PY -0.02800 0.00679 0.02473 -0.00989 -0.01399
155 5PZ -0.02386 -0.04133 0.00591 0.01023 0.00116
156 6PX -0.04707 0.15568 0.06081 -0.13148 0.24640
157 6PY 0.21004 -0.04707 -0.20170 0.06081 0.14226
158 6PZ 0.16955 0.29366 -0.04723 -0.08180 -0.04020
159 7PX -0.04324 -0.11833 0.01854 0.30376 -0.64838
160 7PY -0.06840 -0.04324 0.28235 0.01854 -0.37434
161 7PZ -0.19621 -0.33985 0.06916 0.11979 0.39731
162 8D 0 0.00677 0.01172 0.00022 0.00039 0.00083
163 8D+1 0.00165 -0.01498 0.00894 -0.01154 -0.00631
164 8D-1 -0.01688 0.00165 -0.02186 0.00894 -0.00364
165 8D+2 0.00948 -0.00620 -0.00323 -0.00553 0.00541
166 8D-2 -0.00620 0.00233 -0.00553 -0.00961 0.00937
167 9D 0 -0.05196 -0.08999 -0.01460 -0.02529 -0.01645
168 9D+1 -0.00450 0.13360 -0.05865 0.10142 0.05558
169 9D-1 0.13880 -0.00450 0.16914 -0.05865 0.03209
170 9D+2 -0.08068 0.04336 0.03770 0.05424 -0.04684
171 9D-2 0.04336 -0.03061 0.05424 0.10034 -0.08113
172 10F 0 0.00143 0.00248 -0.00158 -0.00274 -0.00311
173 10F+1 0.00651 0.01302 -0.00913 -0.01028 0.00245
174 10F-1 0.00551 0.00651 0.00026 -0.00913 0.00142
175 10F+2 -0.00741 -0.00063 0.01130 -0.00408 0.00343
176 10F-2 -0.00063 -0.00814 -0.00408 0.00658 0.00595
177 10F+3 0.00837 -0.00483 -0.00743 0.00429 0.00000
178 10F-3 -0.00461 -0.00799 0.00442 0.00766 -0.01335
179 5 H 1S 0.00100 -0.00173 0.00155 -0.00268 -0.01170
180 2S -0.01887 0.03269 -0.04022 0.06966 0.11563
181 3S 0.13456 -0.23306 -0.01055 0.01828 -1.09792
182 4S 0.28204 -0.48850 -0.13473 0.23336 -0.41854
183 5PX -0.00679 -0.02017 0.00989 0.01331 0.02422
184 5PY -0.02800 -0.00679 0.02473 0.00989 -0.01399
185 5PZ -0.02386 0.04133 0.00591 -0.01023 0.00116
186 6PX 0.04707 0.15568 -0.06081 -0.13148 -0.24640
187 6PY 0.21004 0.04707 -0.20170 -0.06081 0.14226
188 6PZ 0.16955 -0.29366 -0.04723 0.08180 -0.04020
189 7PX 0.04324 -0.11833 -0.01854 0.30376 0.64838
190 7PY -0.06840 0.04324 0.28235 -0.01854 -0.37434
191 7PZ -0.19621 0.33985 0.06916 -0.11979 0.39731
192 8D 0 0.00677 -0.01172 0.00022 -0.00039 0.00083
193 8D+1 -0.00165 -0.01498 -0.00894 -0.01154 0.00631
194 8D-1 -0.01688 -0.00165 -0.02186 -0.00894 -0.00364
195 8D+2 0.00948 0.00620 -0.00323 0.00553 0.00541
196 8D-2 0.00620 0.00233 0.00553 -0.00961 -0.00937
197 9D 0 -0.05196 0.08999 -0.01460 0.02529 -0.01645
198 9D+1 0.00450 0.13360 0.05865 0.10142 -0.05558
199 9D-1 0.13880 0.00450 0.16914 0.05865 0.03209
200 9D+2 -0.08068 -0.04336 0.03770 -0.05424 -0.04684
201 9D-2 -0.04336 -0.03061 -0.05424 0.10034 0.08113
202 10F 0 0.00143 -0.00248 -0.00158 0.00274 -0.00311
203 10F+1 -0.00651 0.01302 0.00913 -0.01028 -0.00245
204 10F-1 0.00551 -0.00651 0.00026 0.00913 0.00142
205 10F+2 -0.00741 0.00063 0.01130 0.00408 0.00343
206 10F-2 0.00063 -0.00814 0.00408 0.00658 -0.00595
207 10F+3 -0.00837 -0.00483 0.00743 0.00429 0.00000
208 10F-3 -0.00461 0.00799 0.00442 -0.00766 -0.01335
209 6 H 1S -0.00200 0.00000 0.00309 0.00000 -0.01170
210 2S 0.03775 0.00000 -0.08044 0.00000 0.11563
211 3S -0.26911 0.00000 -0.02111 0.00000 -1.09792
212 4S -0.56408 0.00000 -0.26947 0.00000 -0.41854
213 5PX 0.00000 0.03192 0.00000 0.03044 0.00000
214 5PY 0.01625 0.00000 0.00760 0.00000 -0.02797
215 5PZ -0.04773 0.00000 -0.01182 0.00000 -0.00116
216 6PX 0.00000 -0.23721 0.00000 -0.23681 0.00000
217 6PY -0.12851 0.00000 -0.09637 0.00000 0.28452
218 6PZ 0.33909 0.00000 0.09445 0.00000 0.04020
219 7PX 0.00000 0.04343 0.00000 0.27165 0.00000
220 7PY 0.14329 0.00000 0.31447 0.00000 -0.74869
221 7PZ -0.39242 0.00000 -0.13832 0.00000 -0.39731
222 8D 0 -0.01353 0.00000 0.00044 0.00000 0.00083
223 8D+1 0.00000 -0.01784 0.00000 0.02702 0.00000
224 8D-1 -0.01402 0.00000 0.00638 0.00000 0.00728
225 8D+2 -0.00125 0.00000 0.01281 0.00000 -0.01082
226 8D-2 0.00000 0.01306 0.00000 0.00003 0.00000
227 9D 0 0.10391 0.00000 -0.02921 0.00000 -0.01645
228 9D+1 0.00000 0.14140 0.00000 -0.20300 0.00000
229 9D-1 0.13100 0.00000 -0.06756 0.00000 -0.06418
230 9D+2 -0.00558 0.00000 -0.13165 0.00000 0.09369
231 9D-2 0.00000 -0.10572 0.00000 -0.00638 0.00000
232 10F 0 0.00287 0.00000 0.00317 0.00000 0.00311
233 10F+1 0.00000 -0.00175 0.00000 0.00553 0.00000
234 10F-1 -0.01678 0.00000 -0.01555 0.00000 0.00283
235 10F+2 0.00850 0.00000 0.00423 0.00000 0.00687
236 10F-2 0.00000 0.00704 0.00000 0.01365 0.00000
237 10F+3 0.00000 -0.00967 0.00000 -0.00858 0.00000
238 10F-3 -0.00922 0.00000 -0.00884 0.00000 0.01335
239 7 H 1S 0.00100 -0.00173 -0.00155 0.00268 -0.01170
240 2S -0.01887 0.03269 0.04022 -0.06966 0.11563
241 3S 0.13456 -0.23306 0.01055 -0.01828 -1.09792
242 4S 0.28204 -0.48850 0.13473 -0.23336 -0.41854
243 5PX 0.00679 0.02017 0.00989 0.01331 -0.02422
244 5PY 0.02800 0.00679 0.02473 0.00989 0.01399
245 5PZ 0.02386 -0.04133 0.00591 -0.01023 -0.00116
246 6PX -0.04707 -0.15568 -0.06081 -0.13148 0.24640
247 6PY -0.21004 -0.04707 -0.20170 -0.06081 -0.14226
248 6PZ -0.16955 0.29366 -0.04723 0.08180 0.04020
249 7PX -0.04324 0.11833 -0.01854 0.30376 -0.64838
250 7PY 0.06840 -0.04324 0.28235 -0.01854 0.37434
251 7PZ 0.19621 -0.33985 0.06916 -0.11979 -0.39731
252 8D 0 0.00677 -0.01172 -0.00022 0.00039 0.00083
253 8D+1 -0.00165 -0.01498 0.00894 0.01154 0.00631
254 8D-1 -0.01688 -0.00165 0.02186 0.00894 -0.00364
255 8D+2 0.00948 0.00620 0.00323 -0.00553 0.00541
256 8D-2 0.00620 0.00233 -0.00553 0.00961 -0.00937
257 9D 0 -0.05196 0.08999 0.01460 -0.02529 -0.01645
258 9D+1 0.00450 0.13360 -0.05865 -0.10142 -0.05558
259 9D-1 0.13880 0.00450 -0.16914 -0.05865 0.03209
260 9D+2 -0.08068 -0.04336 -0.03770 0.05424 -0.04684
261 9D-2 -0.04336 -0.03061 0.05424 -0.10034 0.08113
262 10F 0 -0.00143 0.00248 -0.00158 0.00274 0.00311
263 10F+1 0.00651 -0.01302 0.00913 -0.01028 0.00245
264 10F-1 -0.00551 0.00651 0.00026 0.00913 -0.00142
265 10F+2 0.00741 -0.00063 0.01130 0.00408 -0.00343
266 10F-2 -0.00063 0.00814 0.00408 0.00658 0.00595
267 10F+3 0.00837 0.00483 0.00743 0.00429 0.00000
268 10F-3 0.00461 -0.00799 0.00442 -0.00766 0.01335
269 8 H 1S 0.00100 0.00173 -0.00155 -0.00268 -0.01170
270 2S -0.01887 -0.03269 0.04022 0.06966 0.11563
271 3S 0.13456 0.23306 0.01055 0.01828 -1.09792
272 4S 0.28204 0.48850 0.13473 0.23336 -0.41854
273 5PX -0.00679 0.02017 -0.00989 0.01331 0.02422
274 5PY 0.02800 -0.00679 0.02473 -0.00989 0.01399
275 5PZ 0.02386 0.04133 0.00591 0.01023 -0.00116
276 6PX 0.04707 -0.15568 0.06081 -0.13148 -0.24640
277 6PY -0.21004 0.04707 -0.20170 0.06081 -0.14226
278 6PZ -0.16955 -0.29366 -0.04723 -0.08180 0.04020
279 7PX 0.04324 0.11833 0.01854 0.30376 0.64838
280 7PY 0.06840 0.04324 0.28235 0.01854 0.37434
281 7PZ 0.19621 0.33985 0.06916 0.11979 -0.39731
282 8D 0 0.00677 0.01172 -0.00022 -0.00039 0.00083
283 8D+1 0.00165 -0.01498 -0.00894 0.01154 -0.00631
284 8D-1 -0.01688 0.00165 0.02186 -0.00894 -0.00364
285 8D+2 0.00948 -0.00620 0.00323 0.00553 0.00541
286 8D-2 -0.00620 0.00233 0.00553 0.00961 0.00937
287 9D 0 -0.05196 -0.08999 0.01460 0.02529 -0.01645
288 9D+1 -0.00450 0.13360 0.05865 -0.10142 0.05558
289 9D-1 0.13880 -0.00450 -0.16914 0.05865 0.03209
290 9D+2 -0.08068 0.04336 -0.03770 -0.05424 -0.04684
291 9D-2 0.04336 -0.03061 -0.05424 -0.10034 -0.08113
292 10F 0 -0.00143 -0.00248 -0.00158 -0.00274 0.00311
293 10F+1 -0.00651 -0.01302 -0.00913 -0.01028 -0.00245
294 10F-1 -0.00551 -0.00651 0.00026 -0.00913 -0.00142
295 10F+2 0.00741 0.00063 0.01130 -0.00408 -0.00343
296 10F-2 0.00063 0.00814 -0.00408 0.00658 -0.00595
297 10F+3 -0.00837 0.00483 -0.00743 0.00429 0.00000
298 10F-3 0.00461 0.00799 0.00442 0.00766 0.01335
116 117 118 119 120
(A2U)--V (EU)--V (EU)--V (EG)--V (EG)--V
Eigenvalues -- 2.24301 2.25222 2.25222 2.28104 2.28104
1 1 Si 1S -0.01760 0.00000 0.00000 0.00000 0.00000
2 2S -0.00840 0.00000 0.00000 0.00000 0.00000
3 3S -0.23285 0.00000 0.00000 0.00000 0.00000
4 4S -3.79116 0.00000 0.00000 0.00000 0.00000
5 5S 8.71933 0.00000 0.00000 0.00000 0.00000
6 6S 1.89156 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 -0.04139 -0.02067 0.00000
8 7PY 0.00000 -0.04139 0.00000 0.00000 -0.02067
9 7PZ -0.10458 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 -0.02376 -0.01035 0.00000
11 8PY 0.00000 -0.02376 0.00000 0.00000 -0.01035
12 8PZ -0.06177 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 0.06165 -0.02784 0.00000
14 9PY 0.00000 0.06165 0.00000 0.00000 -0.02784
15 9PZ 0.36846 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 1.53721 1.17237 0.00000
17 10PY 0.00000 1.53721 0.00000 0.00000 1.17237
18 10PZ 1.56037 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.09090 0.62425 0.00000
20 11PY 0.00000 0.09090 0.00000 0.00000 0.62425
21 11PZ -0.11921 0.00000 0.00000 0.00000 0.00000
22 12D 0 -0.39438 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.27780 0.12261 0.00000
24 12D-1 0.00000 0.27780 0.00000 0.00000 0.12261
25 12D+2 0.00000 -0.42263 0.00000 0.00000 -0.46017
26 12D-2 0.00000 0.00000 -0.42263 -0.46017 0.00000
27 13D 0 -0.60341 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.97114 0.73273 0.00000
29 13D-1 0.00000 0.97114 0.00000 0.00000 0.73273
30 13D+2 0.00000 0.35720 0.00000 0.00000 0.15032
31 13D-2 0.00000 0.00000 0.35720 0.15032 0.00000
32 14D 0 0.00050 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 -0.69288 -0.49724 0.00000
34 14D-1 0.00000 -0.69288 0.00000 0.00000 -0.49724
35 14D+2 0.00000 -0.54707 0.00000 0.00000 -0.32579
36 14D-2 0.00000 0.00000 -0.54707 -0.32579 0.00000
37 15F 0 -0.80580 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.00000 -0.18682 0.63746 0.00000
39 15F-1 0.00000 -0.18682 0.00000 0.00000 0.63746
40 15F+2 0.00000 -0.09460 0.00000 0.00000 -0.55937
41 15F-2 0.00000 0.00000 -0.09460 -0.55937 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -1.30552 0.00000 0.00000 0.00000 0.00000
44 16F 0 -0.12961 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 0.00000 0.22505 -0.06712 0.00000
46 16F-1 0.00000 0.22505 0.00000 0.00000 -0.06712
47 16F+2 0.00000 0.00902 0.00000 0.00000 0.32647
48 16F-2 0.00000 0.00000 0.00902 0.32647 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.31720 0.00000 0.00000 0.00000 0.00000
51 17G 0 -0.12986 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 0.00000 -0.15863 -0.21409 0.00000
53 17G-1 0.00000 -0.15863 0.00000 0.00000 -0.21409
54 17G+2 0.00000 -0.15509 0.00000 0.00000 -0.37884
55 17G-2 0.00000 0.00000 -0.15509 -0.37884 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.49004 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.23387 0.00000 0.00000 0.07906
59 17G-4 0.00000 0.00000 -0.23387 -0.07906 0.00000
60 2 Si 1S 0.01760 0.00000 0.00000 0.00000 0.00000
61 2S 0.00840 0.00000 0.00000 0.00000 0.00000
62 3S 0.23285 0.00000 0.00000 0.00000 0.00000
63 4S 3.79116 0.00000 0.00000 0.00000 0.00000
64 5S -8.71933 0.00000 0.00000 0.00000 0.00000
65 6S -1.89156 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 0.00000 -0.04139 0.02067 0.00000
67 7PY 0.00000 -0.04139 0.00000 0.00000 0.02067
68 7PZ -0.10458 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 0.00000 -0.02376 0.01035 0.00000
70 8PY 0.00000 -0.02376 0.00000 0.00000 0.01035
71 8PZ -0.06177 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 0.00000 0.06165 0.02784 0.00000
73 9PY 0.00000 0.06165 0.00000 0.00000 0.02784
74 9PZ 0.36846 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 0.00000 1.53721 -1.17237 0.00000
76 10PY 0.00000 1.53721 0.00000 0.00000 -1.17237
77 10PZ 1.56037 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 0.00000 0.09090 -0.62425 0.00000
79 11PY 0.00000 0.09090 0.00000 0.00000 -0.62425
80 11PZ -0.11921 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.39438 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.00000 -0.27780 0.12261 0.00000
83 12D-1 0.00000 -0.27780 0.00000 0.00000 0.12261
84 12D+2 0.00000 0.42263 0.00000 0.00000 -0.46017
85 12D-2 0.00000 0.00000 0.42263 -0.46017 0.00000
86 13D 0 0.60341 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.00000 -0.97114 0.73273 0.00000
88 13D-1 0.00000 -0.97114 0.00000 0.00000 0.73273
89 13D+2 0.00000 -0.35720 0.00000 0.00000 0.15032
90 13D-2 0.00000 0.00000 -0.35720 0.15032 0.00000
91 14D 0 -0.00050 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.00000 0.69288 -0.49724 0.00000
93 14D-1 0.00000 0.69288 0.00000 0.00000 -0.49724
94 14D+2 0.00000 0.54707 0.00000 0.00000 -0.32579
95 14D-2 0.00000 0.00000 0.54707 -0.32579 0.00000
96 15F 0 -0.80580 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.00000 -0.18682 -0.63746 0.00000
98 15F-1 0.00000 -0.18682 0.00000 0.00000 -0.63746
99 15F+2 0.00000 -0.09460 0.00000 0.00000 0.55937
100 15F-2 0.00000 0.00000 -0.09460 0.55937 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 -1.30552 0.00000 0.00000 0.00000 0.00000
103 16F 0 -0.12961 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.00000 0.22505 0.06712 0.00000
105 16F-1 0.00000 0.22505 0.00000 0.00000 0.06712
106 16F+2 0.00000 0.00902 0.00000 0.00000 -0.32647
107 16F-2 0.00000 0.00000 0.00902 -0.32647 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.31720 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.12986 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.00000 0.15863 -0.21409 0.00000
112 17G-1 0.00000 0.15863 0.00000 0.00000 -0.21409
113 17G+2 0.00000 0.15509 0.00000 0.00000 -0.37884
114 17G-2 0.00000 0.00000 0.15509 -0.37884 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.49004 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 -0.23387 0.00000 0.00000 0.07906
118 17G-4 0.00000 0.00000 0.23387 -0.07906 0.00000
119 3 H 1S 0.01185 0.00558 0.00000 0.00000 0.00268
120 2S 0.33382 0.07391 0.00000 0.00000 0.01632
121 3S -3.47008 -1.27942 0.00000 0.00000 -0.94297
122 4S -0.24938 -0.29149 0.00000 0.00000 -0.57806
123 5PX 0.00000 0.00000 -0.01581 -0.02471 0.00000
124 5PY -0.01755 -0.00470 0.00000 0.00000 -0.00923
125 5PZ -0.04101 -0.01521 0.00000 0.00000 -0.00809
126 6PX 0.00000 0.00000 0.14244 0.20458 0.00000
127 6PY 0.14963 0.03215 0.00000 0.00000 0.08043
128 6PZ 0.32922 0.13983 0.00000 0.00000 0.09289
129 7PX 0.00000 0.00000 -0.43370 -0.17335 0.00000
130 7PY 1.02368 0.44151 0.00000 0.00000 0.39292
131 7PZ 0.17577 -0.09726 0.00000 0.00000 -0.51546
132 8D 0 -0.00223 -0.01422 0.00000 0.00000 0.02576
133 8D+1 0.00000 0.00000 0.01094 0.01748 0.00000
134 8D-1 -0.00246 0.01052 0.00000 0.00000 -0.01339
135 8D+2 0.00788 0.01400 0.00000 0.00000 -0.01971
136 8D-2 0.00000 0.00000 -0.00094 -0.00196 0.00000
137 9D 0 0.03953 0.14967 0.00000 0.00000 -0.15304
138 9D+1 0.00000 0.00000 -0.06268 -0.13045 0.00000
139 9D-1 -0.01323 -0.07869 0.00000 0.00000 0.14807
140 9D+2 0.00415 -0.06814 0.00000 0.00000 0.19294
141 9D-2 0.00000 0.00000 0.06825 0.04025 0.00000
142 10F 0 0.00337 0.00218 0.00000 0.00000 0.00754
143 10F+1 0.00000 0.00000 0.00047 -0.00131 0.00000
144 10F-1 -0.01068 -0.02363 0.00000 0.00000 -0.02222
145 10F+2 0.00470 0.01038 0.00000 0.00000 0.01545
146 10F-2 0.00000 0.00000 -0.01985 -0.01897 0.00000
147 10F+3 0.00000 0.00000 0.02702 0.01580 0.00000
148 10F-3 -0.01219 -0.00846 0.00000 0.00000 -0.00391
149 4 H 1S 0.01185 -0.00279 -0.00483 -0.00232 -0.00134
150 2S 0.33382 -0.03695 -0.06401 -0.01413 -0.00816
151 3S -3.47008 0.63971 1.10801 0.81664 0.47149
152 4S -0.24938 0.14575 0.25244 0.50062 0.28903
153 5PX 0.01520 0.00481 -0.00748 -0.01310 0.00670
154 5PY 0.00877 -0.01304 0.00481 0.00670 -0.02084
155 5PZ -0.04101 0.00760 0.01317 0.00701 0.00404
156 6PX -0.12958 -0.04775 0.05972 0.11146 -0.05376
157 6PY -0.07482 0.11486 -0.04775 -0.05376 0.17354
158 6PZ 0.32922 -0.06991 -0.12109 -0.08044 -0.04644
159 7PX -0.88653 0.37898 0.22271 0.25136 0.24520
160 7PY -0.51184 -0.21489 0.37898 0.24520 -0.03178
161 7PZ 0.17577 0.04863 0.08423 0.44640 0.25773
162 8D 0 -0.00223 0.00711 0.01232 -0.02231 -0.01288
163 8D+1 0.00213 -0.00018 0.01062 -0.00567 -0.01337
164 8D-1 0.00123 0.01083 -0.00018 -0.01337 0.00977
165 8D+2 -0.00394 0.00280 0.00647 -0.00769 -0.00640
166 8D-2 -0.00682 0.00647 0.01027 -0.01527 -0.00769
167 9D 0 0.03953 -0.07484 -0.12962 0.13253 0.07652
168 9D+1 0.01146 -0.00693 -0.07469 0.07844 0.12060
169 9D-1 0.00662 -0.06669 -0.00693 0.12060 -0.06082
170 9D+2 -0.00208 0.03415 -0.05906 0.06611 0.07842
171 9D-2 -0.00360 -0.05906 -0.03405 0.15476 0.06611
172 10F 0 0.00337 -0.00109 -0.00189 -0.00653 -0.00377
173 10F+1 0.00925 -0.01044 -0.01760 -0.01699 -0.00906
174 10F-1 0.00534 -0.00555 -0.01044 -0.00906 -0.00654
175 10F+2 -0.00235 -0.01229 0.01309 0.01490 -0.01037
176 10F-2 -0.00407 0.01309 0.00283 0.00684 0.01490
177 10F+3 0.00000 0.02340 -0.01351 -0.00790 0.01369
178 10F-3 -0.01219 0.00423 0.00733 0.00339 0.00196
179 5 H 1S 0.01185 -0.00279 0.00483 0.00232 -0.00134
180 2S 0.33382 -0.03695 0.06401 0.01413 -0.00816
181 3S -3.47008 0.63971 -1.10801 -0.81664 0.47149
182 4S -0.24938 0.14575 -0.25244 -0.50062 0.28903
183 5PX -0.01520 -0.00481 -0.00748 -0.01310 -0.00670
184 5PY 0.00877 -0.01304 -0.00481 -0.00670 -0.02084
185 5PZ -0.04101 0.00760 -0.01317 -0.00701 0.00404
186 6PX 0.12958 0.04775 0.05972 0.11146 0.05376
187 6PY -0.07482 0.11486 0.04775 0.05376 0.17354
188 6PZ 0.32922 -0.06991 0.12109 0.08044 -0.04644
189 7PX 0.88653 -0.37898 0.22271 0.25136 -0.24520
190 7PY -0.51184 -0.21489 -0.37898 -0.24520 -0.03178
191 7PZ 0.17577 0.04863 -0.08423 -0.44640 0.25773
192 8D 0 -0.00223 0.00711 -0.01232 0.02231 -0.01288
193 8D+1 -0.00213 0.00018 0.01062 -0.00567 0.01337
194 8D-1 0.00123 0.01083 0.00018 0.01337 0.00977
195 8D+2 -0.00394 0.00280 -0.00647 0.00769 -0.00640
196 8D-2 0.00682 -0.00647 0.01027 -0.01527 0.00769
197 9D 0 0.03953 -0.07484 0.12962 -0.13253 0.07652
198 9D+1 -0.01146 0.00693 -0.07469 0.07844 -0.12060
199 9D-1 0.00662 -0.06669 0.00693 -0.12060 -0.06082
200 9D+2 -0.00208 0.03415 0.05906 -0.06611 0.07842
201 9D-2 0.00360 0.05906 -0.03405 0.15476 -0.06611
202 10F 0 0.00337 -0.00109 0.00189 0.00653 -0.00377
203 10F+1 -0.00925 0.01044 -0.01760 -0.01699 0.00906
204 10F-1 0.00534 -0.00555 0.01044 0.00906 -0.00654
205 10F+2 -0.00235 -0.01229 -0.01309 -0.01490 -0.01037
206 10F-2 0.00407 -0.01309 0.00283 0.00684 -0.01490
207 10F+3 0.00000 -0.02340 -0.01351 -0.00790 -0.01369
208 10F-3 -0.01219 0.00423 -0.00733 -0.00339 0.00196
209 6 H 1S -0.01185 -0.00558 0.00000 0.00000 0.00268
210 2S -0.33382 -0.07391 0.00000 0.00000 0.01632
211 3S 3.47008 1.27942 0.00000 0.00000 -0.94297
212 4S 0.24938 0.29149 0.00000 0.00000 -0.57806
213 5PX 0.00000 0.00000 -0.01581 0.02471 0.00000
214 5PY -0.01755 -0.00470 0.00000 0.00000 0.00923
215 5PZ -0.04101 -0.01521 0.00000 0.00000 0.00809
216 6PX 0.00000 0.00000 0.14244 -0.20458 0.00000
217 6PY 0.14963 0.03215 0.00000 0.00000 -0.08043
218 6PZ 0.32922 0.13983 0.00000 0.00000 -0.09289
219 7PX 0.00000 0.00000 -0.43370 0.17335 0.00000
220 7PY 1.02368 0.44151 0.00000 0.00000 -0.39292
221 7PZ 0.17577 -0.09726 0.00000 0.00000 0.51546
222 8D 0 0.00223 0.01422 0.00000 0.00000 0.02576
223 8D+1 0.00000 0.00000 -0.01094 0.01748 0.00000
224 8D-1 0.00246 -0.01052 0.00000 0.00000 -0.01339
225 8D+2 -0.00788 -0.01400 0.00000 0.00000 -0.01971
226 8D-2 0.00000 0.00000 0.00094 -0.00196 0.00000
227 9D 0 -0.03953 -0.14967 0.00000 0.00000 -0.15304
228 9D+1 0.00000 0.00000 0.06268 -0.13045 0.00000
229 9D-1 0.01323 0.07869 0.00000 0.00000 0.14807
230 9D+2 -0.00415 0.06814 0.00000 0.00000 0.19294
231 9D-2 0.00000 0.00000 -0.06825 0.04025 0.00000
232 10F 0 0.00337 0.00218 0.00000 0.00000 -0.00754
233 10F+1 0.00000 0.00000 0.00047 0.00131 0.00000
234 10F-1 -0.01068 -0.02363 0.00000 0.00000 0.02222
235 10F+2 0.00470 0.01038 0.00000 0.00000 -0.01545
236 10F-2 0.00000 0.00000 -0.01985 0.01897 0.00000
237 10F+3 0.00000 0.00000 0.02702 -0.01580 0.00000
238 10F-3 -0.01219 -0.00846 0.00000 0.00000 0.00391
239 7 H 1S -0.01185 0.00279 -0.00483 0.00232 -0.00134
240 2S -0.33382 0.03695 -0.06401 0.01413 -0.00816
241 3S 3.47008 -0.63971 1.10801 -0.81664 0.47149
242 4S 0.24938 -0.14575 0.25244 -0.50062 0.28903
243 5PX -0.01520 -0.00481 -0.00748 0.01310 0.00670
244 5PY 0.00877 -0.01304 -0.00481 0.00670 0.02084
245 5PZ -0.04101 0.00760 -0.01317 0.00701 -0.00404
246 6PX 0.12958 0.04775 0.05972 -0.11146 -0.05376
247 6PY -0.07482 0.11486 0.04775 -0.05376 -0.17354
248 6PZ 0.32922 -0.06991 0.12109 -0.08044 0.04644
249 7PX 0.88653 -0.37898 0.22271 -0.25136 0.24520
250 7PY -0.51184 -0.21489 -0.37898 0.24520 0.03178
251 7PZ 0.17577 0.04863 -0.08423 0.44640 -0.25773
252 8D 0 0.00223 -0.00711 0.01232 0.02231 -0.01288
253 8D+1 0.00213 -0.00018 -0.01062 -0.00567 0.01337
254 8D-1 -0.00123 -0.01083 -0.00018 0.01337 0.00977
255 8D+2 0.00394 -0.00280 0.00647 0.00769 -0.00640
256 8D-2 -0.00682 0.00647 -0.01027 -0.01527 0.00769
257 9D 0 -0.03953 0.07484 -0.12962 -0.13253 0.07652
258 9D+1 0.01146 -0.00693 0.07469 0.07844 -0.12060
259 9D-1 -0.00662 0.06669 -0.00693 -0.12060 -0.06082
260 9D+2 0.00208 -0.03415 -0.05906 -0.06611 0.07842
261 9D-2 -0.00360 -0.05906 0.03405 0.15476 -0.06611
262 10F 0 0.00337 -0.00109 0.00189 -0.00653 0.00377
263 10F+1 -0.00925 0.01044 -0.01760 0.01699 -0.00906
264 10F-1 0.00534 -0.00555 0.01044 -0.00906 0.00654
265 10F+2 -0.00235 -0.01229 -0.01309 0.01490 0.01037
266 10F-2 0.00407 -0.01309 0.00283 -0.00684 0.01490
267 10F+3 0.00000 -0.02340 -0.01351 0.00790 0.01369
268 10F-3 -0.01219 0.00423 -0.00733 0.00339 -0.00196
269 8 H 1S -0.01185 0.00279 0.00483 -0.00232 -0.00134
270 2S -0.33382 0.03695 0.06401 -0.01413 -0.00816
271 3S 3.47008 -0.63971 -1.10801 0.81664 0.47149
272 4S 0.24938 -0.14575 -0.25244 0.50062 0.28903
273 5PX 0.01520 0.00481 -0.00748 0.01310 -0.00670
274 5PY 0.00877 -0.01304 0.00481 -0.00670 0.02084
275 5PZ -0.04101 0.00760 0.01317 -0.00701 -0.00404
276 6PX -0.12958 -0.04775 0.05972 -0.11146 0.05376
277 6PY -0.07482 0.11486 -0.04775 0.05376 -0.17354
278 6PZ 0.32922 -0.06991 -0.12109 0.08044 0.04644
279 7PX -0.88653 0.37898 0.22271 -0.25136 -0.24520
280 7PY -0.51184 -0.21489 0.37898 -0.24520 0.03178
281 7PZ 0.17577 0.04863 0.08423 -0.44640 -0.25773
282 8D 0 0.00223 -0.00711 -0.01232 -0.02231 -0.01288
283 8D+1 -0.00213 0.00018 -0.01062 -0.00567 -0.01337
284 8D-1 -0.00123 -0.01083 0.00018 -0.01337 0.00977
285 8D+2 0.00394 -0.00280 -0.00647 -0.00769 -0.00640
286 8D-2 0.00682 -0.00647 -0.01027 -0.01527 -0.00769
287 9D 0 -0.03953 0.07484 0.12962 0.13253 0.07652
288 9D+1 -0.01146 0.00693 0.07469 0.07844 0.12060
289 9D-1 -0.00662 0.06669 0.00693 0.12060 -0.06082
290 9D+2 0.00208 -0.03415 0.05906 0.06611 0.07842
291 9D-2 0.00360 0.05906 0.03405 0.15476 0.06611
292 10F 0 0.00337 -0.00109 -0.00189 0.00653 0.00377
293 10F+1 0.00925 -0.01044 -0.01760 0.01699 0.00906
294 10F-1 0.00534 -0.00555 -0.01044 0.00906 0.00654
295 10F+2 -0.00235 -0.01229 0.01309 -0.01490 0.01037
296 10F-2 -0.00407 0.01309 0.00283 -0.00684 -0.01490
297 10F+3 0.00000 0.02340 -0.01351 0.00790 -0.01369
298 10F-3 -0.01219 0.00423 0.00733 -0.00339 -0.00196
121 122 123 124 125
(A1G)--V (A1U)--V (EU)--V (EU)--V (A2U)--V
Eigenvalues -- 2.28104 2.28714 2.36872 2.36872 2.40808
1 1 Si 1S 0.00277 0.00000 0.00000 0.00000 -0.01075
2 2S 0.01916 0.00000 0.00000 0.00000 0.04302
3 3S 0.05431 0.00000 0.00000 0.00000 -0.07203
4 4S -0.17746 0.00000 0.00000 0.00000 -1.88837
5 5S 1.07748 0.00000 0.00000 0.00000 6.17838
6 6S 0.25209 0.00000 0.00000 0.00000 -1.38339
7 7PX 0.00000 0.00000 -0.07838 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 -0.07838 0.00000
9 7PZ -0.08738 0.00000 0.00000 0.00000 -0.08179
10 8PX 0.00000 0.00000 -0.02931 0.00000 0.00000
11 8PY 0.00000 0.00000 0.00000 -0.02931 0.00000
12 8PZ 0.00053 0.00000 0.00000 0.00000 -0.07369
13 9PX 0.00000 0.00000 0.39025 0.00000 0.00000
14 9PY 0.00000 0.00000 0.00000 0.39025 0.00000
15 9PZ 0.63740 0.00000 0.00000 0.00000 0.37389
16 10PX 0.00000 0.00000 1.95659 0.00000 0.00000
17 10PY 0.00000 0.00000 0.00000 1.95659 0.00000
18 10PZ 0.17305 0.00000 0.00000 0.00000 2.23235
19 11PX 0.00000 0.00000 0.12111 0.00000 0.00000
20 11PY 0.00000 0.00000 0.00000 0.12111 0.00000
21 11PZ -0.51772 0.00000 0.00000 0.00000 0.69188
22 12D 0 0.63389 0.00000 0.00000 0.00000 -0.46294
23 12D+1 0.00000 0.00000 0.44203 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.44203 0.00000
25 12D+2 0.00000 0.00000 0.00000 -0.69244 0.00000
26 12D-2 0.00000 0.00000 -0.69244 0.00000 0.00000
27 13D 0 -0.77893 0.00000 0.00000 0.00000 -0.77447
28 13D+1 0.00000 0.00000 -0.16992 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 -0.16992 0.00000
30 13D+2 0.00000 0.00000 0.00000 -0.83446 0.00000
31 13D-2 0.00000 0.00000 -0.83446 0.00000 0.00000
32 14D 0 0.39857 0.00000 0.00000 0.00000 0.12843
33 14D+1 0.00000 0.00000 0.27035 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.27035 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.37055 0.00000
36 14D-2 0.00000 0.00000 0.37055 0.00000 0.00000
37 15F 0 -0.28789 0.00000 0.00000 0.00000 0.10858
38 15F+1 0.00000 0.00000 -0.73790 0.00000 0.00000
39 15F-1 0.00000 0.00000 0.00000 -0.73790 0.00000
40 15F+2 0.00000 0.00000 0.00000 0.77565 0.00000
41 15F-2 0.00000 0.00000 0.77565 0.00000 0.00000
42 15F+3 0.00000 0.74763 0.00000 0.00000 0.00000
43 15F-3 0.36548 0.00000 0.00000 0.00000 -0.00736
44 16F 0 0.06487 0.00000 0.00000 0.00000 -0.46882
45 16F+1 0.00000 0.00000 0.19200 0.00000 0.00000
46 16F-1 0.00000 0.00000 0.00000 0.19200 0.00000
47 16F+2 0.00000 0.00000 0.00000 -0.54011 0.00000
48 16F-2 0.00000 0.00000 -0.54011 0.00000 0.00000
49 16F+3 0.00000 -0.24915 0.00000 0.00000 0.00000
50 16F-3 -0.60511 0.00000 0.00000 0.00000 -0.43905
51 17G 0 0.24818 0.00000 0.00000 0.00000 -0.39686
52 17G+1 0.00000 0.00000 -0.11218 0.00000 0.00000
53 17G-1 0.00000 0.00000 0.00000 -0.11218 0.00000
54 17G+2 0.00000 0.00000 0.00000 -0.18620 0.00000
55 17G-2 0.00000 0.00000 -0.18620 0.00000 0.00000
56 17G+3 0.00000 0.19073 0.00000 0.00000 0.00000
57 17G-3 0.14958 0.00000 0.00000 0.00000 0.11776
58 17G+4 0.00000 0.00000 0.00000 0.09662 0.00000
59 17G-4 0.00000 0.00000 -0.09662 0.00000 0.00000
60 2 Si 1S 0.00277 0.00000 0.00000 0.00000 0.01075
61 2S 0.01916 0.00000 0.00000 0.00000 -0.04302
62 3S 0.05431 0.00000 0.00000 0.00000 0.07203
63 4S -0.17746 0.00000 0.00000 0.00000 1.88837
64 5S 1.07748 0.00000 0.00000 0.00000 -6.17838
65 6S 0.25209 0.00000 0.00000 0.00000 1.38339
66 7PX 0.00000 0.00000 -0.07838 0.00000 0.00000
67 7PY 0.00000 0.00000 0.00000 -0.07838 0.00000
68 7PZ 0.08738 0.00000 0.00000 0.00000 -0.08179
69 8PX 0.00000 0.00000 -0.02931 0.00000 0.00000
70 8PY 0.00000 0.00000 0.00000 -0.02931 0.00000
71 8PZ -0.00053 0.00000 0.00000 0.00000 -0.07369
72 9PX 0.00000 0.00000 0.39025 0.00000 0.00000
73 9PY 0.00000 0.00000 0.00000 0.39025 0.00000
74 9PZ -0.63740 0.00000 0.00000 0.00000 0.37389
75 10PX 0.00000 0.00000 1.95659 0.00000 0.00000
76 10PY 0.00000 0.00000 0.00000 1.95659 0.00000
77 10PZ -0.17305 0.00000 0.00000 0.00000 2.23235
78 11PX 0.00000 0.00000 0.12111 0.00000 0.00000
79 11PY 0.00000 0.00000 0.00000 0.12111 0.00000
80 11PZ 0.51772 0.00000 0.00000 0.00000 0.69188
81 12D 0 0.63389 0.00000 0.00000 0.00000 0.46294
82 12D+1 0.00000 0.00000 -0.44203 0.00000 0.00000
83 12D-1 0.00000 0.00000 0.00000 -0.44203 0.00000
84 12D+2 0.00000 0.00000 0.00000 0.69244 0.00000
85 12D-2 0.00000 0.00000 0.69244 0.00000 0.00000
86 13D 0 -0.77893 0.00000 0.00000 0.00000 0.77447
87 13D+1 0.00000 0.00000 0.16992 0.00000 0.00000
88 13D-1 0.00000 0.00000 0.00000 0.16992 0.00000
89 13D+2 0.00000 0.00000 0.00000 0.83446 0.00000
90 13D-2 0.00000 0.00000 0.83446 0.00000 0.00000
91 14D 0 0.39857 0.00000 0.00000 0.00000 -0.12843
92 14D+1 0.00000 0.00000 -0.27035 0.00000 0.00000
93 14D-1 0.00000 0.00000 0.00000 -0.27035 0.00000
94 14D+2 0.00000 0.00000 0.00000 -0.37055 0.00000
95 14D-2 0.00000 0.00000 -0.37055 0.00000 0.00000
96 15F 0 0.28789 0.00000 0.00000 0.00000 0.10858
97 15F+1 0.00000 0.00000 -0.73790 0.00000 0.00000
98 15F-1 0.00000 0.00000 0.00000 -0.73790 0.00000
99 15F+2 0.00000 0.00000 0.00000 0.77565 0.00000
100 15F-2 0.00000 0.00000 0.77565 0.00000 0.00000
101 15F+3 0.00000 0.74763 0.00000 0.00000 0.00000
102 15F-3 -0.36548 0.00000 0.00000 0.00000 -0.00736
103 16F 0 -0.06487 0.00000 0.00000 0.00000 -0.46882
104 16F+1 0.00000 0.00000 0.19200 0.00000 0.00000
105 16F-1 0.00000 0.00000 0.00000 0.19200 0.00000
106 16F+2 0.00000 0.00000 0.00000 -0.54011 0.00000
107 16F-2 0.00000 0.00000 -0.54011 0.00000 0.00000
108 16F+3 0.00000 -0.24915 0.00000 0.00000 0.00000
109 16F-3 0.60511 0.00000 0.00000 0.00000 -0.43905
110 17G 0 0.24818 0.00000 0.00000 0.00000 0.39686
111 17G+1 0.00000 0.00000 0.11218 0.00000 0.00000
112 17G-1 0.00000 0.00000 0.00000 0.11218 0.00000
113 17G+2 0.00000 0.00000 0.00000 0.18620 0.00000
114 17G-2 0.00000 0.00000 0.18620 0.00000 0.00000
115 17G+3 0.00000 -0.19073 0.00000 0.00000 0.00000
116 17G-3 0.14958 0.00000 0.00000 0.00000 -0.11776
117 17G+4 0.00000 0.00000 0.00000 -0.09662 0.00000
118 17G-4 0.00000 0.00000 0.09662 0.00000 0.00000
119 3 H 1S -0.00343 0.00000 0.00000 0.00182 -0.00800
120 2S 0.09413 0.00000 0.00000 0.20516 0.25952
121 3S -0.56826 0.00000 0.00000 -1.77031 -1.94721
122 4S -0.09033 0.00000 0.00000 -0.52283 -0.39953
123 5PX 0.00000 -0.00252 0.01399 0.00000 0.00000
124 5PY -0.00204 0.00000 0.00000 0.01114 0.03411
125 5PZ 0.03346 0.00000 0.00000 -0.02899 -0.01866
126 6PX 0.00000 0.01605 -0.11490 0.00000 0.00000
127 6PY -0.02665 0.00000 0.00000 -0.13381 -0.35027
128 6PZ -0.28927 0.00000 0.00000 0.21698 0.11999
129 7PX 0.00000 0.35419 -0.06770 0.00000 0.00000
130 7PY 0.47671 0.00000 0.00000 0.67290 1.36902
131 7PZ 0.43247 0.00000 0.00000 0.61101 0.20141
132 8D 0 -0.00910 0.00000 0.00000 -0.03126 -0.01291
133 8D+1 0.00000 0.04913 0.00055 0.00000 0.00000
134 8D-1 -0.00308 0.00000 0.00000 0.02621 0.01335
135 8D+2 -0.00804 0.00000 0.00000 0.01734 -0.00126
136 8D-2 0.00000 -0.01980 -0.00880 0.00000 0.00000
137 9D 0 0.07372 0.00000 0.00000 0.26474 0.11962
138 9D+1 0.00000 -0.40340 -0.01962 0.00000 0.00000
139 9D-1 -0.01229 0.00000 0.00000 -0.27898 -0.13248
140 9D+2 0.07553 0.00000 0.00000 -0.09922 0.04717
141 9D-2 0.00000 0.13895 0.07711 0.00000 0.00000
142 10F 0 -0.01494 0.00000 0.00000 -0.00321 -0.00911
143 10F+1 0.00000 -0.00216 -0.00723 0.00000 0.00000
144 10F-1 0.01360 0.00000 0.00000 -0.00494 -0.01043
145 10F+2 -0.01905 0.00000 0.00000 -0.00605 -0.00567
146 10F-2 0.00000 0.00242 0.01076 0.00000 0.00000
147 10F+3 0.00000 -0.00388 -0.00704 0.00000 0.00000
148 10F-3 0.00473 0.00000 0.00000 -0.01124 -0.01807
149 4 H 1S -0.00343 0.00000 -0.00158 -0.00091 -0.00800
150 2S 0.09413 0.00000 -0.17767 -0.10258 0.25952
151 3S -0.56826 0.00000 1.53313 0.88516 -1.94721
152 4S -0.09033 0.00000 0.45278 0.26141 -0.39953
153 5PX 0.00176 0.00126 0.01185 -0.00123 -0.02954
154 5PY 0.00102 -0.00218 -0.00123 0.01328 -0.01706
155 5PZ 0.03346 0.00000 0.02511 0.01450 -0.01866
156 6PX 0.02308 -0.00803 -0.12908 -0.00819 0.30334
157 6PY 0.01332 0.01390 -0.00819 -0.11963 0.17514
158 6PZ -0.28927 0.00000 -0.18791 -0.10849 0.11999
159 7PX -0.41284 -0.17710 0.48775 0.32069 -1.18560
160 7PY -0.23836 0.30674 0.32069 0.11745 -0.68451
161 7PZ 0.43247 0.00000 -0.52915 -0.30550 0.20141
162 8D 0 -0.00910 0.00000 0.02707 0.01563 -0.01291
163 8D+1 0.00267 -0.02457 0.01980 0.01111 -0.01156
164 8D-1 0.00154 0.04255 0.01111 0.00697 -0.00667
165 8D+2 0.00402 -0.01715 0.01132 -0.00227 0.00063
166 8D-2 0.00696 0.00990 0.01080 0.01132 0.00109
167 9D 0 0.07372 0.00000 -0.22927 -0.13237 0.11962
168 9D+1 0.01065 0.20170 -0.21414 -0.11231 0.11473
169 9D-1 0.00615 -0.34936 -0.11231 -0.08446 0.06624
170 9D+2 -0.03777 0.12034 -0.07635 0.03303 -0.02359
171 9D-2 -0.06541 -0.06948 -0.05514 -0.07635 -0.04085
172 10F 0 -0.01494 0.00000 0.00278 0.00161 -0.00911
173 10F+1 -0.01177 0.00108 -0.00552 0.00099 0.00903
174 10F-1 -0.00680 -0.00187 0.00099 -0.00666 0.00522
175 10F+2 0.00953 0.00210 -0.00728 0.00655 0.00283
176 10F-2 0.01650 -0.00121 -0.00185 -0.00728 0.00491
177 10F+3 0.00000 -0.00388 0.00352 -0.00610 0.00000
178 10F-3 0.00473 0.00000 0.00974 0.00562 -0.01807
179 5 H 1S -0.00343 0.00000 0.00158 -0.00091 -0.00800
180 2S 0.09413 0.00000 0.17767 -0.10258 0.25952
181 3S -0.56826 0.00000 -1.53313 0.88516 -1.94721
182 4S -0.09033 0.00000 -0.45278 0.26141 -0.39953
183 5PX -0.00176 0.00126 0.01185 0.00123 0.02954
184 5PY 0.00102 0.00218 0.00123 0.01328 -0.01706
185 5PZ 0.03346 0.00000 -0.02511 0.01450 -0.01866
186 6PX -0.02308 -0.00803 -0.12908 0.00819 -0.30334
187 6PY 0.01332 -0.01390 0.00819 -0.11963 0.17514
188 6PZ -0.28927 0.00000 0.18791 -0.10849 0.11999
189 7PX 0.41284 -0.17710 0.48775 -0.32069 1.18560
190 7PY -0.23836 -0.30674 -0.32069 0.11745 -0.68451
191 7PZ 0.43247 0.00000 0.52915 -0.30550 0.20141
192 8D 0 -0.00910 0.00000 -0.02707 0.01563 -0.01291
193 8D+1 -0.00267 -0.02457 0.01980 -0.01111 0.01156
194 8D-1 0.00154 -0.04255 -0.01111 0.00697 -0.00667
195 8D+2 0.00402 0.01715 -0.01132 -0.00227 0.00063
196 8D-2 -0.00696 0.00990 0.01080 -0.01132 -0.00109
197 9D 0 0.07372 0.00000 0.22927 -0.13237 0.11962
198 9D+1 -0.01065 0.20170 -0.21414 0.11231 -0.11473
199 9D-1 0.00615 0.34936 0.11231 -0.08446 0.06624
200 9D+2 -0.03777 -0.12034 0.07635 0.03303 -0.02359
201 9D-2 0.06541 -0.06948 -0.05514 0.07635 0.04085
202 10F 0 -0.01494 0.00000 -0.00278 0.00161 -0.00911
203 10F+1 0.01177 0.00108 -0.00552 -0.00099 -0.00903
204 10F-1 -0.00680 0.00187 -0.00099 -0.00666 0.00522
205 10F+2 0.00953 -0.00210 0.00728 0.00655 0.00283
206 10F-2 -0.01650 -0.00121 -0.00185 0.00728 -0.00491
207 10F+3 0.00000 -0.00388 0.00352 0.00610 0.00000
208 10F-3 0.00473 0.00000 -0.00974 0.00562 -0.01807
209 6 H 1S -0.00343 0.00000 0.00000 -0.00182 0.00800
210 2S 0.09413 0.00000 0.00000 -0.20516 -0.25952
211 3S -0.56826 0.00000 0.00000 1.77031 1.94721
212 4S -0.09033 0.00000 0.00000 0.52283 0.39953
213 5PX 0.00000 -0.00252 0.01399 0.00000 0.00000
214 5PY 0.00204 0.00000 0.00000 0.01114 0.03411
215 5PZ -0.03346 0.00000 0.00000 -0.02899 -0.01866
216 6PX 0.00000 0.01605 -0.11490 0.00000 0.00000
217 6PY 0.02665 0.00000 0.00000 -0.13381 -0.35027
218 6PZ 0.28927 0.00000 0.00000 0.21698 0.11999
219 7PX 0.00000 0.35419 -0.06770 0.00000 0.00000
220 7PY -0.47671 0.00000 0.00000 0.67290 1.36902
221 7PZ -0.43247 0.00000 0.00000 0.61101 0.20141
222 8D 0 -0.00910 0.00000 0.00000 0.03126 0.01291
223 8D+1 0.00000 -0.04913 -0.00055 0.00000 0.00000
224 8D-1 -0.00308 0.00000 0.00000 -0.02621 -0.01335
225 8D+2 -0.00804 0.00000 0.00000 -0.01734 0.00126
226 8D-2 0.00000 0.01980 0.00880 0.00000 0.00000
227 9D 0 0.07372 0.00000 0.00000 -0.26474 -0.11962
228 9D+1 0.00000 0.40340 0.01962 0.00000 0.00000
229 9D-1 -0.01229 0.00000 0.00000 0.27898 0.13248
230 9D+2 0.07553 0.00000 0.00000 0.09922 -0.04717
231 9D-2 0.00000 -0.13895 -0.07711 0.00000 0.00000
232 10F 0 0.01494 0.00000 0.00000 -0.00321 -0.00911
233 10F+1 0.00000 -0.00216 -0.00723 0.00000 0.00000
234 10F-1 -0.01360 0.00000 0.00000 -0.00494 -0.01043
235 10F+2 0.01905 0.00000 0.00000 -0.00605 -0.00567
236 10F-2 0.00000 0.00242 0.01076 0.00000 0.00000
237 10F+3 0.00000 -0.00388 -0.00704 0.00000 0.00000
238 10F-3 -0.00473 0.00000 0.00000 -0.01124 -0.01807
239 7 H 1S -0.00343 0.00000 -0.00158 0.00091 0.00800
240 2S 0.09413 0.00000 -0.17767 0.10258 -0.25952
241 3S -0.56826 0.00000 1.53313 -0.88516 1.94721
242 4S -0.09033 0.00000 0.45278 -0.26141 0.39953
243 5PX 0.00176 0.00126 0.01185 0.00123 0.02954
244 5PY -0.00102 0.00218 0.00123 0.01328 -0.01706
245 5PZ -0.03346 0.00000 -0.02511 0.01450 -0.01866
246 6PX 0.02308 -0.00803 -0.12908 0.00819 -0.30334
247 6PY -0.01332 -0.01390 0.00819 -0.11963 0.17514
248 6PZ 0.28927 0.00000 0.18791 -0.10849 0.11999
249 7PX -0.41284 -0.17710 0.48775 -0.32069 1.18560
250 7PY 0.23836 -0.30674 -0.32069 0.11745 -0.68451
251 7PZ -0.43247 0.00000 0.52915 -0.30550 0.20141
252 8D 0 -0.00910 0.00000 0.02707 -0.01563 0.01291
253 8D+1 -0.00267 0.02457 -0.01980 0.01111 -0.01156
254 8D-1 0.00154 0.04255 0.01111 -0.00697 0.00667
255 8D+2 0.00402 -0.01715 0.01132 0.00227 -0.00063
256 8D-2 -0.00696 -0.00990 -0.01080 0.01132 0.00109
257 9D 0 0.07372 0.00000 -0.22927 0.13237 -0.11962
258 9D+1 -0.01065 -0.20170 0.21414 -0.11231 0.11473
259 9D-1 0.00615 -0.34936 -0.11231 0.08446 -0.06624
260 9D+2 -0.03777 0.12034 -0.07635 -0.03303 0.02359
261 9D-2 0.06541 0.06948 0.05514 -0.07635 -0.04085
262 10F 0 0.01494 0.00000 -0.00278 0.00161 -0.00911
263 10F+1 -0.01177 0.00108 -0.00552 -0.00099 -0.00903
264 10F-1 0.00680 0.00187 -0.00099 -0.00666 0.00522
265 10F+2 -0.00953 -0.00210 0.00728 0.00655 0.00283
266 10F-2 0.01650 -0.00121 -0.00185 0.00728 -0.00491
267 10F+3 0.00000 -0.00388 0.00352 0.00610 0.00000
268 10F-3 -0.00473 0.00000 -0.00974 0.00562 -0.01807
269 8 H 1S -0.00343 0.00000 0.00158 0.00091 0.00800
270 2S 0.09413 0.00000 0.17767 0.10258 -0.25952
271 3S -0.56826 0.00000 -1.53313 -0.88516 1.94721
272 4S -0.09033 0.00000 -0.45278 -0.26141 0.39953
273 5PX -0.00176 0.00126 0.01185 -0.00123 -0.02954
274 5PY -0.00102 -0.00218 -0.00123 0.01328 -0.01706
275 5PZ -0.03346 0.00000 0.02511 0.01450 -0.01866
276 6PX -0.02308 -0.00803 -0.12908 -0.00819 0.30334
277 6PY -0.01332 0.01390 -0.00819 -0.11963 0.17514
278 6PZ 0.28927 0.00000 -0.18791 -0.10849 0.11999
279 7PX 0.41284 -0.17710 0.48775 0.32069 -1.18560
280 7PY 0.23836 0.30674 0.32069 0.11745 -0.68451
281 7PZ -0.43247 0.00000 -0.52915 -0.30550 0.20141
282 8D 0 -0.00910 0.00000 -0.02707 -0.01563 0.01291
283 8D+1 0.00267 0.02457 -0.01980 -0.01111 0.01156
284 8D-1 0.00154 -0.04255 -0.01111 -0.00697 0.00667
285 8D+2 0.00402 0.01715 -0.01132 0.00227 -0.00063
286 8D-2 0.00696 -0.00990 -0.01080 -0.01132 -0.00109
287 9D 0 0.07372 0.00000 0.22927 0.13237 -0.11962
288 9D+1 0.01065 -0.20170 0.21414 0.11231 -0.11473
289 9D-1 0.00615 0.34936 0.11231 0.08446 -0.06624
290 9D+2 -0.03777 -0.12034 0.07635 -0.03303 0.02359
291 9D-2 -0.06541 0.06948 0.05514 0.07635 0.04085
292 10F 0 0.01494 0.00000 0.00278 0.00161 -0.00911
293 10F+1 0.01177 0.00108 -0.00552 0.00099 0.00903
294 10F-1 0.00680 -0.00187 0.00099 -0.00666 0.00522
295 10F+2 -0.00953 0.00210 -0.00728 0.00655 0.00283
296 10F-2 -0.01650 -0.00121 -0.00185 -0.00728 0.00491
297 10F+3 0.00000 -0.00388 0.00352 -0.00610 0.00000
298 10F-3 -0.00473 0.00000 0.00974 0.00562 -0.01807
126 127 128 129 130
(EG)--V (EG)--V (EG)--V (EG)--V (A2G)--V
Eigenvalues -- 2.41505 2.41505 2.44207 2.44207 2.45262
1 1 Si 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 0.02072 0.00000 -0.08963 0.00000 0.00000
8 7PY 0.00000 0.02072 0.00000 0.08963 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00469 0.00000 -0.03089 0.00000 0.00000
11 8PY 0.00000 0.00469 0.00000 0.03089 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX -0.15845 0.00000 0.28460 0.00000 0.00000
14 9PY 0.00000 -0.15845 0.00000 -0.28460 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 1.77193 0.00000 1.83474 0.00000 0.00000
17 10PY 0.00000 1.77193 0.00000 -1.83474 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.23672 0.00000 -0.25419 0.00000 0.00000
20 11PY 0.00000 0.23672 0.00000 0.25419 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 -0.60584 0.00000 1.48550 0.00000 0.00000
24 12D-1 0.00000 -0.60584 0.00000 -1.48550 0.00000
25 12D+2 0.00000 -0.44649 0.00000 0.77679 0.00000
26 12D-2 -0.44649 0.00000 -0.77679 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.02278 0.00000 0.53907 0.00000 0.00000
29 13D-1 0.00000 0.02278 0.00000 -0.53907 0.00000
30 13D+2 0.00000 -0.89629 0.00000 1.59833 0.00000
31 13D-2 -0.89629 0.00000 -1.59833 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.17629 0.00000 -0.00451 0.00000 0.00000
34 14D-1 0.00000 0.17629 0.00000 0.00451 0.00000
35 14D+2 0.00000 0.43139 0.00000 -0.64368 0.00000
36 14D-2 0.43139 0.00000 0.64368 0.00000 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15F+1 1.26327 0.00000 -0.99706 0.00000 0.00000
39 15F-1 0.00000 1.26327 0.00000 0.99706 0.00000
40 15F+2 0.00000 -0.69122 0.00000 0.99413 0.00000
41 15F-2 -0.69122 0.00000 -0.99413 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 1.27412
43 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
45 16F+1 -0.45441 0.00000 0.46419 0.00000 0.00000
46 16F-1 0.00000 -0.45441 0.00000 -0.46419 0.00000
47 16F+2 0.00000 0.12056 0.00000 -0.44174 0.00000
48 16F-2 0.12056 0.00000 0.44174 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 -0.49016
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
52 17G+1 -0.08355 0.00000 0.06255 0.00000 0.00000
53 17G-1 0.00000 -0.08355 0.00000 -0.06255 0.00000
54 17G+2 0.00000 -0.35892 0.00000 0.04465 0.00000
55 17G-2 -0.35892 0.00000 -0.04465 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.11332
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 -0.51050 0.00000 -0.09979 0.00000
59 17G-4 0.51050 0.00000 -0.09979 0.00000 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00000
61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
62 3S 0.00000 0.00000 0.00000 0.00000 0.00000
63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
64 5S 0.00000 0.00000 0.00000 0.00000 0.00000
65 6S 0.00000 0.00000 0.00000 0.00000 0.00000
66 7PX -0.02072 0.00000 0.08963 0.00000 0.00000
67 7PY 0.00000 -0.02072 0.00000 -0.08963 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
69 8PX -0.00469 0.00000 0.03089 0.00000 0.00000
70 8PY 0.00000 -0.00469 0.00000 -0.03089 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
72 9PX 0.15845 0.00000 -0.28460 0.00000 0.00000
73 9PY 0.00000 0.15845 0.00000 0.28460 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
75 10PX -1.77193 0.00000 -1.83474 0.00000 0.00000
76 10PY 0.00000 -1.77193 0.00000 1.83474 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
78 11PX -0.23672 0.00000 0.25419 0.00000 0.00000
79 11PY 0.00000 -0.23672 0.00000 -0.25419 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 12D+1 -0.60584 0.00000 1.48550 0.00000 0.00000
83 12D-1 0.00000 -0.60584 0.00000 -1.48550 0.00000
84 12D+2 0.00000 -0.44649 0.00000 0.77679 0.00000
85 12D-2 -0.44649 0.00000 -0.77679 0.00000 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.02278 0.00000 0.53907 0.00000 0.00000
88 13D-1 0.00000 0.02278 0.00000 -0.53907 0.00000
89 13D+2 0.00000 -0.89629 0.00000 1.59833 0.00000
90 13D-2 -0.89629 0.00000 -1.59833 0.00000 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.17629 0.00000 -0.00451 0.00000 0.00000
93 14D-1 0.00000 0.17629 0.00000 0.00451 0.00000
94 14D+2 0.00000 0.43139 0.00000 -0.64368 0.00000
95 14D-2 0.43139 0.00000 0.64368 0.00000 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
97 15F+1 -1.26327 0.00000 0.99706 0.00000 0.00000
98 15F-1 0.00000 -1.26327 0.00000 -0.99706 0.00000
99 15F+2 0.00000 0.69122 0.00000 -0.99413 0.00000
100 15F-2 0.69122 0.00000 0.99413 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 -1.27412
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.45441 0.00000 -0.46419 0.00000 0.00000
105 16F-1 0.00000 0.45441 0.00000 0.46419 0.00000
106 16F+2 0.00000 -0.12056 0.00000 0.44174 0.00000
107 16F-2 -0.12056 0.00000 -0.44174 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.49016
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
111 17G+1 -0.08355 0.00000 0.06255 0.00000 0.00000
112 17G-1 0.00000 -0.08355 0.00000 -0.06255 0.00000
113 17G+2 0.00000 -0.35892 0.00000 0.04465 0.00000
114 17G-2 -0.35892 0.00000 -0.04465 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.11332
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 -0.51050 0.00000 -0.09979 0.00000
118 17G-4 0.51050 0.00000 -0.09979 0.00000 0.00000
119 3 H 1S 0.00000 -0.00680 0.00000 -0.00720 0.00000
120 2S 0.00000 0.35905 0.00000 -0.25012 0.00000
121 3S 0.00000 -1.52876 0.00000 3.11242 0.00000
122 4S 0.00000 -0.12047 0.00000 0.17420 0.00000
123 5PX 0.02746 0.00000 -0.01674 0.00000 -0.02689
124 5PY 0.00000 -0.00609 0.00000 0.03415 0.00000
125 5PZ 0.00000 0.00974 0.00000 0.01811 0.00000
126 6PX -0.25570 0.00000 0.12139 0.00000 0.21659
127 6PY 0.00000 0.01912 0.00000 -0.30669 0.00000
128 6PZ 0.00000 -0.04729 0.00000 -0.15961 0.00000
129 7PX 0.75022 0.00000 0.21721 0.00000 0.38641
130 7PY 0.00000 0.66567 0.00000 -0.51128 0.00000
131 7PZ 0.00000 -0.28791 0.00000 -0.20796 0.00000
132 8D 0 0.00000 -0.00437 0.00000 -0.01195 0.00000
133 8D+1 -0.00332 0.00000 -0.02444 0.00000 0.03889
134 8D-1 0.00000 -0.02109 0.00000 -0.00495 0.00000
135 8D+2 0.00000 -0.01338 0.00000 -0.00045 0.00000
136 8D-2 0.00984 0.00000 0.00097 0.00000 -0.02568
137 9D 0 0.00000 0.06650 0.00000 0.08709 0.00000
138 9D+1 0.00118 0.00000 0.20382 0.00000 -0.34487
139 9D-1 0.00000 0.24090 0.00000 0.10204 0.00000
140 9D+2 0.00000 0.13564 0.00000 -0.02063 0.00000
141 9D-2 -0.14301 0.00000 -0.04757 0.00000 0.18938
142 10F 0 0.00000 0.00779 0.00000 -0.00690 0.00000
143 10F+1 -0.00318 0.00000 -0.00516 0.00000 -0.00129
144 10F-1 0.00000 -0.01175 0.00000 -0.00374 0.00000
145 10F+2 0.00000 0.00454 0.00000 -0.00568 0.00000
146 10F-2 0.01779 0.00000 -0.00130 0.00000 0.00131
147 10F+3 -0.02951 0.00000 -0.01422 0.00000 -0.00018
148 10F-3 0.00000 -0.00103 0.00000 -0.01229 0.00000
149 4 H 1S 0.00589 0.00340 -0.00623 0.00360 0.00000
150 2S -0.31094 -0.17952 -0.21661 0.12506 0.00000
151 3S 1.32395 0.76438 2.69543 -1.55621 0.00000
152 4S 0.10433 0.06023 0.15086 -0.08710 0.00000
153 5PX 0.00229 -0.01453 -0.02979 0.00754 0.01345
154 5PY -0.01453 0.01907 -0.00754 0.02109 -0.02329
155 5PZ -0.00844 -0.00487 0.01568 -0.00906 0.00000
156 6PX -0.04958 0.11900 0.26036 -0.08023 -0.10829
157 6PY 0.11900 -0.18699 0.08023 -0.16772 0.18757
158 6PZ 0.04095 0.02364 -0.13823 0.07981 0.00000
159 7PX 0.68681 -0.03661 0.43776 -0.12733 -0.19320
160 7PY -0.03661 0.72909 0.12733 -0.29073 0.33464
161 7PZ 0.24933 0.14395 -0.18009 0.10398 0.00000
162 8D 0 0.00378 0.00218 -0.01035 0.00598 0.00000
163 8D+1 -0.01665 -0.00769 -0.00240 -0.01272 -0.01945
164 8D-1 -0.00769 -0.00776 0.01272 0.01709 0.03368
165 8D+2 -0.01006 0.00404 -0.00022 -0.00084 -0.02224
166 8D-2 -0.00758 -0.01006 0.00058 0.00022 0.01284
167 9D 0 -0.05759 -0.03325 0.07542 -0.04354 0.00000
168 9D+1 0.18097 0.10380 -0.02557 0.13244 0.17243
169 9D-1 0.10380 0.06111 -0.13244 -0.12735 -0.29867
170 9D+2 0.12066 -0.07335 0.02953 0.03052 0.16401
171 9D-2 0.06597 0.12066 0.00358 -0.02953 -0.09469
172 10F 0 -0.00675 -0.00390 -0.00598 0.00345 0.00000
173 10F+1 -0.00961 -0.00371 0.00151 -0.00385 0.00065
174 10F-1 -0.00371 -0.00532 0.00385 0.00294 -0.00112
175 10F+2 -0.00574 0.01448 0.00302 -0.00045 0.00113
176 10F-2 0.00786 -0.00574 0.00393 -0.00302 -0.00065
177 10F+3 0.01476 -0.02556 0.00711 0.01232 -0.00018
178 10F-3 0.00090 0.00052 -0.01064 0.00614 0.00000
179 5 H 1S -0.00589 0.00340 0.00623 0.00360 0.00000
180 2S 0.31094 -0.17952 0.21661 0.12506 0.00000
181 3S -1.32395 0.76438 -2.69543 -1.55621 0.00000
182 4S -0.10433 0.06023 -0.15086 -0.08710 0.00000
183 5PX 0.00229 0.01453 -0.02979 -0.00754 0.01345
184 5PY 0.01453 0.01907 0.00754 0.02109 0.02329
185 5PZ 0.00844 -0.00487 -0.01568 -0.00906 0.00000
186 6PX -0.04958 -0.11900 0.26036 0.08023 -0.10829
187 6PY -0.11900 -0.18699 -0.08023 -0.16772 -0.18757
188 6PZ -0.04095 0.02364 0.13823 0.07981 0.00000
189 7PX 0.68681 0.03661 0.43776 0.12733 -0.19320
190 7PY 0.03661 0.72909 -0.12733 -0.29073 -0.33464
191 7PZ -0.24933 0.14395 0.18009 0.10398 0.00000
192 8D 0 -0.00378 0.00218 0.01035 0.00598 0.00000
193 8D+1 -0.01665 0.00769 -0.00240 0.01272 -0.01945
194 8D-1 0.00769 -0.00776 -0.01272 0.01709 -0.03368
195 8D+2 0.01006 0.00404 0.00022 -0.00084 0.02224
196 8D-2 -0.00758 0.01006 0.00058 -0.00022 0.01284
197 9D 0 0.05759 -0.03325 -0.07542 -0.04354 0.00000
198 9D+1 0.18097 -0.10380 -0.02557 -0.13244 0.17243
199 9D-1 -0.10380 0.06111 0.13244 -0.12735 0.29867
200 9D+2 -0.12066 -0.07335 -0.02953 0.03052 -0.16401
201 9D-2 0.06597 -0.12066 0.00358 0.02953 -0.09469
202 10F 0 0.00675 -0.00390 0.00598 0.00345 0.00000
203 10F+1 -0.00961 0.00371 0.00151 0.00385 0.00065
204 10F-1 0.00371 -0.00532 -0.00385 0.00294 0.00112
205 10F+2 0.00574 0.01448 -0.00302 -0.00045 -0.00113
206 10F-2 0.00786 0.00574 0.00393 0.00302 -0.00065
207 10F+3 0.01476 0.02556 0.00711 -0.01232 -0.00018
208 10F-3 -0.00090 0.00052 0.01064 0.00614 0.00000
209 6 H 1S 0.00000 -0.00680 0.00000 -0.00720 0.00000
210 2S 0.00000 0.35905 0.00000 -0.25012 0.00000
211 3S 0.00000 -1.52876 0.00000 3.11242 0.00000
212 4S 0.00000 -0.12047 0.00000 0.17420 0.00000
213 5PX -0.02746 0.00000 0.01674 0.00000 0.02689
214 5PY 0.00000 0.00609 0.00000 -0.03415 0.00000
215 5PZ 0.00000 -0.00974 0.00000 -0.01811 0.00000
216 6PX 0.25570 0.00000 -0.12139 0.00000 -0.21659
217 6PY 0.00000 -0.01912 0.00000 0.30669 0.00000
218 6PZ 0.00000 0.04729 0.00000 0.15961 0.00000
219 7PX -0.75022 0.00000 -0.21721 0.00000 -0.38641
220 7PY 0.00000 -0.66567 0.00000 0.51128 0.00000
221 7PZ 0.00000 0.28791 0.00000 0.20796 0.00000
222 8D 0 0.00000 -0.00437 0.00000 -0.01195 0.00000
223 8D+1 -0.00332 0.00000 -0.02444 0.00000 0.03889
224 8D-1 0.00000 -0.02109 0.00000 -0.00495 0.00000
225 8D+2 0.00000 -0.01338 0.00000 -0.00045 0.00000
226 8D-2 0.00984 0.00000 0.00097 0.00000 -0.02568
227 9D 0 0.00000 0.06650 0.00000 0.08709 0.00000
228 9D+1 0.00118 0.00000 0.20382 0.00000 -0.34487
229 9D-1 0.00000 0.24090 0.00000 0.10204 0.00000
230 9D+2 0.00000 0.13564 0.00000 -0.02063 0.00000
231 9D-2 -0.14301 0.00000 -0.04757 0.00000 0.18938
232 10F 0 0.00000 -0.00779 0.00000 0.00690 0.00000
233 10F+1 0.00318 0.00000 0.00516 0.00000 0.00129
234 10F-1 0.00000 0.01175 0.00000 0.00374 0.00000
235 10F+2 0.00000 -0.00454 0.00000 0.00568 0.00000
236 10F-2 -0.01779 0.00000 0.00130 0.00000 -0.00131
237 10F+3 0.02951 0.00000 0.01422 0.00000 0.00018
238 10F-3 0.00000 0.00103 0.00000 0.01229 0.00000
239 7 H 1S -0.00589 0.00340 0.00623 0.00360 0.00000
240 2S 0.31094 -0.17952 0.21661 0.12506 0.00000
241 3S -1.32395 0.76438 -2.69543 -1.55621 0.00000
242 4S -0.10433 0.06023 -0.15086 -0.08710 0.00000
243 5PX -0.00229 -0.01453 0.02979 0.00754 -0.01345
244 5PY -0.01453 -0.01907 -0.00754 -0.02109 -0.02329
245 5PZ -0.00844 0.00487 0.01568 0.00906 0.00000
246 6PX 0.04958 0.11900 -0.26036 -0.08023 0.10829
247 6PY 0.11900 0.18699 0.08023 0.16772 0.18757
248 6PZ 0.04095 -0.02364 -0.13823 -0.07981 0.00000
249 7PX -0.68681 -0.03661 -0.43776 -0.12733 0.19320
250 7PY -0.03661 -0.72909 0.12733 0.29073 0.33464
251 7PZ 0.24933 -0.14395 -0.18009 -0.10398 0.00000
252 8D 0 -0.00378 0.00218 0.01035 0.00598 0.00000
253 8D+1 -0.01665 0.00769 -0.00240 0.01272 -0.01945
254 8D-1 0.00769 -0.00776 -0.01272 0.01709 -0.03368
255 8D+2 0.01006 0.00404 0.00022 -0.00084 0.02224
256 8D-2 -0.00758 0.01006 0.00058 -0.00022 0.01284
257 9D 0 0.05759 -0.03325 -0.07542 -0.04354 0.00000
258 9D+1 0.18097 -0.10380 -0.02557 -0.13244 0.17243
259 9D-1 -0.10380 0.06111 0.13244 -0.12735 0.29867
260 9D+2 -0.12066 -0.07335 -0.02953 0.03052 -0.16401
261 9D-2 0.06597 -0.12066 0.00358 0.02953 -0.09469
262 10F 0 -0.00675 0.00390 -0.00598 -0.00345 0.00000
263 10F+1 0.00961 -0.00371 -0.00151 -0.00385 -0.00065
264 10F-1 -0.00371 0.00532 0.00385 -0.00294 -0.00112
265 10F+2 -0.00574 -0.01448 0.00302 0.00045 0.00113
266 10F-2 -0.00786 -0.00574 -0.00393 -0.00302 0.00065
267 10F+3 -0.01476 -0.02556 -0.00711 0.01232 0.00018
268 10F-3 0.00090 -0.00052 -0.01064 -0.00614 0.00000
269 8 H 1S 0.00589 0.00340 -0.00623 0.00360 0.00000
270 2S -0.31094 -0.17952 -0.21661 0.12506 0.00000
271 3S 1.32395 0.76438 2.69543 -1.55621 0.00000
272 4S 0.10433 0.06023 0.15086 -0.08710 0.00000
273 5PX -0.00229 0.01453 0.02979 -0.00754 -0.01345
274 5PY 0.01453 -0.01907 0.00754 -0.02109 0.02329
275 5PZ 0.00844 0.00487 -0.01568 0.00906 0.00000
276 6PX 0.04958 -0.11900 -0.26036 0.08023 0.10829
277 6PY -0.11900 0.18699 -0.08023 0.16772 -0.18757
278 6PZ -0.04095 -0.02364 0.13823 -0.07981 0.00000
279 7PX -0.68681 0.03661 -0.43776 0.12733 0.19320
280 7PY 0.03661 -0.72909 -0.12733 0.29073 -0.33464
281 7PZ -0.24933 -0.14395 0.18009 -0.10398 0.00000
282 8D 0 0.00378 0.00218 -0.01035 0.00598 0.00000
283 8D+1 -0.01665 -0.00769 -0.00240 -0.01272 -0.01945
284 8D-1 -0.00769 -0.00776 0.01272 0.01709 0.03368
285 8D+2 -0.01006 0.00404 -0.00022 -0.00084 -0.02224
286 8D-2 -0.00758 -0.01006 0.00058 0.00022 0.01284
287 9D 0 -0.05759 -0.03325 0.07542 -0.04354 0.00000
288 9D+1 0.18097 0.10380 -0.02557 0.13244 0.17243
289 9D-1 0.10380 0.06111 -0.13244 -0.12735 -0.29867
290 9D+2 0.12066 -0.07335 0.02953 0.03052 0.16401
291 9D-2 0.06597 0.12066 0.00358 -0.02953 -0.09469
292 10F 0 0.00675 0.00390 0.00598 -0.00345 0.00000
293 10F+1 0.00961 0.00371 -0.00151 0.00385 -0.00065
294 10F-1 0.00371 0.00532 -0.00385 -0.00294 0.00112
295 10F+2 0.00574 -0.01448 -0.00302 0.00045 -0.00113
296 10F-2 -0.00786 0.00574 -0.00393 0.00302 0.00065
297 10F+3 -0.01476 0.02556 -0.00711 -0.01232 0.00018
298 10F-3 -0.00090 -0.00052 0.01064 -0.00614 0.00000
131 132 133 134 135
(A1U)--V (EU)--V (EU)--V (A1G)--V (A2U)--V
Eigenvalues -- 2.46405 2.47253 2.47253 2.48410 2.50066
1 1 Si 1S 0.00000 0.00000 0.00000 -0.02827 0.00467
2 2S 0.00000 0.00000 0.00000 0.00193 0.00815
3 3S 0.00000 0.00000 0.00000 -0.34926 0.07024
4 4S 0.00000 0.00000 0.00000 -4.61449 0.93324
5 5S 0.00000 0.00000 0.00000 10.68852 -1.87389
6 6S 0.00000 0.00000 0.00000 1.02096 -1.36905
7 7PX 0.00000 0.00000 -0.23357 0.00000 0.00000
8 7PY 0.00000 0.23357 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 -0.05478 -0.00523
10 8PX 0.00000 0.00000 -0.06697 0.00000 0.00000
11 8PY 0.00000 0.06697 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 -0.00952 -0.01031
13 9PX 0.00000 0.00000 0.86187 0.00000 0.00000
14 9PY 0.00000 -0.86187 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.11529 -0.12410
16 10PX 0.00000 0.00000 6.04064 0.00000 0.00000
17 10PY 0.00000 -6.04064 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 2.00752 2.57067
19 11PX 0.00000 0.00000 0.06929 0.00000 0.00000
20 11PY 0.00000 -0.06929 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.36105 0.45380
22 12D 0 0.00000 0.00000 0.00000 -1.54104 -1.25932
23 12D+1 0.00000 0.00000 1.08774 0.00000 0.00000
24 12D-1 0.00000 -1.08774 0.00000 0.00000 0.00000
25 12D+2 0.00000 1.45333 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 -1.45333 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 -1.43824 -1.34261
28 13D+1 0.00000 0.00000 1.93579 0.00000 0.00000
29 13D-1 0.00000 -1.93579 0.00000 0.00000 0.00000
30 13D+2 0.00000 2.93484 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 -2.93484 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.35814 0.61541
33 14D+1 0.00000 0.00000 -0.55714 0.00000 0.00000
34 14D-1 0.00000 0.55714 0.00000 0.00000 0.00000
35 14D+2 0.00000 -0.86275 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.86275 0.00000 0.00000
37 15F 0 0.00000 0.00000 0.00000 -0.46583 1.25518
38 15F+1 0.00000 0.00000 -0.60759 0.00000 0.00000
39 15F-1 0.00000 0.60759 0.00000 0.00000 0.00000
40 15F+2 0.00000 1.57135 0.00000 0.00000 0.00000
41 15F-2 0.00000 0.00000 -1.57135 0.00000 0.00000
42 15F+3 0.88715 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 -2.24368 -0.49243
44 16F 0 0.00000 0.00000 0.00000 -0.31155 -0.40551
45 16F+1 0.00000 0.00000 0.19621 0.00000 0.00000
46 16F-1 0.00000 -0.19621 0.00000 0.00000 0.00000
47 16F+2 0.00000 -0.10624 0.00000 0.00000 0.00000
48 16F-2 0.00000 0.00000 0.10624 0.00000 0.00000
49 16F+3 -0.20714 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.47011 0.23363
51 17G 0 0.00000 0.00000 0.00000 0.41653 0.15613
52 17G+1 0.00000 0.00000 -0.28372 0.00000 0.00000
53 17G-1 0.00000 0.28372 0.00000 0.00000 0.00000
54 17G+2 0.00000 -0.19523 0.00000 0.00000 0.00000
55 17G-2 0.00000 0.00000 0.19523 0.00000 0.00000
56 17G+3 0.82436 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 -0.12179 0.36895
58 17G+4 0.00000 -0.27857 0.00000 0.00000 0.00000
59 17G-4 0.00000 0.00000 -0.27857 0.00000 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 -0.02827 -0.00467
61 2S 0.00000 0.00000 0.00000 0.00193 -0.00815
62 3S 0.00000 0.00000 0.00000 -0.34926 -0.07024
63 4S 0.00000 0.00000 0.00000 -4.61449 -0.93324
64 5S 0.00000 0.00000 0.00000 10.68852 1.87389
65 6S 0.00000 0.00000 0.00000 1.02096 1.36905
66 7PX 0.00000 0.00000 -0.23357 0.00000 0.00000
67 7PY 0.00000 0.23357 0.00000 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.05478 -0.00523
69 8PX 0.00000 0.00000 -0.06697 0.00000 0.00000
70 8PY 0.00000 0.06697 0.00000 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00952 -0.01031
72 9PX 0.00000 0.00000 0.86187 0.00000 0.00000
73 9PY 0.00000 -0.86187 0.00000 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.00000 -0.11529 -0.12410
75 10PX 0.00000 0.00000 6.04064 0.00000 0.00000
76 10PY 0.00000 -6.04064 0.00000 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 -2.00752 2.57067
78 11PX 0.00000 0.00000 0.06929 0.00000 0.00000
79 11PY 0.00000 -0.06929 0.00000 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.00000 -0.36105 0.45380
81 12D 0 0.00000 0.00000 0.00000 -1.54104 1.25932
82 12D+1 0.00000 0.00000 -1.08774 0.00000 0.00000
83 12D-1 0.00000 1.08774 0.00000 0.00000 0.00000
84 12D+2 0.00000 -1.45333 0.00000 0.00000 0.00000
85 12D-2 0.00000 0.00000 1.45333 0.00000 0.00000
86 13D 0 0.00000 0.00000 0.00000 -1.43824 1.34261
87 13D+1 0.00000 0.00000 -1.93579 0.00000 0.00000
88 13D-1 0.00000 1.93579 0.00000 0.00000 0.00000
89 13D+2 0.00000 -2.93484 0.00000 0.00000 0.00000
90 13D-2 0.00000 0.00000 2.93484 0.00000 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.35814 -0.61541
92 14D+1 0.00000 0.00000 0.55714 0.00000 0.00000
93 14D-1 0.00000 -0.55714 0.00000 0.00000 0.00000
94 14D+2 0.00000 0.86275 0.00000 0.00000 0.00000
95 14D-2 0.00000 0.00000 -0.86275 0.00000 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.46583 1.25518
97 15F+1 0.00000 0.00000 -0.60759 0.00000 0.00000
98 15F-1 0.00000 0.60759 0.00000 0.00000 0.00000
99 15F+2 0.00000 1.57135 0.00000 0.00000 0.00000
100 15F-2 0.00000 0.00000 -1.57135 0.00000 0.00000
101 15F+3 0.88715 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 2.24368 -0.49243
103 16F 0 0.00000 0.00000 0.00000 0.31155 -0.40551
104 16F+1 0.00000 0.00000 0.19621 0.00000 0.00000
105 16F-1 0.00000 -0.19621 0.00000 0.00000 0.00000
106 16F+2 0.00000 -0.10624 0.00000 0.00000 0.00000
107 16F-2 0.00000 0.00000 0.10624 0.00000 0.00000
108 16F+3 -0.20714 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 -0.47011 0.23363
110 17G 0 0.00000 0.00000 0.00000 0.41653 -0.15613
111 17G+1 0.00000 0.00000 0.28372 0.00000 0.00000
112 17G-1 0.00000 -0.28372 0.00000 0.00000 0.00000
113 17G+2 0.00000 0.19523 0.00000 0.00000 0.00000
114 17G-2 0.00000 0.00000 -0.19523 0.00000 0.00000
115 17G+3 -0.82436 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 -0.12179 -0.36895
117 17G+4 0.00000 0.27857 0.00000 0.00000 0.00000
118 17G-4 0.00000 0.00000 0.27857 0.00000 0.00000
119 3 H 1S 0.00000 -0.02178 0.00000 0.00130 -0.00449
120 2S 0.00000 -0.23288 0.00000 0.22140 0.30957
121 3S 0.00000 6.51106 0.00000 -3.94340 -0.61057
122 4S 0.00000 0.73844 0.00000 -0.32966 -0.02026
123 5PX 0.02143 0.00000 0.00218 0.00000 0.00000
124 5PY 0.00000 0.06021 0.00000 -0.03613 0.00593
125 5PZ 0.00000 0.01512 0.00000 0.01581 -0.00856
126 6PX -0.22227 0.00000 -0.01898 0.00000 0.00000
127 6PY 0.00000 -0.47983 0.00000 0.30724 -0.03947
128 6PZ 0.00000 -0.11467 0.00000 -0.13065 0.03746
129 7PX 0.76641 0.00000 0.30258 0.00000 0.00000
130 7PY 0.00000 -1.95527 0.00000 0.78878 0.01939
131 7PZ 0.00000 -0.71956 0.00000 1.00502 0.43789
132 8D 0 0.00000 0.00042 0.00000 0.00582 0.02575
133 8D+1 -0.01579 0.00000 -0.01172 0.00000 0.00000
134 8D-1 0.00000 -0.01166 0.00000 0.00162 -0.01406
135 8D+2 0.00000 0.00556 0.00000 0.00557 -0.01671
136 8D-2 0.03029 0.00000 -0.00487 0.00000 0.00000
137 9D 0 0.00000 -0.06565 0.00000 -0.06125 -0.26602
138 9D+1 0.08236 0.00000 0.10775 0.00000 0.00000
139 9D-1 0.00000 0.24947 0.00000 -0.06562 0.09823
140 9D+2 0.00000 -0.21904 0.00000 -0.00543 0.11664
141 9D-2 -0.31982 0.00000 0.02572 0.00000 0.00000
142 10F 0 0.00000 0.00168 0.00000 0.00049 -0.00065
143 10F+1 -0.00433 0.00000 -0.00094 0.00000 0.00000
144 10F-1 0.00000 -0.00032 0.00000 0.01731 0.01770
145 10F+2 0.00000 0.00478 0.00000 -0.00720 -0.00951
146 10F-2 0.01120 0.00000 0.00060 0.00000 0.00000
147 10F+3 -0.02982 0.00000 -0.01003 0.00000 0.00000
148 10F-3 0.00000 -0.00463 0.00000 -0.00162 0.00714
149 4 H 1S 0.00000 0.01089 -0.01886 0.00130 -0.00449
150 2S 0.00000 0.11644 -0.20168 0.22140 0.30957
151 3S 0.00000 -3.25553 5.63875 -3.94340 -0.61057
152 4S 0.00000 -0.36922 0.63951 -0.32966 -0.02026
153 5PX -0.01072 0.02701 -0.04461 0.03129 -0.00513
154 5PY 0.01856 0.01342 -0.02701 0.01807 -0.00296
155 5PZ 0.00000 -0.00756 0.01310 0.01581 -0.00856
156 6PX 0.11114 -0.21599 0.35513 -0.26607 0.03419
157 6PY -0.19249 -0.10572 0.21599 -0.15362 0.01974
158 6PZ 0.00000 0.05734 -0.09931 -0.13065 0.03746
159 7PX -0.38321 -0.71563 1.54210 -0.68310 -0.01679
160 7PY 0.66373 -0.71576 0.71563 -0.39439 -0.00969
161 7PZ 0.00000 0.35978 -0.62316 1.00502 0.43789
162 8D 0 0.00000 -0.00021 0.00036 0.00582 0.02575
163 8D+1 0.00790 -0.01012 0.00582 -0.00140 0.01218
164 8D-1 -0.01368 0.00587 0.01012 -0.00081 0.00703
165 8D+2 0.02623 0.00504 -0.00030 -0.00279 0.00836
166 8D-2 -0.01514 0.00030 -0.00539 -0.00483 0.01447
167 9D 0 0.00000 0.03282 -0.05685 -0.06125 -0.26602
168 9D+1 -0.04118 0.15468 -0.16016 0.05683 -0.08507
169 9D-1 0.07132 -0.01845 -0.15468 0.03281 -0.04912
170 9D+2 -0.27698 -0.07405 0.08371 0.00272 -0.05832
171 9D-2 0.15991 -0.08371 0.17071 0.00471 -0.10102
172 10F 0 0.00000 -0.00084 0.00146 0.00049 -0.00065
173 10F+1 0.00217 -0.00055 0.00001 -0.01499 -0.01533
174 10F-1 -0.00375 0.00062 0.00055 -0.00865 -0.00885
175 10F+2 0.00970 0.00074 -0.00233 0.00360 0.00476
176 10F-2 -0.00560 0.00233 -0.00343 0.00624 0.00824
177 10F+3 -0.02982 0.00868 0.00501 0.00000 0.00000
178 10F-3 0.00000 0.00232 -0.00401 -0.00162 0.00714
179 5 H 1S 0.00000 0.01089 0.01886 0.00130 -0.00449
180 2S 0.00000 0.11644 0.20168 0.22140 0.30957
181 3S 0.00000 -3.25553 -5.63875 -3.94340 -0.61057
182 4S 0.00000 -0.36922 -0.63951 -0.32966 -0.02026
183 5PX -0.01072 -0.02701 -0.04461 -0.03129 0.00513
184 5PY -0.01856 0.01342 0.02701 0.01807 -0.00296
185 5PZ 0.00000 -0.00756 -0.01310 0.01581 -0.00856
186 6PX 0.11114 0.21599 0.35513 0.26607 -0.03419
187 6PY 0.19249 -0.10572 -0.21599 -0.15362 0.01974
188 6PZ 0.00000 0.05734 0.09931 -0.13065 0.03746
189 7PX -0.38321 0.71563 1.54210 0.68310 0.01679
190 7PY -0.66373 -0.71576 -0.71563 -0.39439 -0.00969
191 7PZ 0.00000 0.35978 0.62316 1.00502 0.43789
192 8D 0 0.00000 -0.00021 -0.00036 0.00582 0.02575
193 8D+1 0.00790 0.01012 0.00582 0.00140 -0.01218
194 8D-1 0.01368 0.00587 -0.01012 -0.00081 0.00703
195 8D+2 -0.02623 0.00504 0.00030 -0.00279 0.00836
196 8D-2 -0.01514 -0.00030 -0.00539 0.00483 -0.01447
197 9D 0 0.00000 0.03282 0.05685 -0.06125 -0.26602
198 9D+1 -0.04118 -0.15468 -0.16016 -0.05683 0.08507
199 9D-1 -0.07132 -0.01845 0.15468 0.03281 -0.04912
200 9D+2 0.27698 -0.07405 -0.08371 0.00272 -0.05832
201 9D-2 0.15991 0.08371 0.17071 -0.00471 0.10102
202 10F 0 0.00000 -0.00084 -0.00146 0.00049 -0.00065
203 10F+1 0.00217 0.00055 0.00001 0.01499 0.01533
204 10F-1 0.00375 0.00062 -0.00055 -0.00865 -0.00885
205 10F+2 -0.00970 0.00074 0.00233 0.00360 0.00476
206 10F-2 -0.00560 -0.00233 -0.00343 -0.00624 -0.00824
207 10F+3 -0.02982 -0.00868 0.00501 0.00000 0.00000
208 10F-3 0.00000 0.00232 0.00401 -0.00162 0.00714
209 6 H 1S 0.00000 0.02178 0.00000 0.00130 0.00449
210 2S 0.00000 0.23288 0.00000 0.22140 -0.30957
211 3S 0.00000 -6.51106 0.00000 -3.94340 0.61057
212 4S 0.00000 -0.73844 0.00000 -0.32966 0.02026
213 5PX 0.02143 0.00000 0.00218 0.00000 0.00000
214 5PY 0.00000 0.06021 0.00000 0.03613 0.00593
215 5PZ 0.00000 0.01512 0.00000 -0.01581 -0.00856
216 6PX -0.22227 0.00000 -0.01898 0.00000 0.00000
217 6PY 0.00000 -0.47983 0.00000 -0.30724 -0.03947
218 6PZ 0.00000 -0.11467 0.00000 0.13065 0.03746
219 7PX 0.76641 0.00000 0.30258 0.00000 0.00000
220 7PY 0.00000 -1.95527 0.00000 -0.78878 0.01939
221 7PZ 0.00000 -0.71956 0.00000 -1.00502 0.43789
222 8D 0 0.00000 -0.00042 0.00000 0.00582 -0.02575
223 8D+1 0.01579 0.00000 0.01172 0.00000 0.00000
224 8D-1 0.00000 0.01166 0.00000 0.00162 0.01406
225 8D+2 0.00000 -0.00556 0.00000 0.00557 0.01671
226 8D-2 -0.03029 0.00000 0.00487 0.00000 0.00000
227 9D 0 0.00000 0.06565 0.00000 -0.06125 0.26602
228 9D+1 -0.08236 0.00000 -0.10775 0.00000 0.00000
229 9D-1 0.00000 -0.24947 0.00000 -0.06562 -0.09823
230 9D+2 0.00000 0.21904 0.00000 -0.00543 -0.11664
231 9D-2 0.31982 0.00000 -0.02572 0.00000 0.00000
232 10F 0 0.00000 0.00168 0.00000 -0.00049 -0.00065
233 10F+1 -0.00433 0.00000 -0.00094 0.00000 0.00000
234 10F-1 0.00000 -0.00032 0.00000 -0.01731 0.01770
235 10F+2 0.00000 0.00478 0.00000 0.00720 -0.00951
236 10F-2 0.01120 0.00000 0.00060 0.00000 0.00000
237 10F+3 -0.02982 0.00000 -0.01003 0.00000 0.00000
238 10F-3 0.00000 -0.00463 0.00000 0.00162 0.00714
239 7 H 1S 0.00000 -0.01089 -0.01886 0.00130 0.00449
240 2S 0.00000 -0.11644 -0.20168 0.22140 -0.30957
241 3S 0.00000 3.25553 5.63875 -3.94340 0.61057
242 4S 0.00000 0.36922 0.63951 -0.32966 0.02026
243 5PX -0.01072 -0.02701 -0.04461 0.03129 0.00513
244 5PY -0.01856 0.01342 0.02701 -0.01807 -0.00296
245 5PZ 0.00000 -0.00756 -0.01310 -0.01581 -0.00856
246 6PX 0.11114 0.21599 0.35513 -0.26607 -0.03419
247 6PY 0.19249 -0.10572 -0.21599 0.15362 0.01974
248 6PZ 0.00000 0.05734 0.09931 0.13065 0.03746
249 7PX -0.38321 0.71563 1.54210 -0.68310 0.01679
250 7PY -0.66373 -0.71576 -0.71563 0.39439 -0.00969
251 7PZ 0.00000 0.35978 0.62316 -1.00502 0.43789
252 8D 0 0.00000 0.00021 0.00036 0.00582 -0.02575
253 8D+1 -0.00790 -0.01012 -0.00582 0.00140 0.01218
254 8D-1 -0.01368 -0.00587 0.01012 -0.00081 -0.00703
255 8D+2 0.02623 -0.00504 -0.00030 -0.00279 -0.00836
256 8D-2 0.01514 0.00030 0.00539 0.00483 0.01447
257 9D 0 0.00000 -0.03282 -0.05685 -0.06125 0.26602
258 9D+1 0.04118 0.15468 0.16016 -0.05683 -0.08507
259 9D-1 0.07132 0.01845 -0.15468 0.03281 0.04912
260 9D+2 -0.27698 0.07405 0.08371 0.00272 0.05832
261 9D-2 -0.15991 -0.08371 -0.17071 -0.00471 -0.10102
262 10F 0 0.00000 -0.00084 -0.00146 -0.00049 -0.00065
263 10F+1 0.00217 0.00055 0.00001 -0.01499 0.01533
264 10F-1 0.00375 0.00062 -0.00055 0.00865 -0.00885
265 10F+2 -0.00970 0.00074 0.00233 -0.00360 0.00476
266 10F-2 -0.00560 -0.00233 -0.00343 0.00624 -0.00824
267 10F+3 -0.02982 -0.00868 0.00501 0.00000 0.00000
268 10F-3 0.00000 0.00232 0.00401 0.00162 0.00714
269 8 H 1S 0.00000 -0.01089 0.01886 0.00130 0.00449
270 2S 0.00000 -0.11644 0.20168 0.22140 -0.30957
271 3S 0.00000 3.25553 -5.63875 -3.94340 0.61057
272 4S 0.00000 0.36922 -0.63951 -0.32966 0.02026
273 5PX -0.01072 0.02701 -0.04461 -0.03129 -0.00513
274 5PY 0.01856 0.01342 -0.02701 -0.01807 -0.00296
275 5PZ 0.00000 -0.00756 0.01310 -0.01581 -0.00856
276 6PX 0.11114 -0.21599 0.35513 0.26607 0.03419
277 6PY -0.19249 -0.10572 0.21599 0.15362 0.01974
278 6PZ 0.00000 0.05734 -0.09931 0.13065 0.03746
279 7PX -0.38321 -0.71563 1.54210 0.68310 -0.01679
280 7PY 0.66373 -0.71576 0.71563 0.39439 -0.00969
281 7PZ 0.00000 0.35978 -0.62316 -1.00502 0.43789
282 8D 0 0.00000 0.00021 -0.00036 0.00582 -0.02575
283 8D+1 -0.00790 0.01012 -0.00582 -0.00140 -0.01218
284 8D-1 0.01368 -0.00587 -0.01012 -0.00081 -0.00703
285 8D+2 -0.02623 -0.00504 0.00030 -0.00279 -0.00836
286 8D-2 0.01514 -0.00030 0.00539 -0.00483 -0.01447
287 9D 0 0.00000 -0.03282 0.05685 -0.06125 0.26602
288 9D+1 0.04118 -0.15468 0.16016 0.05683 0.08507
289 9D-1 -0.07132 0.01845 0.15468 0.03281 0.04912
290 9D+2 0.27698 0.07405 -0.08371 0.00272 0.05832
291 9D-2 -0.15991 0.08371 -0.17071 0.00471 0.10102
292 10F 0 0.00000 -0.00084 0.00146 -0.00049 -0.00065
293 10F+1 0.00217 -0.00055 0.00001 0.01499 -0.01533
294 10F-1 -0.00375 0.00062 0.00055 0.00865 -0.00885
295 10F+2 0.00970 0.00074 -0.00233 -0.00360 0.00476
296 10F-2 -0.00560 0.00233 -0.00343 -0.00624 0.00824
297 10F+3 -0.02982 0.00868 0.00501 0.00000 0.00000
298 10F-3 0.00000 0.00232 -0.00401 0.00162 0.00714
136 137 138 139 140
(A2G)--V (EU)--V (EU)--V (EG)--V (EG)--V
Eigenvalues -- 2.56127 2.56676 2.56676 2.57807 2.57807
1 1 Si 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 -0.11223 0.00000 -0.22656 0.00000
8 7PY 0.00000 0.00000 -0.11223 0.00000 -0.22656
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.04610 0.00000 -0.09198 0.00000
11 8PY 0.00000 0.00000 -0.04610 0.00000 -0.09198
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.73383 0.00000 0.96681 0.00000
14 9PY 0.00000 0.00000 0.73383 0.00000 0.96681
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.60030 0.00000 6.95221 0.00000
17 10PY 0.00000 0.00000 0.60030 0.00000 6.95221
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 -0.07140 0.00000 0.33514 0.00000
20 11PY 0.00000 0.00000 -0.07140 0.00000 0.33514
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 -0.37160 0.00000 -0.49126 0.00000
24 12D-1 0.00000 0.00000 -0.37160 0.00000 -0.49126
25 12D+2 0.00000 0.00000 0.55102 0.00000 -0.85448
26 12D-2 0.00000 0.55102 0.00000 -0.85448 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.68534 0.00000 1.98068 0.00000
29 13D-1 0.00000 0.00000 0.68534 0.00000 1.98068
30 13D+2 0.00000 0.00000 -0.57255 0.00000 -2.97068
31 13D-2 0.00000 -0.57255 0.00000 -2.97068 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 -0.12365 0.00000 -0.36508 0.00000
34 14D-1 0.00000 0.00000 -0.12365 0.00000 -0.36508
35 14D+2 0.00000 0.00000 0.10636 0.00000 0.77701
36 14D-2 0.00000 0.10636 0.00000 0.77701 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.18404 0.00000 0.41414 0.00000
39 15F-1 0.00000 0.00000 0.18404 0.00000 0.41414
40 15F+2 0.00000 0.00000 0.83592 0.00000 -0.56181
41 15F-2 0.00000 0.83592 0.00000 -0.56181 0.00000
42 15F+3 1.34699 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 -0.26945 0.00000 -0.35682 0.00000
46 16F-1 0.00000 0.00000 -0.26945 0.00000 -0.35682
47 16F+2 0.00000 0.00000 -0.53328 0.00000 -0.39981
48 16F-2 0.00000 -0.53328 0.00000 -0.39981 0.00000
49 16F+3 -0.36123 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 -0.12939 0.00000 -0.41233 0.00000
53 17G-1 0.00000 0.00000 -0.12939 0.00000 -0.41233
54 17G+2 0.00000 0.00000 0.16318 0.00000 0.20298
55 17G-2 0.00000 0.16318 0.00000 0.20298 0.00000
56 17G+3 0.74569 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.52612 0.00000 0.43038
59 17G-4 0.00000 -0.52612 0.00000 -0.43038 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00000
61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
62 3S 0.00000 0.00000 0.00000 0.00000 0.00000
63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
64 5S 0.00000 0.00000 0.00000 0.00000 0.00000
65 6S 0.00000 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 -0.11223 0.00000 0.22656 0.00000
67 7PY 0.00000 0.00000 -0.11223 0.00000 0.22656
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 -0.04610 0.00000 0.09198 0.00000
70 8PY 0.00000 0.00000 -0.04610 0.00000 0.09198
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 0.73383 0.00000 -0.96681 0.00000
73 9PY 0.00000 0.00000 0.73383 0.00000 -0.96681
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 0.60030 0.00000 -6.95221 0.00000
76 10PY 0.00000 0.00000 0.60030 0.00000 -6.95221
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 -0.07140 0.00000 -0.33514 0.00000
79 11PY 0.00000 0.00000 -0.07140 0.00000 -0.33514
80 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.37160 0.00000 -0.49126 0.00000
83 12D-1 0.00000 0.00000 0.37160 0.00000 -0.49126
84 12D+2 0.00000 0.00000 -0.55102 0.00000 -0.85448
85 12D-2 0.00000 -0.55102 0.00000 -0.85448 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 -0.68534 0.00000 1.98068 0.00000
88 13D-1 0.00000 0.00000 -0.68534 0.00000 1.98068
89 13D+2 0.00000 0.00000 0.57255 0.00000 -2.97068
90 13D-2 0.00000 0.57255 0.00000 -2.97068 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.12365 0.00000 -0.36508 0.00000
93 14D-1 0.00000 0.00000 0.12365 0.00000 -0.36508
94 14D+2 0.00000 0.00000 -0.10636 0.00000 0.77701
95 14D-2 0.00000 -0.10636 0.00000 0.77701 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.18404 0.00000 -0.41414 0.00000
98 15F-1 0.00000 0.00000 0.18404 0.00000 -0.41414
99 15F+2 0.00000 0.00000 0.83592 0.00000 0.56181
100 15F-2 0.00000 0.83592 0.00000 0.56181 0.00000
101 15F+3 -1.34699 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 -0.26945 0.00000 0.35682 0.00000
105 16F-1 0.00000 0.00000 -0.26945 0.00000 0.35682
106 16F+2 0.00000 0.00000 -0.53328 0.00000 0.39981
107 16F-2 0.00000 -0.53328 0.00000 0.39981 0.00000
108 16F+3 0.36123 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.12939 0.00000 -0.41233 0.00000
112 17G-1 0.00000 0.00000 0.12939 0.00000 -0.41233
113 17G+2 0.00000 0.00000 -0.16318 0.00000 0.20298
114 17G-2 0.00000 -0.16318 0.00000 0.20298 0.00000
115 17G+3 0.74569 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 -0.52612 0.00000 0.43038
118 17G-4 0.00000 0.52612 0.00000 -0.43038 0.00000
119 3 H 1S 0.00000 0.00000 0.01157 0.00000 0.02113
120 2S 0.00000 0.00000 -0.29534 0.00000 0.15438
121 3S 0.00000 0.00000 -0.19306 0.00000 -5.97355
122 4S 0.00000 0.00000 -0.22503 0.00000 -0.93948
123 5PX 0.03331 -0.02320 0.00000 -0.02041 0.00000
124 5PY 0.00000 0.00000 0.00786 0.00000 -0.02530
125 5PZ 0.00000 0.00000 0.00852 0.00000 0.00531
126 6PX -0.30377 0.21824 0.00000 0.16009 0.00000
127 6PY 0.00000 0.00000 -0.11391 0.00000 0.13831
128 6PZ 0.00000 0.00000 -0.12012 0.00000 -0.08848
129 7PX 1.00171 -0.66928 0.00000 -0.19942 0.00000
130 7PY 0.00000 0.00000 0.75941 0.00000 2.59079
131 7PZ 0.00000 0.00000 0.61546 0.00000 1.25701
132 8D 0 0.00000 0.00000 0.01795 0.00000 0.00119
133 8D+1 -0.00079 0.01925 0.00000 0.01069 0.00000
134 8D-1 0.00000 0.00000 0.00462 0.00000 0.01184
135 8D+2 0.00000 0.00000 -0.03687 0.00000 -0.03520
136 8D-2 0.03090 -0.01689 0.00000 -0.01655 0.00000
137 9D 0 0.00000 0.00000 -0.12544 0.00000 0.07874
138 9D+1 -0.04019 -0.16628 0.00000 -0.09351 0.00000
139 9D-1 0.00000 0.00000 -0.13825 0.00000 -0.26637
140 9D+2 0.00000 0.00000 0.41227 0.00000 0.52206
141 9D-2 -0.33579 0.18873 0.00000 0.14648 0.00000
142 10F 0 0.00000 0.00000 -0.01354 0.00000 -0.01042
143 10F+1 -0.00067 0.00935 0.00000 0.00384 0.00000
144 10F-1 0.00000 0.00000 0.01117 0.00000 0.00547
145 10F+2 0.00000 0.00000 -0.01367 0.00000 -0.02033
146 10F-2 0.01274 -0.00828 0.00000 0.00099 0.00000
147 10F+3 -0.02505 0.01569 0.00000 -0.00196 0.00000
148 10F-3 0.00000 0.00000 -0.01393 0.00000 -0.01214
149 4 H 1S 0.00000 -0.01002 -0.00579 -0.01830 -0.01057
150 2S 0.00000 0.25578 0.14767 -0.13370 -0.07719
151 3S 0.00000 0.16719 0.09653 5.17325 2.98677
152 4S 0.00000 0.19488 0.11251 0.81361 0.46974
153 5PX -0.01666 0.00009 0.01345 -0.02408 -0.00212
154 5PY 0.02885 0.01345 -0.01544 -0.00212 -0.02164
155 5PZ 0.00000 -0.00738 -0.00426 -0.00460 -0.00266
156 6PX 0.15189 -0.03087 -0.14382 0.14376 -0.00943
157 6PY -0.26307 -0.14382 0.13520 -0.00943 0.15465
158 6PZ 0.00000 0.10403 0.06006 0.07662 0.04424
159 7PX -0.50085 0.40224 0.61864 1.89323 1.20819
160 7PY 0.86750 0.61864 -0.31211 1.20819 0.49813
161 7PZ 0.00000 -0.53300 -0.30773 -1.08860 -0.62851
162 8D 0 0.00000 -0.01555 -0.00898 -0.00103 -0.00060
163 8D+1 0.00040 0.00828 -0.00634 0.01155 0.00050
164 8D-1 -0.00069 -0.00634 0.01559 0.00050 0.01097
165 8D+2 0.02676 -0.00865 -0.02189 -0.00808 -0.02121
166 8D-2 -0.01545 -0.03188 -0.00865 -0.03054 -0.00808
167 9D 0 0.00000 0.10863 0.06272 -0.06819 -0.03937
168 9D+1 0.02009 -0.14525 0.01214 -0.22316 -0.07485
169 9D-1 -0.03480 0.01214 -0.15927 -0.07485 -0.13672
170 9D+2 -0.29081 0.09679 0.24462 0.16263 0.24037
171 9D-2 0.16790 0.35638 0.09679 0.42816 0.16263
172 10F 0 0.00000 0.01173 0.00677 0.00903 0.00521
173 10F+1 0.00033 0.01072 0.00079 0.00506 0.00071
174 10F-1 -0.00058 0.00079 0.00980 0.00071 0.00425
175 10F+2 0.01103 -0.00233 -0.00963 -0.00923 -0.00434
176 10F-2 -0.00637 -0.01232 -0.00233 -0.01500 -0.00923
177 10F+3 -0.02505 -0.00784 0.01359 0.00098 -0.00170
178 10F-3 0.00000 0.01206 0.00696 0.01051 0.00607
179 5 H 1S 0.00000 0.01002 -0.00579 0.01830 -0.01057
180 2S 0.00000 -0.25578 0.14767 0.13370 -0.07719
181 3S 0.00000 -0.16719 0.09653 -5.17325 2.98677
182 4S 0.00000 -0.19488 0.11251 -0.81361 0.46974
183 5PX -0.01666 0.00009 -0.01345 -0.02408 0.00212
184 5PY -0.02885 -0.01345 -0.01544 0.00212 -0.02164
185 5PZ 0.00000 0.00738 -0.00426 0.00460 -0.00266
186 6PX 0.15189 -0.03087 0.14382 0.14376 0.00943
187 6PY 0.26307 0.14382 0.13520 0.00943 0.15465
188 6PZ 0.00000 -0.10403 0.06006 -0.07662 0.04424
189 7PX -0.50085 0.40224 -0.61864 1.89323 -1.20819
190 7PY -0.86750 -0.61864 -0.31211 -1.20819 0.49813
191 7PZ 0.00000 0.53300 -0.30773 1.08860 -0.62851
192 8D 0 0.00000 0.01555 -0.00898 0.00103 -0.00060
193 8D+1 0.00040 0.00828 0.00634 0.01155 -0.00050
194 8D-1 0.00069 0.00634 0.01559 -0.00050 0.01097
195 8D+2 -0.02676 0.00865 -0.02189 0.00808 -0.02121
196 8D-2 -0.01545 -0.03188 0.00865 -0.03054 0.00808
197 9D 0 0.00000 -0.10863 0.06272 0.06819 -0.03937
198 9D+1 0.02009 -0.14525 -0.01214 -0.22316 0.07485
199 9D-1 0.03480 -0.01214 -0.15927 0.07485 -0.13672
200 9D+2 0.29081 -0.09679 0.24462 -0.16263 0.24037
201 9D-2 0.16790 0.35638 -0.09679 0.42816 -0.16263
202 10F 0 0.00000 -0.01173 0.00677 -0.00903 0.00521
203 10F+1 0.00033 0.01072 -0.00079 0.00506 -0.00071
204 10F-1 0.00058 -0.00079 0.00980 -0.00071 0.00425
205 10F+2 -0.01103 0.00233 -0.00963 0.00923 -0.00434
206 10F-2 -0.00637 -0.01232 0.00233 -0.01500 0.00923
207 10F+3 -0.02505 -0.00784 -0.01359 0.00098 0.00170
208 10F-3 0.00000 -0.01206 0.00696 -0.01051 0.00607
209 6 H 1S 0.00000 0.00000 -0.01157 0.00000 0.02113
210 2S 0.00000 0.00000 0.29534 0.00000 0.15438
211 3S 0.00000 0.00000 0.19306 0.00000 -5.97355
212 4S 0.00000 0.00000 0.22503 0.00000 -0.93948
213 5PX -0.03331 -0.02320 0.00000 0.02041 0.00000
214 5PY 0.00000 0.00000 0.00786 0.00000 0.02530
215 5PZ 0.00000 0.00000 0.00852 0.00000 -0.00531
216 6PX 0.30377 0.21824 0.00000 -0.16009 0.00000
217 6PY 0.00000 0.00000 -0.11391 0.00000 -0.13831
218 6PZ 0.00000 0.00000 -0.12012 0.00000 0.08848
219 7PX -1.00171 -0.66928 0.00000 0.19942 0.00000
220 7PY 0.00000 0.00000 0.75941 0.00000 -2.59079
221 7PZ 0.00000 0.00000 0.61546 0.00000 -1.25701
222 8D 0 0.00000 0.00000 -0.01795 0.00000 0.00119
223 8D+1 -0.00079 -0.01925 0.00000 0.01069 0.00000
224 8D-1 0.00000 0.00000 -0.00462 0.00000 0.01184
225 8D+2 0.00000 0.00000 0.03687 0.00000 -0.03520
226 8D-2 0.03090 0.01689 0.00000 -0.01655 0.00000
227 9D 0 0.00000 0.00000 0.12544 0.00000 0.07874
228 9D+1 -0.04019 0.16628 0.00000 -0.09351 0.00000
229 9D-1 0.00000 0.00000 0.13825 0.00000 -0.26637
230 9D+2 0.00000 0.00000 -0.41227 0.00000 0.52206
231 9D-2 -0.33579 -0.18873 0.00000 0.14648 0.00000
232 10F 0 0.00000 0.00000 -0.01354 0.00000 0.01042
233 10F+1 0.00067 0.00935 0.00000 -0.00384 0.00000
234 10F-1 0.00000 0.00000 0.01117 0.00000 -0.00547
235 10F+2 0.00000 0.00000 -0.01367 0.00000 0.02033
236 10F-2 -0.01274 -0.00828 0.00000 -0.00099 0.00000
237 10F+3 0.02505 0.01569 0.00000 0.00196 0.00000
238 10F-3 0.00000 0.00000 -0.01393 0.00000 0.01214
239 7 H 1S 0.00000 -0.01002 0.00579 0.01830 -0.01057
240 2S 0.00000 0.25578 -0.14767 0.13370 -0.07719
241 3S 0.00000 0.16719 -0.09653 -5.17325 2.98677
242 4S 0.00000 0.19488 -0.11251 -0.81361 0.46974
243 5PX 0.01666 0.00009 -0.01345 0.02408 -0.00212
244 5PY 0.02885 -0.01345 -0.01544 -0.00212 0.02164
245 5PZ 0.00000 0.00738 -0.00426 -0.00460 0.00266
246 6PX -0.15189 -0.03087 0.14382 -0.14376 -0.00943
247 6PY -0.26307 0.14382 0.13520 -0.00943 -0.15465
248 6PZ 0.00000 -0.10403 0.06006 0.07662 -0.04424
249 7PX 0.50085 0.40224 -0.61864 -1.89323 1.20819
250 7PY 0.86750 -0.61864 -0.31211 1.20819 -0.49813
251 7PZ 0.00000 0.53300 -0.30773 -1.08860 0.62851
252 8D 0 0.00000 -0.01555 0.00898 0.00103 -0.00060
253 8D+1 0.00040 -0.00828 -0.00634 0.01155 -0.00050
254 8D-1 0.00069 -0.00634 -0.01559 -0.00050 0.01097
255 8D+2 -0.02676 -0.00865 0.02189 0.00808 -0.02121
256 8D-2 -0.01545 0.03188 -0.00865 -0.03054 0.00808
257 9D 0 0.00000 0.10863 -0.06272 0.06819 -0.03937
258 9D+1 0.02009 0.14525 0.01214 -0.22316 0.07485
259 9D-1 0.03480 0.01214 0.15927 0.07485 -0.13672
260 9D+2 0.29081 0.09679 -0.24462 -0.16263 0.24037
261 9D-2 0.16790 -0.35638 0.09679 0.42816 -0.16263
262 10F 0 0.00000 -0.01173 0.00677 0.00903 -0.00521
263 10F+1 -0.00033 0.01072 -0.00079 -0.00506 0.00071
264 10F-1 -0.00058 -0.00079 0.00980 0.00071 -0.00425
265 10F+2 0.01103 0.00233 -0.00963 -0.00923 0.00434
266 10F-2 0.00637 -0.01232 0.00233 0.01500 -0.00923
267 10F+3 0.02505 -0.00784 -0.01359 -0.00098 -0.00170
268 10F-3 0.00000 -0.01206 0.00696 0.01051 -0.00607
269 8 H 1S 0.00000 0.01002 0.00579 -0.01830 -0.01057
270 2S 0.00000 -0.25578 -0.14767 -0.13370 -0.07719
271 3S 0.00000 -0.16719 -0.09653 5.17325 2.98677
272 4S 0.00000 -0.19488 -0.11251 0.81361 0.46974
273 5PX 0.01666 0.00009 0.01345 0.02408 0.00212
274 5PY -0.02885 0.01345 -0.01544 0.00212 0.02164
275 5PZ 0.00000 -0.00738 -0.00426 0.00460 0.00266
276 6PX -0.15189 -0.03087 -0.14382 -0.14376 0.00943
277 6PY 0.26307 -0.14382 0.13520 0.00943 -0.15465
278 6PZ 0.00000 0.10403 0.06006 -0.07662 -0.04424
279 7PX 0.50085 0.40224 0.61864 -1.89323 -1.20819
280 7PY -0.86750 0.61864 -0.31211 -1.20819 -0.49813
281 7PZ 0.00000 -0.53300 -0.30773 1.08860 0.62851
282 8D 0 0.00000 0.01555 0.00898 -0.00103 -0.00060
283 8D+1 0.00040 -0.00828 0.00634 0.01155 0.00050
284 8D-1 -0.00069 0.00634 -0.01559 0.00050 0.01097
285 8D+2 0.02676 0.00865 0.02189 -0.00808 -0.02121
286 8D-2 -0.01545 0.03188 0.00865 -0.03054 -0.00808
287 9D 0 0.00000 -0.10863 -0.06272 -0.06819 -0.03937
288 9D+1 0.02009 0.14525 -0.01214 -0.22316 -0.07485
289 9D-1 -0.03480 -0.01214 0.15927 -0.07485 -0.13672
290 9D+2 -0.29081 -0.09679 -0.24462 0.16263 0.24037
291 9D-2 0.16790 -0.35638 -0.09679 0.42816 0.16263
292 10F 0 0.00000 0.01173 0.00677 -0.00903 -0.00521
293 10F+1 -0.00033 0.01072 0.00079 -0.00506 -0.00071
294 10F-1 0.00058 0.00079 0.00980 -0.00071 -0.00425
295 10F+2 -0.01103 -0.00233 -0.00963 0.00923 0.00434
296 10F-2 0.00637 -0.01232 -0.00233 0.01500 0.00923
297 10F+3 0.02505 -0.00784 0.01359 -0.00098 0.00170
298 10F-3 0.00000 0.01206 0.00696 -0.01051 -0.00607
141 142 143 144 145
(EU)--V (EU)--V (A1G)--V (EG)--V (EG)--V
Eigenvalues -- 2.57979 2.57979 2.58647 2.63646 2.63646
1 1 Si 1S 0.00000 0.00000 -0.00332 0.00000 0.00000
2 2S 0.00000 0.00000 0.01723 0.00000 0.00000
3 3S 0.00000 0.00000 -0.03213 0.00000 0.00000
4 4S 0.00000 0.00000 -1.63121 0.00000 0.00000
5 5S 0.00000 0.00000 4.58057 0.00000 0.00000
6 6S 0.00000 0.00000 0.40948 0.00000 0.00000
7 7PX -0.01553 0.00000 0.00000 -0.07515 0.00000
8 7PY 0.00000 0.01553 0.00000 0.00000 -0.07515
9 7PZ 0.00000 0.00000 -0.04388 0.00000 0.00000
10 8PX -0.00163 0.00000 0.00000 -0.02156 0.00000
11 8PY 0.00000 0.00163 0.00000 0.00000 -0.02156
12 8PZ 0.00000 0.00000 -0.01463 0.00000 0.00000
13 9PX 0.08221 0.00000 0.00000 0.53008 0.00000
14 9PY 0.00000 -0.08221 0.00000 0.00000 0.53008
15 9PZ 0.00000 0.00000 0.32193 0.00000 0.00000
16 10PX 0.65862 0.00000 0.00000 -0.47513 0.00000
17 10PY 0.00000 -0.65862 0.00000 0.00000 -0.47513
18 10PZ 0.00000 0.00000 1.16929 0.00000 0.00000
19 11PX -0.12864 0.00000 0.00000 -0.08514 0.00000
20 11PY 0.00000 0.12864 0.00000 0.00000 -0.08514
21 11PZ 0.00000 0.00000 -0.06791 0.00000 0.00000
22 12D 0 0.00000 0.00000 0.01290 0.00000 0.00000
23 12D+1 0.24500 0.00000 0.00000 0.67908 0.00000
24 12D-1 0.00000 -0.24500 0.00000 0.00000 0.67908
25 12D+2 0.00000 0.05210 0.00000 0.00000 -0.00644
26 12D-2 -0.05210 0.00000 0.00000 -0.00644 0.00000
27 13D 0 0.00000 0.00000 -1.03040 0.00000 0.00000
28 13D+1 0.79654 0.00000 0.00000 0.66002 0.00000
29 13D-1 0.00000 -0.79654 0.00000 0.00000 0.66002
30 13D+2 0.00000 0.77354 0.00000 0.00000 -0.07647
31 13D-2 -0.77354 0.00000 0.00000 -0.07647 0.00000
32 14D 0 0.00000 0.00000 0.30210 0.00000 0.00000
33 14D+1 -0.19488 0.00000 0.00000 -0.35046 0.00000
34 14D-1 0.00000 0.19488 0.00000 0.00000 -0.35046
35 14D+2 0.00000 -0.27711 0.00000 0.00000 -0.04738
36 14D-2 0.27711 0.00000 0.00000 -0.04738 0.00000
37 15F 0 0.00000 0.00000 -0.58705 0.00000 0.00000
38 15F+1 0.68814 0.00000 0.00000 -0.55597 0.00000
39 15F-1 0.00000 -0.68814 0.00000 0.00000 -0.55597
40 15F+2 0.00000 0.18817 0.00000 0.00000 -0.31598
41 15F-2 -0.18817 0.00000 0.00000 -0.31598 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 -0.08275 0.00000 0.00000
44 16F 0 0.00000 0.00000 -0.14211 0.00000 0.00000
45 16F+1 -0.28899 0.00000 0.00000 -0.09050 0.00000
46 16F-1 0.00000 0.28899 0.00000 0.00000 -0.09050
47 16F+2 0.00000 -0.09400 0.00000 0.00000 -0.00703
48 16F-2 0.09400 0.00000 0.00000 -0.00703 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 -0.18693 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.04349 0.00000 0.00000
52 17G+1 -0.02853 0.00000 0.00000 -0.26260 0.00000
53 17G-1 0.00000 0.02853 0.00000 0.00000 -0.26260
54 17G+2 0.00000 0.34350 0.00000 0.00000 -0.25887
55 17G-2 -0.34350 0.00000 0.00000 -0.25887 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 -0.20697 0.00000 0.00000
58 17G+4 0.00000 0.16540 0.00000 0.00000 -0.00658
59 17G-4 0.16540 0.00000 0.00000 0.00658 0.00000
60 2 Si 1S 0.00000 0.00000 -0.00332 0.00000 0.00000
61 2S 0.00000 0.00000 0.01723 0.00000 0.00000
62 3S 0.00000 0.00000 -0.03213 0.00000 0.00000
63 4S 0.00000 0.00000 -1.63121 0.00000 0.00000
64 5S 0.00000 0.00000 4.58057 0.00000 0.00000
65 6S 0.00000 0.00000 0.40948 0.00000 0.00000
66 7PX -0.01553 0.00000 0.00000 0.07515 0.00000
67 7PY 0.00000 0.01553 0.00000 0.00000 0.07515
68 7PZ 0.00000 0.00000 0.04388 0.00000 0.00000
69 8PX -0.00163 0.00000 0.00000 0.02156 0.00000
70 8PY 0.00000 0.00163 0.00000 0.00000 0.02156
71 8PZ 0.00000 0.00000 0.01463 0.00000 0.00000
72 9PX 0.08221 0.00000 0.00000 -0.53008 0.00000
73 9PY 0.00000 -0.08221 0.00000 0.00000 -0.53008
74 9PZ 0.00000 0.00000 -0.32193 0.00000 0.00000
75 10PX 0.65862 0.00000 0.00000 0.47513 0.00000
76 10PY 0.00000 -0.65862 0.00000 0.00000 0.47513
77 10PZ 0.00000 0.00000 -1.16929 0.00000 0.00000
78 11PX -0.12864 0.00000 0.00000 0.08514 0.00000
79 11PY 0.00000 0.12864 0.00000 0.00000 0.08514
80 11PZ 0.00000 0.00000 0.06791 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.01290 0.00000 0.00000
82 12D+1 -0.24500 0.00000 0.00000 0.67908 0.00000
83 12D-1 0.00000 0.24500 0.00000 0.00000 0.67908
84 12D+2 0.00000 -0.05210 0.00000 0.00000 -0.00644
85 12D-2 0.05210 0.00000 0.00000 -0.00644 0.00000
86 13D 0 0.00000 0.00000 -1.03040 0.00000 0.00000
87 13D+1 -0.79654 0.00000 0.00000 0.66002 0.00000
88 13D-1 0.00000 0.79654 0.00000 0.00000 0.66002
89 13D+2 0.00000 -0.77354 0.00000 0.00000 -0.07647
90 13D-2 0.77354 0.00000 0.00000 -0.07647 0.00000
91 14D 0 0.00000 0.00000 0.30210 0.00000 0.00000
92 14D+1 0.19488 0.00000 0.00000 -0.35046 0.00000
93 14D-1 0.00000 -0.19488 0.00000 0.00000 -0.35046
94 14D+2 0.00000 0.27711 0.00000 0.00000 -0.04738
95 14D-2 -0.27711 0.00000 0.00000 -0.04738 0.00000
96 15F 0 0.00000 0.00000 0.58705 0.00000 0.00000
97 15F+1 0.68814 0.00000 0.00000 0.55597 0.00000
98 15F-1 0.00000 -0.68814 0.00000 0.00000 0.55597
99 15F+2 0.00000 0.18817 0.00000 0.00000 0.31598
100 15F-2 -0.18817 0.00000 0.00000 0.31598 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.08275 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.14211 0.00000 0.00000
104 16F+1 -0.28899 0.00000 0.00000 0.09050 0.00000
105 16F-1 0.00000 0.28899 0.00000 0.00000 0.09050
106 16F+2 0.00000 -0.09400 0.00000 0.00000 0.00703
107 16F-2 0.09400 0.00000 0.00000 0.00703 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.18693 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.04349 0.00000 0.00000
111 17G+1 0.02853 0.00000 0.00000 -0.26260 0.00000
112 17G-1 0.00000 -0.02853 0.00000 0.00000 -0.26260
113 17G+2 0.00000 -0.34350 0.00000 0.00000 -0.25887
114 17G-2 0.34350 0.00000 0.00000 -0.25887 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 -0.20697 0.00000 0.00000
117 17G+4 0.00000 -0.16540 0.00000 0.00000 -0.00658
118 17G-4 -0.16540 0.00000 0.00000 0.00658 0.00000
119 3 H 1S 0.00000 -0.00347 0.00455 0.00000 0.00377
120 2S 0.00000 -0.24252 0.07532 0.00000 -0.28269
121 3S 0.00000 1.26216 -1.65111 0.00000 -0.20770
122 4S 0.00000 -0.15700 -0.19939 0.00000 -0.16903
123 5PX 0.01140 0.00000 0.00000 -0.00867 0.00000
124 5PY 0.00000 -0.00153 0.00290 0.00000 0.00792
125 5PZ 0.00000 0.05276 -0.00902 0.00000 -0.01430
126 6PX -0.10404 0.00000 0.00000 0.08128 0.00000
127 6PY 0.00000 0.00872 -0.04961 0.00000 -0.09036
128 6PZ 0.00000 -0.44237 0.05715 0.00000 0.12693
129 7PX 0.22629 0.00000 0.00000 -0.09922 0.00000
130 7PY 0.00000 -0.66466 0.82127 0.00000 0.30691
131 7PZ 0.00000 0.64698 0.19661 0.00000 -0.18053
132 8D 0 0.00000 -0.01094 -0.03928 0.00000 -0.04290
133 8D+1 0.04321 0.00000 0.00000 -0.04539 0.00000
134 8D-1 0.00000 0.02601 0.02803 0.00000 0.03262
135 8D+2 0.00000 0.01658 0.02943 0.00000 0.01509
136 8D-2 -0.00259 0.00000 0.00000 0.00951 0.00000
137 9D 0 0.00000 0.06756 0.35617 0.00000 0.41350
138 9D+1 -0.39816 0.00000 0.00000 0.39778 0.00000
139 9D-1 0.00000 -0.23722 -0.29304 0.00000 -0.29031
140 9D+2 0.00000 -0.19430 -0.21207 0.00000 -0.07136
141 9D-2 -0.00468 0.00000 0.00000 -0.07699 0.00000
142 10F 0 0.00000 0.00069 -0.00163 0.00000 0.00793
143 10F+1 -0.00531 0.00000 0.00000 -0.00681 0.00000
144 10F-1 0.00000 0.01437 0.00201 0.00000 -0.01447
145 10F+2 0.00000 -0.00773 -0.00692 0.00000 0.00914
146 10F-2 0.00134 0.00000 0.00000 0.00646 0.00000
147 10F+3 -0.01090 0.00000 0.00000 0.00936 0.00000
148 10F-3 0.00000 0.00684 -0.01045 0.00000 -0.00570
149 4 H 1S -0.00301 0.00174 0.00455 -0.00327 -0.00189
150 2S -0.21003 0.12126 0.07532 0.24481 0.14134
151 3S 1.09306 -0.63108 -1.65111 0.17988 0.10385
152 4S -0.13596 0.07850 -0.19939 0.14638 0.08451
153 5PX 0.00400 0.00428 -0.00251 0.00377 0.00718
154 5PY -0.00428 -0.00893 -0.00145 0.00718 -0.00452
155 5PZ 0.04569 -0.02638 -0.00902 0.01238 0.00715
156 6PX -0.03255 -0.04128 0.04296 -0.04745 -0.07432
157 6PY 0.04128 0.08021 0.02480 -0.07432 0.03837
158 6PZ -0.38311 0.22119 0.05715 -0.10993 -0.06347
159 7PX 0.55507 -0.18982 -0.71124 0.20538 0.17586
160 7PY 0.18982 -0.33589 -0.41063 0.17586 0.00232
161 7PZ 0.56030 -0.32349 0.19661 0.15635 0.09027
162 8D 0 -0.00947 0.00547 -0.03928 0.03715 0.02145
163 8D+1 -0.00870 0.02997 -0.02427 0.01312 0.03378
164 8D-1 -0.02997 -0.02591 -0.01401 0.03378 -0.02589
165 8D+2 -0.00606 0.00609 -0.01471 0.00241 0.01091
166 8D-2 -0.01309 0.00606 -0.02549 0.01370 0.00241
167 9D 0 0.05851 -0.03378 0.35617 -0.35810 -0.20675
168 9D+1 0.07838 -0.27513 0.25378 -0.11829 -0.29795
169 9D-1 0.27513 0.23932 0.14652 -0.29795 0.22576
170 9D+2 0.08616 -0.04506 0.10604 0.00244 -0.07558
171 9D-2 0.14455 -0.08616 0.18366 -0.07277 0.00244
172 10F 0 0.00060 -0.00035 -0.00163 -0.00686 -0.00396
173 10F+1 -0.01211 0.00393 -0.00174 -0.01256 -0.00332
174 10F-1 -0.00393 0.00757 -0.00101 -0.00332 -0.00872
175 10F+2 0.00277 -0.00294 0.00346 0.00116 0.00713
176 10F-2 0.00614 -0.00277 0.00600 0.00847 0.00116
177 10F+3 0.00545 0.00944 0.00000 -0.00468 0.00811
178 10F-3 0.00592 -0.00342 -0.01045 0.00493 0.00285
179 5 H 1S 0.00301 0.00174 0.00455 0.00327 -0.00189
180 2S 0.21003 0.12126 0.07532 -0.24481 0.14134
181 3S -1.09306 -0.63108 -1.65111 -0.17988 0.10385
182 4S 0.13596 0.07850 -0.19939 -0.14638 0.08451
183 5PX 0.00400 -0.00428 0.00251 0.00377 -0.00718
184 5PY 0.00428 -0.00893 -0.00145 -0.00718 -0.00452
185 5PZ -0.04569 -0.02638 -0.00902 -0.01238 0.00715
186 6PX -0.03255 0.04128 -0.04296 -0.04745 0.07432
187 6PY -0.04128 0.08021 0.02480 0.07432 0.03837
188 6PZ 0.38311 0.22119 0.05715 0.10993 -0.06347
189 7PX 0.55507 0.18982 0.71124 0.20538 -0.17586
190 7PY -0.18982 -0.33589 -0.41063 -0.17586 0.00232
191 7PZ -0.56030 -0.32349 0.19661 -0.15635 0.09027
192 8D 0 0.00947 0.00547 -0.03928 -0.03715 0.02145
193 8D+1 -0.00870 -0.02997 0.02427 0.01312 -0.03378
194 8D-1 0.02997 -0.02591 -0.01401 -0.03378 -0.02589
195 8D+2 0.00606 0.00609 -0.01471 -0.00241 0.01091
196 8D-2 -0.01309 -0.00606 0.02549 0.01370 -0.00241
197 9D 0 -0.05851 -0.03378 0.35617 0.35810 -0.20675
198 9D+1 0.07838 0.27513 -0.25378 -0.11829 0.29795
199 9D-1 -0.27513 0.23932 0.14652 0.29795 0.22576
200 9D+2 -0.08616 -0.04506 0.10604 -0.00244 -0.07558
201 9D-2 0.14455 0.08616 -0.18366 -0.07277 -0.00244
202 10F 0 -0.00060 -0.00035 -0.00163 0.00686 -0.00396
203 10F+1 -0.01211 -0.00393 0.00174 -0.01256 0.00332
204 10F-1 0.00393 0.00757 -0.00101 0.00332 -0.00872
205 10F+2 -0.00277 -0.00294 0.00346 -0.00116 0.00713
206 10F-2 0.00614 0.00277 -0.00600 0.00847 -0.00116
207 10F+3 0.00545 -0.00944 0.00000 -0.00468 -0.00811
208 10F-3 -0.00592 -0.00342 -0.01045 -0.00493 0.00285
209 6 H 1S 0.00000 0.00347 0.00455 0.00000 0.00377
210 2S 0.00000 0.24252 0.07532 0.00000 -0.28269
211 3S 0.00000 -1.26216 -1.65111 0.00000 -0.20770
212 4S 0.00000 0.15700 -0.19939 0.00000 -0.16903
213 5PX 0.01140 0.00000 0.00000 0.00867 0.00000
214 5PY 0.00000 -0.00153 -0.00290 0.00000 -0.00792
215 5PZ 0.00000 0.05276 0.00902 0.00000 0.01430
216 6PX -0.10404 0.00000 0.00000 -0.08128 0.00000
217 6PY 0.00000 0.00872 0.04961 0.00000 0.09036
218 6PZ 0.00000 -0.44237 -0.05715 0.00000 -0.12693
219 7PX 0.22629 0.00000 0.00000 0.09922 0.00000
220 7PY 0.00000 -0.66466 -0.82127 0.00000 -0.30691
221 7PZ 0.00000 0.64698 -0.19661 0.00000 0.18053
222 8D 0 0.00000 0.01094 -0.03928 0.00000 -0.04290
223 8D+1 -0.04321 0.00000 0.00000 -0.04539 0.00000
224 8D-1 0.00000 -0.02601 0.02803 0.00000 0.03262
225 8D+2 0.00000 -0.01658 0.02943 0.00000 0.01509
226 8D-2 0.00259 0.00000 0.00000 0.00951 0.00000
227 9D 0 0.00000 -0.06756 0.35617 0.00000 0.41350
228 9D+1 0.39816 0.00000 0.00000 0.39778 0.00000
229 9D-1 0.00000 0.23722 -0.29304 0.00000 -0.29031
230 9D+2 0.00000 0.19430 -0.21207 0.00000 -0.07136
231 9D-2 0.00468 0.00000 0.00000 -0.07699 0.00000
232 10F 0 0.00000 0.00069 0.00163 0.00000 -0.00793
233 10F+1 -0.00531 0.00000 0.00000 0.00681 0.00000
234 10F-1 0.00000 0.01437 -0.00201 0.00000 0.01447
235 10F+2 0.00000 -0.00773 0.00692 0.00000 -0.00914
236 10F-2 0.00134 0.00000 0.00000 -0.00646 0.00000
237 10F+3 -0.01090 0.00000 0.00000 -0.00936 0.00000
238 10F-3 0.00000 0.00684 0.01045 0.00000 0.00570
239 7 H 1S -0.00301 -0.00174 0.00455 0.00327 -0.00189
240 2S -0.21003 -0.12126 0.07532 -0.24481 0.14134
241 3S 1.09306 0.63108 -1.65111 -0.17988 0.10385
242 4S -0.13596 -0.07850 -0.19939 -0.14638 0.08451
243 5PX 0.00400 -0.00428 -0.00251 -0.00377 0.00718
244 5PY 0.00428 -0.00893 0.00145 0.00718 0.00452
245 5PZ -0.04569 -0.02638 0.00902 0.01238 -0.00715
246 6PX -0.03255 0.04128 0.04296 0.04745 -0.07432
247 6PY -0.04128 0.08021 -0.02480 -0.07432 -0.03837
248 6PZ 0.38311 0.22119 -0.05715 -0.10993 0.06347
249 7PX 0.55507 0.18982 -0.71124 -0.20538 0.17586
250 7PY -0.18982 -0.33589 0.41063 0.17586 -0.00232
251 7PZ -0.56030 -0.32349 -0.19661 0.15635 -0.09027
252 8D 0 -0.00947 -0.00547 -0.03928 -0.03715 0.02145
253 8D+1 0.00870 0.02997 0.02427 0.01312 -0.03378
254 8D-1 -0.02997 0.02591 -0.01401 -0.03378 -0.02589
255 8D+2 -0.00606 -0.00609 -0.01471 -0.00241 0.01091
256 8D-2 0.01309 0.00606 0.02549 0.01370 -0.00241
257 9D 0 0.05851 0.03378 0.35617 0.35810 -0.20675
258 9D+1 -0.07838 -0.27513 -0.25378 -0.11829 0.29795
259 9D-1 0.27513 -0.23932 0.14652 0.29795 0.22576
260 9D+2 0.08616 0.04506 0.10604 -0.00244 -0.07558
261 9D-2 -0.14455 -0.08616 -0.18366 -0.07277 -0.00244
262 10F 0 -0.00060 -0.00035 0.00163 -0.00686 0.00396
263 10F+1 -0.01211 -0.00393 -0.00174 0.01256 -0.00332
264 10F-1 0.00393 0.00757 0.00101 -0.00332 0.00872
265 10F+2 -0.00277 -0.00294 -0.00346 0.00116 -0.00713
266 10F-2 0.00614 0.00277 0.00600 -0.00847 0.00116
267 10F+3 0.00545 -0.00944 0.00000 0.00468 0.00811
268 10F-3 -0.00592 -0.00342 0.01045 0.00493 -0.00285
269 8 H 1S 0.00301 -0.00174 0.00455 -0.00327 -0.00189
270 2S 0.21003 -0.12126 0.07532 0.24481 0.14134
271 3S -1.09306 0.63108 -1.65111 0.17988 0.10385
272 4S 0.13596 -0.07850 -0.19939 0.14638 0.08451
273 5PX 0.00400 0.00428 0.00251 -0.00377 -0.00718
274 5PY -0.00428 -0.00893 0.00145 -0.00718 0.00452
275 5PZ 0.04569 -0.02638 0.00902 -0.01238 -0.00715
276 6PX -0.03255 -0.04128 -0.04296 0.04745 0.07432
277 6PY 0.04128 0.08021 -0.02480 0.07432 -0.03837
278 6PZ -0.38311 0.22119 -0.05715 0.10993 0.06347
279 7PX 0.55507 -0.18982 0.71124 -0.20538 -0.17586
280 7PY 0.18982 -0.33589 0.41063 -0.17586 -0.00232
281 7PZ 0.56030 -0.32349 -0.19661 -0.15635 -0.09027
282 8D 0 0.00947 -0.00547 -0.03928 0.03715 0.02145
283 8D+1 0.00870 -0.02997 -0.02427 0.01312 0.03378
284 8D-1 0.02997 0.02591 -0.01401 0.03378 -0.02589
285 8D+2 0.00606 -0.00609 -0.01471 0.00241 0.01091
286 8D-2 0.01309 -0.00606 -0.02549 0.01370 0.00241
287 9D 0 -0.05851 0.03378 0.35617 -0.35810 -0.20675
288 9D+1 -0.07838 0.27513 0.25378 -0.11829 -0.29795
289 9D-1 -0.27513 -0.23932 0.14652 -0.29795 0.22576
290 9D+2 -0.08616 0.04506 0.10604 0.00244 -0.07558
291 9D-2 -0.14455 0.08616 0.18366 -0.07277 0.00244
292 10F 0 0.00060 -0.00035 0.00163 0.00686 0.00396
293 10F+1 -0.01211 0.00393 0.00174 0.01256 0.00332
294 10F-1 -0.00393 0.00757 0.00101 0.00332 0.00872
295 10F+2 0.00277 -0.00294 -0.00346 -0.00116 -0.00713
296 10F-2 0.00614 -0.00277 -0.00600 -0.00847 -0.00116
297 10F+3 0.00545 0.00944 0.00000 0.00468 -0.00811
298 10F-3 0.00592 -0.00342 0.01045 -0.00493 -0.00285
146 147 148 149 150
(A2U)--V (EG)--V (EG)--V (A2U)--V (A1G)--V
Eigenvalues -- 2.65380 2.68814 2.68814 2.73418 2.73716
1 1 Si 1S -0.00437 0.00000 0.00000 0.01276 -0.00269
2 2S 0.02326 0.00000 0.00000 0.02556 0.04522
3 3S -0.03588 0.00000 0.00000 0.15500 -0.01545
4 4S -1.45199 0.00000 0.00000 -2.55579 -4.01009
5 5S 3.92349 0.00000 0.00000 9.73957 11.83974
6 6S 1.25013 0.00000 0.00000 -1.40815 2.19950
7 7PX 0.00000 -0.05291 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 0.05291 0.00000 0.00000
9 7PZ -0.05641 0.00000 0.00000 -0.06053 -0.11655
10 8PX 0.00000 0.00677 0.00000 0.00000 0.00000
11 8PY 0.00000 0.00000 -0.00677 0.00000 0.00000
12 8PZ -0.02089 0.00000 0.00000 -0.04329 -0.04053
13 9PX 0.00000 0.22461 0.00000 0.00000 0.00000
14 9PY 0.00000 0.00000 -0.22461 0.00000 0.00000
15 9PZ 0.40077 0.00000 0.00000 0.00128 0.64271
16 10PX 0.00000 0.98043 0.00000 0.00000 0.00000
17 10PY 0.00000 0.00000 -0.98043 0.00000 0.00000
18 10PZ -0.39775 0.00000 0.00000 5.51583 3.20734
19 11PX 0.00000 0.37205 0.00000 0.00000 0.00000
20 11PY 0.00000 0.00000 -0.37205 0.00000 0.00000
21 11PZ -0.07332 0.00000 0.00000 1.11428 0.22192
22 12D 0 0.47402 0.00000 0.00000 -1.88285 -0.87501
23 12D+1 0.00000 0.04472 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 -0.04472 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.81909 0.00000 0.00000
26 12D-2 0.00000 -0.81909 0.00000 0.00000 0.00000
27 13D 0 0.56315 0.00000 0.00000 -2.06481 -1.58241
28 13D+1 0.00000 1.10990 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 -1.10990 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.64588 0.00000 0.00000
31 13D-2 0.00000 -0.64588 0.00000 0.00000 0.00000
32 14D 0 -0.25927 0.00000 0.00000 0.61444 0.34765
33 14D+1 0.00000 -0.56427 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.56427 0.00000 0.00000
35 14D+2 0.00000 0.00000 -0.02934 0.00000 0.00000
36 14D-2 0.00000 0.02934 0.00000 0.00000 0.00000
37 15F 0 -0.52350 0.00000 0.00000 -0.50758 -0.94525
38 15F+1 0.00000 -0.63518 0.00000 0.00000 0.00000
39 15F-1 0.00000 0.00000 0.63518 0.00000 0.00000
40 15F+2 0.00000 0.00000 0.37047 0.00000 0.00000
41 15F-2 0.00000 -0.37047 0.00000 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.29188 0.00000 0.00000 -1.49405 -1.92569
44 16F 0 0.17285 0.00000 0.00000 -0.42249 -0.12773
45 16F+1 0.00000 0.09480 0.00000 0.00000 0.00000
46 16F-1 0.00000 0.00000 -0.09480 0.00000 0.00000
47 16F+2 0.00000 0.00000 -0.17178 0.00000 0.00000
48 16F-2 0.00000 0.17178 0.00000 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 -0.27636 0.00000 0.00000 -0.16581 -0.13570
51 17G 0 -0.08386 0.00000 0.00000 0.19485 0.16710
52 17G+1 0.00000 -0.14719 0.00000 0.00000 0.00000
53 17G-1 0.00000 0.00000 0.14719 0.00000 0.00000
54 17G+2 0.00000 0.00000 -0.24828 0.00000 0.00000
55 17G-2 0.00000 0.24828 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.38531 0.00000 0.00000 -0.73615 -0.78500
58 17G+4 0.00000 0.00000 0.11583 0.00000 0.00000
59 17G-4 0.00000 0.11583 0.00000 0.00000 0.00000
60 2 Si 1S 0.00437 0.00000 0.00000 -0.01276 -0.00269
61 2S -0.02326 0.00000 0.00000 -0.02556 0.04522
62 3S 0.03588 0.00000 0.00000 -0.15500 -0.01545
63 4S 1.45199 0.00000 0.00000 2.55579 -4.01009
64 5S -3.92349 0.00000 0.00000 -9.73957 11.83974
65 6S -1.25013 0.00000 0.00000 1.40815 2.19950
66 7PX 0.00000 0.05291 0.00000 0.00000 0.00000
67 7PY 0.00000 0.00000 -0.05291 0.00000 0.00000
68 7PZ -0.05641 0.00000 0.00000 -0.06053 0.11655
69 8PX 0.00000 -0.00677 0.00000 0.00000 0.00000
70 8PY 0.00000 0.00000 0.00677 0.00000 0.00000
71 8PZ -0.02089 0.00000 0.00000 -0.04329 0.04053
72 9PX 0.00000 -0.22461 0.00000 0.00000 0.00000
73 9PY 0.00000 0.00000 0.22461 0.00000 0.00000
74 9PZ 0.40077 0.00000 0.00000 0.00128 -0.64271
75 10PX 0.00000 -0.98043 0.00000 0.00000 0.00000
76 10PY 0.00000 0.00000 0.98043 0.00000 0.00000
77 10PZ -0.39775 0.00000 0.00000 5.51583 -3.20734
78 11PX 0.00000 -0.37205 0.00000 0.00000 0.00000
79 11PY 0.00000 0.00000 0.37205 0.00000 0.00000
80 11PZ -0.07332 0.00000 0.00000 1.11428 -0.22192
81 12D 0 -0.47402 0.00000 0.00000 1.88285 -0.87501
82 12D+1 0.00000 0.04472 0.00000 0.00000 0.00000
83 12D-1 0.00000 0.00000 -0.04472 0.00000 0.00000
84 12D+2 0.00000 0.00000 0.81909 0.00000 0.00000
85 12D-2 0.00000 -0.81909 0.00000 0.00000 0.00000
86 13D 0 -0.56315 0.00000 0.00000 2.06481 -1.58241
87 13D+1 0.00000 1.10990 0.00000 0.00000 0.00000
88 13D-1 0.00000 0.00000 -1.10990 0.00000 0.00000
89 13D+2 0.00000 0.00000 0.64588 0.00000 0.00000
90 13D-2 0.00000 -0.64588 0.00000 0.00000 0.00000
91 14D 0 0.25927 0.00000 0.00000 -0.61444 0.34765
92 14D+1 0.00000 -0.56427 0.00000 0.00000 0.00000
93 14D-1 0.00000 0.00000 0.56427 0.00000 0.00000
94 14D+2 0.00000 0.00000 -0.02934 0.00000 0.00000
95 14D-2 0.00000 0.02934 0.00000 0.00000 0.00000
96 15F 0 -0.52350 0.00000 0.00000 -0.50758 0.94525
97 15F+1 0.00000 0.63518 0.00000 0.00000 0.00000
98 15F-1 0.00000 0.00000 -0.63518 0.00000 0.00000
99 15F+2 0.00000 0.00000 -0.37047 0.00000 0.00000
100 15F-2 0.00000 0.37047 0.00000 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 -0.29188 0.00000 0.00000 -1.49405 1.92569
103 16F 0 0.17285 0.00000 0.00000 -0.42249 0.12773
104 16F+1 0.00000 -0.09480 0.00000 0.00000 0.00000
105 16F-1 0.00000 0.00000 0.09480 0.00000 0.00000
106 16F+2 0.00000 0.00000 0.17178 0.00000 0.00000
107 16F-2 0.00000 -0.17178 0.00000 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 -0.27636 0.00000 0.00000 -0.16581 0.13570
110 17G 0 0.08386 0.00000 0.00000 -0.19485 0.16710
111 17G+1 0.00000 -0.14719 0.00000 0.00000 0.00000
112 17G-1 0.00000 0.00000 0.14719 0.00000 0.00000
113 17G+2 0.00000 0.00000 -0.24828 0.00000 0.00000
114 17G-2 0.00000 0.24828 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.38531 0.00000 0.00000 0.73615 -0.78500
117 17G+4 0.00000 0.00000 0.11583 0.00000 0.00000
118 17G-4 0.00000 0.11583 0.00000 0.00000 0.00000
119 3 H 1S 0.00510 0.00000 -0.00301 0.01448 0.01262
120 2S -0.14825 0.00000 -0.02217 -0.01369 -0.07010
121 3S -0.75549 0.00000 1.60908 -4.17414 -4.40354
122 4S -0.30509 0.00000 0.39929 -0.74912 -0.86686
123 5PX 0.00000 0.06829 0.00000 0.00000 0.00000
124 5PY 0.01995 0.00000 0.04376 -0.00373 0.01082
125 5PZ -0.02661 0.00000 -0.03156 0.02135 -0.01697
126 6PX 0.00000 -0.55217 0.00000 0.00000 0.00000
127 6PY -0.19212 0.00000 -0.38475 -0.03065 -0.13775
128 6PZ 0.21414 0.00000 0.25410 -0.19285 0.12113
129 7PX 0.00000 0.65791 0.00000 0.00000 0.00000
130 7PY 0.64902 0.00000 -0.13926 1.77405 1.87501
131 7PZ -0.21474 0.00000 -0.62851 0.92523 0.64278
132 8D 0 0.01678 0.00000 0.01447 -0.01530 -0.00077
133 8D+1 0.00000 0.03303 0.00000 0.00000 0.00000
134 8D-1 -0.01977 0.00000 -0.02157 0.01725 0.00583
135 8D+2 -0.03764 0.00000 -0.02489 -0.01443 -0.03492
136 8D-2 0.00000 0.00060 0.00000 0.00000 0.00000
137 9D 0 -0.11602 0.00000 -0.15460 0.17973 0.04987
138 9D+1 0.00000 -0.27269 0.00000 0.00000 0.00000
139 9D-1 0.16349 0.00000 0.20778 -0.25290 -0.14267
140 9D+2 0.37373 0.00000 0.16194 0.25531 0.43331
141 9D-2 0.00000 0.00450 0.00000 0.00000 0.00000
142 10F 0 -0.00554 0.00000 -0.00168 -0.00130 -0.00162
143 10F+1 0.00000 -0.00936 0.00000 0.00000 0.00000
144 10F-1 -0.01505 0.00000 0.00165 0.00115 -0.00428
145 10F+2 -0.00281 0.00000 -0.00343 -0.01482 -0.01359
146 10F-2 0.00000 -0.00281 0.00000 0.00000 0.00000
147 10F+3 0.00000 -0.00301 0.00000 0.00000 0.00000
148 10F-3 0.00114 0.00000 -0.00277 -0.01167 -0.00436
149 4 H 1S 0.00510 -0.00261 0.00151 0.01448 0.01262
150 2S -0.14825 -0.01920 0.01109 -0.01369 -0.07010
151 3S -0.75549 1.39350 -0.80454 -4.17414 -4.40354
152 4S -0.30509 0.34579 -0.19964 -0.74912 -0.86686
153 5PX -0.01728 -0.01575 0.04852 0.00323 -0.00937
154 5PY -0.00998 -0.04852 -0.04028 0.00186 -0.00541
155 5PZ -0.02661 -0.02733 0.01578 0.02135 -0.01697
156 6PX 0.16638 0.15052 -0.40570 0.02655 0.11929
157 6PY 0.09606 0.40570 0.31794 0.01533 0.06887
158 6PZ 0.21414 0.22006 -0.12705 -0.19285 0.12113
159 7PX -0.56207 0.26892 0.22458 -1.53637 -1.62381
160 7PY -0.32451 -0.22458 -0.52825 -0.88703 -0.93751
161 7PZ -0.21474 -0.54430 0.31425 0.92523 0.64278
162 8D 0 0.01678 0.01253 -0.00723 -0.01530 -0.00077
163 8D+1 0.01712 0.02444 0.00496 -0.01494 -0.00505
164 8D-1 0.00988 -0.00496 -0.03016 -0.00863 -0.00292
165 8D+2 0.01882 0.01052 -0.00668 0.00721 0.01746
166 8D-2 0.03260 0.01882 -0.01052 0.01249 0.03024
167 9D 0 -0.11602 -0.13389 0.07730 0.17973 0.04987
168 9D+1 -0.14159 -0.22400 -0.02811 0.21902 0.12355
169 9D-1 -0.08174 0.02811 0.25646 0.12645 0.07133
170 9D+2 -0.18687 -0.07207 0.03711 -0.12765 -0.21665
171 9D-2 -0.32366 -0.12033 0.07207 -0.22110 -0.37526
172 10F 0 -0.00554 -0.00146 0.00084 -0.00130 -0.00162
173 10F+1 0.01303 -0.00358 -0.00334 -0.00100 0.00371
174 10F-1 0.00752 0.00334 0.00743 -0.00058 0.00214
175 10F+2 0.00140 0.00270 0.00125 0.00741 0.00679
176 10F-2 0.00243 0.00187 -0.00270 0.01284 0.01177
177 10F+3 0.00000 0.00150 0.00261 0.00000 0.00000
178 10F-3 0.00114 -0.00240 0.00139 -0.01167 -0.00436
179 5 H 1S 0.00510 0.00261 0.00151 0.01448 0.01262
180 2S -0.14825 0.01920 0.01109 -0.01369 -0.07010
181 3S -0.75549 -1.39350 -0.80454 -4.17414 -4.40354
182 4S -0.30509 -0.34579 -0.19964 -0.74912 -0.86686
183 5PX 0.01728 -0.01575 -0.04852 -0.00323 0.00937
184 5PY -0.00998 0.04852 -0.04028 0.00186 -0.00541
185 5PZ -0.02661 0.02733 0.01578 0.02135 -0.01697
186 6PX -0.16638 0.15052 0.40570 -0.02655 -0.11929
187 6PY 0.09606 -0.40570 0.31794 0.01533 0.06887
188 6PZ 0.21414 -0.22006 -0.12705 -0.19285 0.12113
189 7PX 0.56207 0.26892 -0.22458 1.53637 1.62381
190 7PY -0.32451 0.22458 -0.52825 -0.88703 -0.93751
191 7PZ -0.21474 0.54430 0.31425 0.92523 0.64278
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193 8D+1 -0.01712 0.02444 -0.00496 0.01494 0.00505
194 8D-1 0.00988 0.00496 -0.03016 -0.00863 -0.00292
195 8D+2 0.01882 -0.01052 -0.00668 0.00721 0.01746
196 8D-2 -0.03260 0.01882 0.01052 -0.01249 -0.03024
197 9D 0 -0.11602 0.13389 0.07730 0.17973 0.04987
198 9D+1 0.14159 -0.22400 0.02811 -0.21902 -0.12355
199 9D-1 -0.08174 -0.02811 0.25646 0.12645 0.07133
200 9D+2 -0.18687 0.07207 0.03711 -0.12765 -0.21665
201 9D-2 0.32366 -0.12033 -0.07207 0.22110 0.37526
202 10F 0 -0.00554 0.00146 0.00084 -0.00130 -0.00162
203 10F+1 -0.01303 -0.00358 0.00334 0.00100 -0.00371
204 10F-1 0.00752 -0.00334 0.00743 -0.00058 0.00214
205 10F+2 0.00140 -0.00270 0.00125 0.00741 0.00679
206 10F-2 -0.00243 0.00187 0.00270 -0.01284 -0.01177
207 10F+3 0.00000 0.00150 -0.00261 0.00000 0.00000
208 10F-3 0.00114 0.00240 0.00139 -0.01167 -0.00436
209 6 H 1S -0.00510 0.00000 -0.00301 -0.01448 0.01262
210 2S 0.14825 0.00000 -0.02217 0.01369 -0.07010
211 3S 0.75549 0.00000 1.60908 4.17414 -4.40354
212 4S 0.30509 0.00000 0.39929 0.74912 -0.86686
213 5PX 0.00000 -0.06829 0.00000 0.00000 0.00000
214 5PY 0.01995 0.00000 -0.04376 -0.00373 -0.01082
215 5PZ -0.02661 0.00000 0.03156 0.02135 0.01697
216 6PX 0.00000 0.55217 0.00000 0.00000 0.00000
217 6PY -0.19212 0.00000 0.38475 -0.03065 0.13775
218 6PZ 0.21414 0.00000 -0.25410 -0.19285 -0.12113
219 7PX 0.00000 -0.65791 0.00000 0.00000 0.00000
220 7PY 0.64902 0.00000 0.13926 1.77405 -1.87501
221 7PZ -0.21474 0.00000 0.62851 0.92523 -0.64278
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223 8D+1 0.00000 0.03303 0.00000 0.00000 0.00000
224 8D-1 0.01977 0.00000 -0.02157 -0.01725 0.00583
225 8D+2 0.03764 0.00000 -0.02489 0.01443 -0.03492
226 8D-2 0.00000 0.00060 0.00000 0.00000 0.00000
227 9D 0 0.11602 0.00000 -0.15460 -0.17973 0.04987
228 9D+1 0.00000 -0.27269 0.00000 0.00000 0.00000
229 9D-1 -0.16349 0.00000 0.20778 0.25290 -0.14267
230 9D+2 -0.37373 0.00000 0.16194 -0.25531 0.43331
231 9D-2 0.00000 0.00450 0.00000 0.00000 0.00000
232 10F 0 -0.00554 0.00000 0.00168 -0.00130 0.00162
233 10F+1 0.00000 0.00936 0.00000 0.00000 0.00000
234 10F-1 -0.01505 0.00000 -0.00165 0.00115 0.00428
235 10F+2 -0.00281 0.00000 0.00343 -0.01482 0.01359
236 10F-2 0.00000 0.00281 0.00000 0.00000 0.00000
237 10F+3 0.00000 0.00301 0.00000 0.00000 0.00000
238 10F-3 0.00114 0.00000 0.00277 -0.01167 0.00436
239 7 H 1S -0.00510 0.00261 0.00151 -0.01448 0.01262
240 2S 0.14825 0.01920 0.01109 0.01369 -0.07010
241 3S 0.75549 -1.39350 -0.80454 4.17414 -4.40354
242 4S 0.30509 -0.34579 -0.19964 0.74912 -0.86686
243 5PX 0.01728 0.01575 0.04852 -0.00323 -0.00937
244 5PY -0.00998 -0.04852 0.04028 0.00186 0.00541
245 5PZ -0.02661 -0.02733 -0.01578 0.02135 0.01697
246 6PX -0.16638 -0.15052 -0.40570 -0.02655 0.11929
247 6PY 0.09606 0.40570 -0.31794 0.01533 -0.06887
248 6PZ 0.21414 0.22006 0.12705 -0.19285 -0.12113
249 7PX 0.56207 -0.26892 0.22458 1.53637 -1.62381
250 7PY -0.32451 -0.22458 0.52825 -0.88703 0.93751
251 7PZ -0.21474 -0.54430 -0.31425 0.92523 -0.64278
252 8D 0 -0.01678 -0.01253 -0.00723 0.01530 -0.00077
253 8D+1 0.01712 0.02444 -0.00496 -0.01494 0.00505
254 8D-1 -0.00988 0.00496 -0.03016 0.00863 -0.00292
255 8D+2 -0.01882 -0.01052 -0.00668 -0.00721 0.01746
256 8D-2 0.03260 0.01882 0.01052 0.01249 -0.03024
257 9D 0 0.11602 0.13389 0.07730 -0.17973 0.04987
258 9D+1 -0.14159 -0.22400 0.02811 0.21902 -0.12355
259 9D-1 0.08174 -0.02811 0.25646 -0.12645 0.07133
260 9D+2 0.18687 0.07207 0.03711 0.12765 -0.21665
261 9D-2 -0.32366 -0.12033 -0.07207 -0.22110 0.37526
262 10F 0 -0.00554 -0.00146 -0.00084 -0.00130 0.00162
263 10F+1 -0.01303 0.00358 -0.00334 0.00100 0.00371
264 10F-1 0.00752 0.00334 -0.00743 -0.00058 -0.00214
265 10F+2 0.00140 0.00270 -0.00125 0.00741 -0.00679
266 10F-2 -0.00243 -0.00187 -0.00270 -0.01284 0.01177
267 10F+3 0.00000 -0.00150 0.00261 0.00000 0.00000
268 10F-3 0.00114 -0.00240 -0.00139 -0.01167 0.00436
269 8 H 1S -0.00510 -0.00261 0.00151 -0.01448 0.01262
270 2S 0.14825 -0.01920 0.01109 0.01369 -0.07010
271 3S 0.75549 1.39350 -0.80454 4.17414 -4.40354
272 4S 0.30509 0.34579 -0.19964 0.74912 -0.86686
273 5PX -0.01728 0.01575 -0.04852 0.00323 0.00937
274 5PY -0.00998 0.04852 0.04028 0.00186 0.00541
275 5PZ -0.02661 0.02733 -0.01578 0.02135 0.01697
276 6PX 0.16638 -0.15052 0.40570 0.02655 -0.11929
277 6PY 0.09606 -0.40570 -0.31794 0.01533 -0.06887
278 6PZ 0.21414 -0.22006 0.12705 -0.19285 -0.12113
279 7PX -0.56207 -0.26892 -0.22458 -1.53637 1.62381
280 7PY -0.32451 0.22458 0.52825 -0.88703 0.93751
281 7PZ -0.21474 0.54430 -0.31425 0.92523 -0.64278
282 8D 0 -0.01678 0.01253 -0.00723 0.01530 -0.00077
283 8D+1 -0.01712 0.02444 0.00496 0.01494 -0.00505
284 8D-1 -0.00988 -0.00496 -0.03016 0.00863 -0.00292
285 8D+2 -0.01882 0.01052 -0.00668 -0.00721 0.01746
286 8D-2 -0.03260 0.01882 -0.01052 -0.01249 0.03024
287 9D 0 0.11602 -0.13389 0.07730 -0.17973 0.04987
288 9D+1 0.14159 -0.22400 -0.02811 -0.21902 0.12355
289 9D-1 0.08174 0.02811 0.25646 -0.12645 0.07133
290 9D+2 0.18687 -0.07207 0.03711 0.12765 -0.21665
291 9D-2 0.32366 -0.12033 0.07207 0.22110 -0.37526
292 10F 0 -0.00554 0.00146 -0.00084 -0.00130 0.00162
293 10F+1 0.01303 0.00358 0.00334 -0.00100 -0.00371
294 10F-1 0.00752 -0.00334 -0.00743 -0.00058 -0.00214
295 10F+2 0.00140 -0.00270 -0.00125 0.00741 -0.00679
296 10F-2 0.00243 -0.00187 0.00270 0.01284 -0.01177
297 10F+3 0.00000 -0.00150 -0.00261 0.00000 0.00000
298 10F-3 0.00114 0.00240 -0.00139 -0.01167 0.00436
151 152 153 154 155
(EU)--V (EU)--V (A1U)--V (EG)--V (EG)--V
Eigenvalues -- 2.74632 2.74632 2.81089 2.84472 2.84472
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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 0.00513 0.00000 0.00000 -0.01836 0.00000
8 7PY 0.00000 0.00513 0.00000 0.00000 -0.01836
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00460 0.00000 0.00000 0.01638 0.00000
11 8PY 0.00000 0.00460 0.00000 0.00000 0.01638
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX -0.00509 0.00000 0.00000 0.19743 0.00000
14 9PY 0.00000 -0.00509 0.00000 0.00000 0.19743
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX -0.74536 0.00000 0.00000 -0.35421 0.00000
17 10PY 0.00000 -0.74536 0.00000 0.00000 -0.35421
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX -0.34117 0.00000 0.00000 -0.31752 0.00000
20 11PY 0.00000 -0.34117 0.00000 0.00000 -0.31752
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
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23 12D+1 0.16444 0.00000 0.00000 0.82641 0.00000
24 12D-1 0.00000 0.16444 0.00000 0.00000 0.82641
25 12D+2 0.00000 1.25461 0.00000 0.00000 -0.13770
26 12D-2 1.25461 0.00000 0.00000 -0.13770 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 -0.33339 0.00000 0.00000 0.17307 0.00000
29 13D-1 0.00000 -0.33339 0.00000 0.00000 0.17307
30 13D+2 0.00000 0.07867 0.00000 0.00000 -0.36696
31 13D-2 0.07867 0.00000 0.00000 -0.36696 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.14422 0.00000 0.00000 0.10593 0.00000
34 14D-1 0.00000 0.14422 0.00000 0.00000 0.10593
35 14D+2 0.00000 0.10851 0.00000 0.00000 0.00919
36 14D-2 0.10851 0.00000 0.00000 0.00919 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.17030 0.00000 0.00000 -0.03681 0.00000
39 15F-1 0.00000 0.17030 0.00000 0.00000 -0.03681
40 15F+2 0.00000 -0.32486 0.00000 0.00000 -0.43619
41 15F-2 -0.32486 0.00000 0.00000 -0.43619 0.00000
42 15F+3 0.00000 0.00000 0.22635 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
45 16F+1 -0.02638 0.00000 0.00000 0.20862 0.00000
46 16F-1 0.00000 -0.02638 0.00000 0.00000 0.20862
47 16F+2 0.00000 0.15030 0.00000 0.00000 0.06890
48 16F-2 0.15030 0.00000 0.00000 0.06890 0.00000
49 16F+3 0.00000 0.00000 0.27625 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.25291 0.00000 0.00000 -0.19336 0.00000
53 17G-1 0.00000 0.25291 0.00000 0.00000 -0.19336
54 17G+2 0.00000 -0.22324 0.00000 0.00000 0.03878
55 17G-2 -0.22324 0.00000 0.00000 0.03878 0.00000
56 17G+3 0.00000 0.00000 -0.22522 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.11712 0.00000 0.00000 0.22103
59 17G-4 -0.11712 0.00000 0.00000 -0.22103 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00000
61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
62 3S 0.00000 0.00000 0.00000 0.00000 0.00000
63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
64 5S 0.00000 0.00000 0.00000 0.00000 0.00000
65 6S 0.00000 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00513 0.00000 0.00000 0.01836 0.00000
67 7PY 0.00000 0.00513 0.00000 0.00000 0.01836
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00460 0.00000 0.00000 -0.01638 0.00000
70 8PY 0.00000 0.00460 0.00000 0.00000 -0.01638
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
72 9PX -0.00509 0.00000 0.00000 -0.19743 0.00000
73 9PY 0.00000 -0.00509 0.00000 0.00000 -0.19743
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
75 10PX -0.74536 0.00000 0.00000 0.35421 0.00000
76 10PY 0.00000 -0.74536 0.00000 0.00000 0.35421
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
78 11PX -0.34117 0.00000 0.00000 0.31752 0.00000
79 11PY 0.00000 -0.34117 0.00000 0.00000 0.31752
80 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 12D+1 -0.16444 0.00000 0.00000 0.82641 0.00000
83 12D-1 0.00000 -0.16444 0.00000 0.00000 0.82641
84 12D+2 0.00000 -1.25461 0.00000 0.00000 -0.13770
85 12D-2 -1.25461 0.00000 0.00000 -0.13770 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.33339 0.00000 0.00000 0.17307 0.00000
88 13D-1 0.00000 0.33339 0.00000 0.00000 0.17307
89 13D+2 0.00000 -0.07867 0.00000 0.00000 -0.36696
90 13D-2 -0.07867 0.00000 0.00000 -0.36696 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
92 14D+1 -0.14422 0.00000 0.00000 0.10593 0.00000
93 14D-1 0.00000 -0.14422 0.00000 0.00000 0.10593
94 14D+2 0.00000 -0.10851 0.00000 0.00000 0.00919
95 14D-2 -0.10851 0.00000 0.00000 0.00919 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.17030 0.00000 0.00000 0.03681 0.00000
98 15F-1 0.00000 0.17030 0.00000 0.00000 0.03681
99 15F+2 0.00000 -0.32486 0.00000 0.00000 0.43619
100 15F-2 -0.32486 0.00000 0.00000 0.43619 0.00000
101 15F+3 0.00000 0.00000 0.22635 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 -0.02638 0.00000 0.00000 -0.20862 0.00000
105 16F-1 0.00000 -0.02638 0.00000 0.00000 -0.20862
106 16F+2 0.00000 0.15030 0.00000 0.00000 -0.06890
107 16F-2 0.15030 0.00000 0.00000 -0.06890 0.00000
108 16F+3 0.00000 0.00000 0.27625 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
111 17G+1 -0.25291 0.00000 0.00000 -0.19336 0.00000
112 17G-1 0.00000 -0.25291 0.00000 0.00000 -0.19336
113 17G+2 0.00000 0.22324 0.00000 0.00000 0.03878
114 17G-2 0.22324 0.00000 0.00000 0.03878 0.00000
115 17G+3 0.00000 0.00000 0.22522 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 -0.11712 0.00000 0.00000 0.22103
118 17G-4 0.11712 0.00000 0.00000 -0.22103 0.00000
119 3 H 1S 0.00000 -0.00708 0.00000 0.00000 0.00771
120 2S 0.00000 -0.13606 0.00000 0.00000 -0.20866
121 3S 0.00000 0.96282 0.00000 0.00000 -0.37939
122 4S 0.00000 0.62577 0.00000 0.00000 0.00750
123 5PX -0.08699 0.00000 0.06111 0.06092 0.00000
124 5PY 0.00000 0.02272 0.00000 0.00000 0.01481
125 5PZ 0.00000 -0.05594 0.00000 0.00000 -0.08496
126 6PX 0.71198 0.00000 -0.49192 -0.46316 0.00000
127 6PY 0.00000 -0.17154 0.00000 0.00000 -0.12377
128 6PZ 0.00000 0.46802 0.00000 0.00000 0.68735
129 7PX -0.77718 0.00000 0.57093 0.52327 0.00000
130 7PY 0.00000 -0.05621 0.00000 0.00000 0.36362
131 7PZ 0.00000 -0.80602 0.00000 0.00000 -0.82555
132 8D 0 0.00000 0.00790 0.00000 0.00000 -0.02768
133 8D+1 -0.04248 0.00000 0.03177 0.01120 0.00000
134 8D-1 0.00000 -0.01048 0.00000 0.00000 -0.02699
135 8D+2 0.00000 -0.01368 0.00000 0.00000 -0.02488
136 8D-2 -0.00012 0.00000 0.03451 0.02496 0.00000
137 9D 0 0.00000 -0.06452 0.00000 0.00000 0.27737
138 9D+1 0.36825 0.00000 -0.27638 -0.09816 0.00000
139 9D-1 0.00000 0.09623 0.00000 0.00000 0.22209
140 9D+2 0.00000 0.09275 0.00000 0.00000 0.26131
141 9D-2 -0.03260 0.00000 -0.32520 -0.23643 0.00000
142 10F 0 0.00000 0.00446 0.00000 0.00000 -0.00466
143 10F+1 0.00362 0.00000 -0.00394 0.00234 0.00000
144 10F-1 0.00000 -0.00453 0.00000 0.00000 0.00646
145 10F+2 0.00000 0.00239 0.00000 0.00000 0.00363
146 10F-2 0.00299 0.00000 -0.00178 -0.01128 0.00000
147 10F+3 0.00111 0.00000 0.00585 0.00369 0.00000
148 10F-3 0.00000 0.00403 0.00000 0.00000 0.00346
149 4 H 1S 0.00613 0.00354 0.00000 -0.00668 -0.00385
150 2S 0.11784 0.06803 0.00000 0.18071 0.10433
151 3S -0.83383 -0.48141 0.00000 0.32856 0.18969
152 4S -0.54193 -0.31288 0.00000 -0.00649 -0.00375
153 5PX -0.00470 0.04751 -0.03055 0.02634 -0.01996
154 5PY 0.04751 -0.05956 0.05292 -0.01996 0.04939
155 5PZ 0.04845 0.02797 0.00000 0.07358 0.04248
156 6PX 0.04934 -0.38258 0.24596 -0.20862 0.14696
157 6PY -0.38258 0.49110 -0.42602 0.14696 -0.37832
158 6PZ -0.40532 -0.23401 0.00000 -0.59526 -0.34367
159 7PX -0.23645 0.31219 -0.28546 0.40353 -0.06913
160 7PY 0.31219 -0.59694 0.49444 -0.06913 0.48336
161 7PZ 0.69803 0.40301 0.00000 0.71495 0.41278
162 8D 0 -0.00684 -0.00395 0.00000 0.02397 0.01384
163 8D+1 -0.01848 0.01386 -0.01589 -0.01745 -0.01654
164 8D-1 0.01386 -0.03448 0.02752 -0.01654 0.00165
165 8D+2 -0.00587 -0.00351 0.02989 -0.02158 0.01250
166 8D-2 -0.01029 -0.00587 -0.01726 -0.01242 -0.02158
167 9D 0 0.05588 0.03226 0.00000 -0.24021 -0.13868
168 9D+1 0.16424 -0.11779 0.13819 0.14203 0.13867
169 9D-1 -0.11779 0.30024 -0.23935 0.13867 -0.01810
170 9D+2 0.05428 -0.00126 -0.28163 0.21553 -0.11200
171 9D-2 0.06141 0.05428 0.16260 0.13687 0.21553
172 10F 0 -0.00386 -0.00223 0.00000 0.00404 0.00233
173 10F+1 -0.00250 -0.00353 0.00197 0.00543 0.00178
174 10F-1 -0.00353 0.00158 -0.00341 0.00178 0.00337
175 10F+2 -0.00026 0.00284 -0.00154 0.00646 -0.00755
176 10F-2 0.00254 -0.00026 0.00089 -0.00009 0.00646
177 10F+3 -0.00055 0.00096 0.00585 -0.00185 0.00320
178 10F-3 -0.00349 -0.00202 0.00000 -0.00299 -0.00173
179 5 H 1S -0.00613 0.00354 0.00000 0.00668 -0.00385
180 2S -0.11784 0.06803 0.00000 -0.18071 0.10433
181 3S 0.83383 -0.48141 0.00000 -0.32856 0.18969
182 4S 0.54193 -0.31288 0.00000 0.00649 -0.00375
183 5PX -0.00470 -0.04751 -0.03055 0.02634 0.01996
184 5PY -0.04751 -0.05956 -0.05292 0.01996 0.04939
185 5PZ -0.04845 0.02797 0.00000 -0.07358 0.04248
186 6PX 0.04934 0.38258 0.24596 -0.20862 -0.14696
187 6PY 0.38258 0.49110 0.42602 -0.14696 -0.37832
188 6PZ 0.40532 -0.23401 0.00000 0.59526 -0.34367
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190 7PY -0.31219 -0.59694 -0.49444 0.06913 0.48336
191 7PZ -0.69803 0.40301 0.00000 -0.71495 0.41278
192 8D 0 0.00684 -0.00395 0.00000 -0.02397 0.01384
193 8D+1 -0.01848 -0.01386 -0.01589 -0.01745 0.01654
194 8D-1 -0.01386 -0.03448 -0.02752 0.01654 0.00165
195 8D+2 0.00587 -0.00351 -0.02989 0.02158 0.01250
196 8D-2 -0.01029 0.00587 -0.01726 -0.01242 0.02158
197 9D 0 -0.05588 0.03226 0.00000 0.24021 -0.13868
198 9D+1 0.16424 0.11779 0.13819 0.14203 -0.13867
199 9D-1 0.11779 0.30024 0.23935 -0.13867 -0.01810
200 9D+2 -0.05428 -0.00126 0.28163 -0.21553 -0.11200
201 9D-2 0.06141 -0.05428 0.16260 0.13687 -0.21553
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203 10F+1 -0.00250 0.00353 0.00197 0.00543 -0.00178
204 10F-1 0.00353 0.00158 0.00341 -0.00178 0.00337
205 10F+2 0.00026 0.00284 0.00154 -0.00646 -0.00755
206 10F-2 0.00254 0.00026 0.00089 -0.00009 -0.00646
207 10F+3 -0.00055 -0.00096 0.00585 -0.00185 -0.00320
208 10F-3 0.00349 -0.00202 0.00000 0.00299 -0.00173
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210 2S 0.00000 0.13606 0.00000 0.00000 -0.20866
211 3S 0.00000 -0.96282 0.00000 0.00000 -0.37939
212 4S 0.00000 -0.62577 0.00000 0.00000 0.00750
213 5PX -0.08699 0.00000 0.06111 -0.06092 0.00000
214 5PY 0.00000 0.02272 0.00000 0.00000 -0.01481
215 5PZ 0.00000 -0.05594 0.00000 0.00000 0.08496
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218 6PZ 0.00000 0.46802 0.00000 0.00000 -0.68735
219 7PX -0.77718 0.00000 0.57093 -0.52327 0.00000
220 7PY 0.00000 -0.05621 0.00000 0.00000 -0.36362
221 7PZ 0.00000 -0.80602 0.00000 0.00000 0.82555
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224 8D-1 0.00000 0.01048 0.00000 0.00000 -0.02699
225 8D+2 0.00000 0.01368 0.00000 0.00000 -0.02488
226 8D-2 0.00012 0.00000 -0.03451 0.02496 0.00000
227 9D 0 0.00000 0.06452 0.00000 0.00000 0.27737
228 9D+1 -0.36825 0.00000 0.27638 -0.09816 0.00000
229 9D-1 0.00000 -0.09623 0.00000 0.00000 0.22209
230 9D+2 0.00000 -0.09275 0.00000 0.00000 0.26131
231 9D-2 0.03260 0.00000 0.32520 -0.23643 0.00000
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233 10F+1 0.00362 0.00000 -0.00394 -0.00234 0.00000
234 10F-1 0.00000 -0.00453 0.00000 0.00000 -0.00646
235 10F+2 0.00000 0.00239 0.00000 0.00000 -0.00363
236 10F-2 0.00299 0.00000 -0.00178 0.01128 0.00000
237 10F+3 0.00111 0.00000 0.00585 -0.00369 0.00000
238 10F-3 0.00000 0.00403 0.00000 0.00000 -0.00346
239 7 H 1S 0.00613 -0.00354 0.00000 0.00668 -0.00385
240 2S 0.11784 -0.06803 0.00000 -0.18071 0.10433
241 3S -0.83383 0.48141 0.00000 -0.32856 0.18969
242 4S -0.54193 0.31288 0.00000 0.00649 -0.00375
243 5PX -0.00470 -0.04751 -0.03055 -0.02634 -0.01996
244 5PY -0.04751 -0.05956 -0.05292 -0.01996 -0.04939
245 5PZ -0.04845 0.02797 0.00000 0.07358 -0.04248
246 6PX 0.04934 0.38258 0.24596 0.20862 0.14696
247 6PY 0.38258 0.49110 0.42602 0.14696 0.37832
248 6PZ 0.40532 -0.23401 0.00000 -0.59526 0.34367
249 7PX -0.23645 -0.31219 -0.28546 -0.40353 -0.06913
250 7PY -0.31219 -0.59694 -0.49444 -0.06913 -0.48336
251 7PZ -0.69803 0.40301 0.00000 0.71495 -0.41278
252 8D 0 -0.00684 0.00395 0.00000 -0.02397 0.01384
253 8D+1 0.01848 0.01386 0.01589 -0.01745 0.01654
254 8D-1 0.01386 0.03448 0.02752 0.01654 0.00165
255 8D+2 -0.00587 0.00351 0.02989 0.02158 0.01250
256 8D-2 0.01029 -0.00587 0.01726 -0.01242 0.02158
257 9D 0 0.05588 -0.03226 0.00000 0.24021 -0.13868
258 9D+1 -0.16424 -0.11779 -0.13819 0.14203 -0.13867
259 9D-1 -0.11779 -0.30024 -0.23935 -0.13867 -0.01810
260 9D+2 0.05428 0.00126 -0.28163 -0.21553 -0.11200
261 9D-2 -0.06141 0.05428 -0.16260 0.13687 -0.21553
262 10F 0 0.00386 -0.00223 0.00000 0.00404 -0.00233
263 10F+1 -0.00250 0.00353 0.00197 -0.00543 0.00178
264 10F-1 0.00353 0.00158 0.00341 0.00178 -0.00337
265 10F+2 0.00026 0.00284 0.00154 0.00646 0.00755
266 10F-2 0.00254 0.00026 0.00089 0.00009 0.00646
267 10F+3 -0.00055 -0.00096 0.00585 0.00185 0.00320
268 10F-3 0.00349 -0.00202 0.00000 -0.00299 0.00173
269 8 H 1S -0.00613 -0.00354 0.00000 -0.00668 -0.00385
270 2S -0.11784 -0.06803 0.00000 0.18071 0.10433
271 3S 0.83383 0.48141 0.00000 0.32856 0.18969
272 4S 0.54193 0.31288 0.00000 -0.00649 -0.00375
273 5PX -0.00470 0.04751 -0.03055 -0.02634 0.01996
274 5PY 0.04751 -0.05956 0.05292 0.01996 -0.04939
275 5PZ 0.04845 0.02797 0.00000 -0.07358 -0.04248
276 6PX 0.04934 -0.38258 0.24596 0.20862 -0.14696
277 6PY -0.38258 0.49110 -0.42602 -0.14696 0.37832
278 6PZ -0.40532 -0.23401 0.00000 0.59526 0.34367
279 7PX -0.23645 0.31219 -0.28546 -0.40353 0.06913
280 7PY 0.31219 -0.59694 0.49444 0.06913 -0.48336
281 7PZ 0.69803 0.40301 0.00000 -0.71495 -0.41278
282 8D 0 0.00684 0.00395 0.00000 0.02397 0.01384
283 8D+1 0.01848 -0.01386 0.01589 -0.01745 -0.01654
284 8D-1 -0.01386 0.03448 -0.02752 -0.01654 0.00165
285 8D+2 0.00587 0.00351 -0.02989 -0.02158 0.01250
286 8D-2 0.01029 0.00587 0.01726 -0.01242 -0.02158
287 9D 0 -0.05588 -0.03226 0.00000 -0.24021 -0.13868
288 9D+1 -0.16424 0.11779 -0.13819 0.14203 0.13867
289 9D-1 0.11779 -0.30024 0.23935 0.13867 -0.01810
290 9D+2 -0.05428 0.00126 0.28163 0.21553 -0.11200
291 9D-2 -0.06141 -0.05428 -0.16260 0.13687 0.21553
292 10F 0 -0.00386 -0.00223 0.00000 -0.00404 -0.00233
293 10F+1 -0.00250 -0.00353 0.00197 -0.00543 -0.00178
294 10F-1 -0.00353 0.00158 -0.00341 -0.00178 -0.00337
295 10F+2 -0.00026 0.00284 -0.00154 -0.00646 0.00755
296 10F-2 0.00254 -0.00026 0.00089 0.00009 -0.00646
297 10F+3 -0.00055 0.00096 0.00585 0.00185 -0.00320
298 10F-3 -0.00349 -0.00202 0.00000 0.00299 0.00173
156 157 158 159 160
(EU)--V (EU)--V (A1G)--V (EU)--V (EU)--V
Eigenvalues -- 2.85481 2.85481 2.87205 2.97013 2.97013
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2 2S 0.00000 0.00000 -0.01899 0.00000 0.00000
3 3S 0.00000 0.00000 -0.11067 0.00000 0.00000
4 4S 0.00000 0.00000 -2.82347 0.00000 0.00000
5 5S 0.00000 0.00000 8.26462 0.00000 0.00000
6 6S 0.00000 0.00000 0.13353 0.00000 0.00000
7 7PX 0.00000 -0.05877 0.00000 0.00000 -0.00103
8 7PY 0.05877 0.00000 0.00000 0.00103 0.00000
9 7PZ 0.00000 0.00000 0.00681 0.00000 0.00000
10 8PX 0.00000 -0.07014 0.00000 0.00000 -0.03464
11 8PY 0.07014 0.00000 0.00000 0.03464 0.00000
12 8PZ 0.00000 0.00000 -0.07487 0.00000 0.00000
13 9PX 0.00000 0.42939 0.00000 0.00000 0.03844
14 9PY -0.42939 0.00000 0.00000 -0.03844 0.00000
15 9PZ 0.00000 0.00000 -0.36946 0.00000 0.00000
16 10PX 0.00000 1.23409 0.00000 0.00000 1.31174
17 10PY -1.23409 0.00000 0.00000 -1.31174 0.00000
18 10PZ 0.00000 0.00000 2.41892 0.00000 0.00000
19 11PX 0.00000 0.06617 0.00000 0.00000 0.32045
20 11PY -0.06617 0.00000 0.00000 -0.32045 0.00000
21 11PZ 0.00000 0.00000 0.25998 0.00000 0.00000
22 12D 0 0.00000 0.00000 -0.77610 0.00000 0.00000
23 12D+1 0.00000 0.31635 0.00000 0.00000 0.69586
24 12D-1 -0.31635 0.00000 0.00000 -0.69586 0.00000
25 12D+2 0.00249 0.00000 0.00000 0.98710 0.00000
26 12D-2 0.00000 -0.00249 0.00000 0.00000 -0.98710
27 13D 0 0.00000 0.00000 -1.22470 0.00000 0.00000
28 13D+1 0.00000 0.96475 0.00000 0.00000 0.11587
29 13D-1 -0.96475 0.00000 0.00000 -0.11587 0.00000
30 13D+2 0.79088 0.00000 0.00000 0.42672 0.00000
31 13D-2 0.00000 -0.79088 0.00000 0.00000 -0.42672
32 14D 0 0.00000 0.00000 0.80264 0.00000 0.00000
33 14D+1 0.00000 -0.11482 0.00000 0.00000 0.06668
34 14D-1 0.11482 0.00000 0.00000 -0.06668 0.00000
35 14D+2 -0.05270 0.00000 0.00000 0.03066 0.00000
36 14D-2 0.00000 0.05270 0.00000 0.00000 -0.03066
37 15F 0 0.00000 0.00000 -0.03374 0.00000 0.00000
38 15F+1 0.00000 0.61241 0.00000 0.00000 -0.24188
39 15F-1 -0.61241 0.00000 0.00000 0.24188 0.00000
40 15F+2 1.30152 0.00000 0.00000 0.82930 0.00000
41 15F-2 0.00000 -1.30152 0.00000 0.00000 -0.82930
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 -1.03189 0.00000 0.00000
44 16F 0 0.00000 0.00000 -0.23921 0.00000 0.00000
45 16F+1 0.00000 -0.42779 0.00000 0.00000 0.49581
46 16F-1 0.42779 0.00000 0.00000 -0.49581 0.00000
47 16F+2 -0.21049 0.00000 0.00000 -0.00786 0.00000
48 16F-2 0.00000 0.21049 0.00000 0.00000 0.00786
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 -0.01478 0.00000 0.00000
51 17G 0 0.00000 0.00000 -0.07197 0.00000 0.00000
52 17G+1 0.00000 -0.51115 0.00000 0.00000 0.20227
53 17G-1 0.51115 0.00000 0.00000 -0.20227 0.00000
54 17G+2 0.23079 0.00000 0.00000 -0.13352 0.00000
55 17G-2 0.00000 -0.23079 0.00000 0.00000 0.13352
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.23713 0.00000 0.00000
58 17G+4 0.13845 0.00000 0.00000 -0.10833 0.00000
59 17G-4 0.00000 0.13845 0.00000 0.00000 -0.10833
60 2 Si 1S 0.00000 0.00000 -0.00654 0.00000 0.00000
61 2S 0.00000 0.00000 -0.01899 0.00000 0.00000
62 3S 0.00000 0.00000 -0.11067 0.00000 0.00000
63 4S 0.00000 0.00000 -2.82347 0.00000 0.00000
64 5S 0.00000 0.00000 8.26462 0.00000 0.00000
65 6S 0.00000 0.00000 0.13353 0.00000 0.00000
66 7PX 0.00000 -0.05877 0.00000 0.00000 -0.00103
67 7PY 0.05877 0.00000 0.00000 0.00103 0.00000
68 7PZ 0.00000 0.00000 -0.00681 0.00000 0.00000
69 8PX 0.00000 -0.07014 0.00000 0.00000 -0.03464
70 8PY 0.07014 0.00000 0.00000 0.03464 0.00000
71 8PZ 0.00000 0.00000 0.07487 0.00000 0.00000
72 9PX 0.00000 0.42939 0.00000 0.00000 0.03844
73 9PY -0.42939 0.00000 0.00000 -0.03844 0.00000
74 9PZ 0.00000 0.00000 0.36946 0.00000 0.00000
75 10PX 0.00000 1.23409 0.00000 0.00000 1.31174
76 10PY -1.23409 0.00000 0.00000 -1.31174 0.00000
77 10PZ 0.00000 0.00000 -2.41892 0.00000 0.00000
78 11PX 0.00000 0.06617 0.00000 0.00000 0.32045
79 11PY -0.06617 0.00000 0.00000 -0.32045 0.00000
80 11PZ 0.00000 0.00000 -0.25998 0.00000 0.00000
81 12D 0 0.00000 0.00000 -0.77610 0.00000 0.00000
82 12D+1 0.00000 -0.31635 0.00000 0.00000 -0.69586
83 12D-1 0.31635 0.00000 0.00000 0.69586 0.00000
84 12D+2 -0.00249 0.00000 0.00000 -0.98710 0.00000
85 12D-2 0.00000 0.00249 0.00000 0.00000 0.98710
86 13D 0 0.00000 0.00000 -1.22470 0.00000 0.00000
87 13D+1 0.00000 -0.96475 0.00000 0.00000 -0.11587
88 13D-1 0.96475 0.00000 0.00000 0.11587 0.00000
89 13D+2 -0.79088 0.00000 0.00000 -0.42672 0.00000
90 13D-2 0.00000 0.79088 0.00000 0.00000 0.42672
91 14D 0 0.00000 0.00000 0.80264 0.00000 0.00000
92 14D+1 0.00000 0.11482 0.00000 0.00000 -0.06668
93 14D-1 -0.11482 0.00000 0.00000 0.06668 0.00000
94 14D+2 0.05270 0.00000 0.00000 -0.03066 0.00000
95 14D-2 0.00000 -0.05270 0.00000 0.00000 0.03066
96 15F 0 0.00000 0.00000 0.03374 0.00000 0.00000
97 15F+1 0.00000 0.61241 0.00000 0.00000 -0.24188
98 15F-1 -0.61241 0.00000 0.00000 0.24188 0.00000
99 15F+2 1.30152 0.00000 0.00000 0.82930 0.00000
100 15F-2 0.00000 -1.30152 0.00000 0.00000 -0.82930
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 1.03189 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.23921 0.00000 0.00000
104 16F+1 0.00000 -0.42779 0.00000 0.00000 0.49581
105 16F-1 0.42779 0.00000 0.00000 -0.49581 0.00000
106 16F+2 -0.21049 0.00000 0.00000 -0.00786 0.00000
107 16F-2 0.00000 0.21049 0.00000 0.00000 0.00786
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.01478 0.00000 0.00000
110 17G 0 0.00000 0.00000 -0.07197 0.00000 0.00000
111 17G+1 0.00000 0.51115 0.00000 0.00000 -0.20227
112 17G-1 -0.51115 0.00000 0.00000 0.20227 0.00000
113 17G+2 -0.23079 0.00000 0.00000 0.13352 0.00000
114 17G-2 0.00000 0.23079 0.00000 0.00000 -0.13352
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.23713 0.00000 0.00000
117 17G+4 -0.13845 0.00000 0.00000 0.10833 0.00000
118 17G-4 0.00000 -0.13845 0.00000 0.00000 0.10833
119 3 H 1S -0.01221 0.00000 -0.00252 -0.00467 0.00000
120 2S 0.12998 0.00000 0.36802 -0.18358 0.00000
121 3S 1.64157 0.00000 -2.93920 1.76050 0.00000
122 4S 0.43018 0.00000 -0.17062 0.70652 0.00000
123 5PX 0.00000 0.00893 0.00000 0.00000 0.05391
124 5PY -0.02658 0.00000 0.02091 -0.04039 0.00000
125 5PZ -0.00463 0.00000 -0.05426 0.03678 0.00000
126 6PX 0.00000 -0.06176 0.00000 0.00000 -0.45429
127 6PY 0.28232 0.00000 -0.17141 0.36657 0.00000
128 6PZ 0.04905 0.00000 0.44093 -0.31106 0.00000
129 7PX 0.00000 0.35494 0.00000 0.00000 0.82862
130 7PY -1.32564 0.00000 1.12838 -0.85466 0.00000
131 7PZ 0.33515 0.00000 0.10776 0.35751 0.00000
132 8D 0 0.03632 0.00000 -0.00262 0.02093 0.00000
133 8D+1 0.00000 -0.02123 0.00000 0.00000 0.00571
134 8D-1 -0.01764 0.00000 -0.01608 0.02772 0.00000
135 8D+2 0.01397 0.00000 -0.00340 0.03756 0.00000
136 8D-2 0.00000 0.02470 0.00000 0.00000 0.03813
137 9D 0 -0.36712 0.00000 0.01816 -0.22810 0.00000
138 9D+1 0.00000 0.20055 0.00000 0.00000 -0.04061
139 9D-1 0.14672 0.00000 0.10539 -0.25595 0.00000
140 9D+2 -0.23520 0.00000 0.06042 -0.33472 0.00000
141 9D-2 0.00000 -0.26908 0.00000 0.00000 -0.39356
142 10F 0 -0.00441 0.00000 -0.01320 0.00298 0.00000
143 10F+1 0.00000 -0.00497 0.00000 0.00000 0.01054
144 10F-1 0.01121 0.00000 0.00763 -0.00157 0.00000
145 10F+2 -0.00684 0.00000 -0.01014 0.00402 0.00000
146 10F-2 0.00000 0.00635 0.00000 0.00000 -0.00987
147 10F+3 0.00000 0.00232 0.00000 0.00000 -0.00301
148 10F-3 0.01035 0.00000 -0.00537 -0.00983 0.00000
149 4 H 1S 0.00610 -0.01057 -0.00252 0.00233 -0.00404
150 2S -0.06499 0.11257 0.36802 0.09179 -0.15898
151 3S -0.82078 1.42164 -2.93920 -0.88025 1.52464
152 4S -0.21509 0.37255 -0.17062 -0.35326 0.61187
153 5PX -0.00765 0.02217 -0.01811 0.00585 0.04377
154 5PY -0.01334 0.00765 -0.01045 -0.05053 -0.00585
155 5PZ 0.00231 -0.00401 -0.05426 -0.01839 0.03185
156 6PX 0.09550 -0.22718 0.14845 -0.03799 -0.38850
157 6PY 0.11690 -0.09550 0.08571 0.43236 0.03799
158 6PZ -0.02452 0.04247 0.44093 0.15553 -0.26938
159 7PX -0.42033 1.08296 -0.97720 -0.01128 0.84815
160 7PY -0.59761 0.42033 -0.56419 -0.83513 0.01128
161 7PZ -0.16757 0.29025 0.10776 -0.17876 0.30962
162 8D 0 -0.01816 0.03145 -0.00262 -0.01047 0.01813
163 8D+1 -0.01683 0.00793 0.01392 0.01447 -0.01936
164 8D-1 0.01151 0.01683 0.00804 0.00265 -0.01447
165 8D+2 -0.01503 -0.01674 0.00170 -0.01921 -0.03277
166 8D-2 0.01674 -0.00430 0.00294 0.03277 -0.01864
167 9D 0 0.18356 -0.31793 0.01816 0.11405 -0.19754
168 9D+1 0.15037 -0.05991 -0.09127 -0.12841 0.18181
169 9D-1 -0.11373 -0.15037 -0.05270 -0.03353 0.12841
170 9D+2 0.14301 0.21836 -0.03021 0.21149 0.31535
171 9D-2 -0.21836 0.10913 -0.05233 -0.31535 0.15265
172 10F 0 0.00220 -0.00382 -0.01320 -0.00149 0.00258
173 10F+1 0.00270 -0.00965 -0.00660 0.00389 0.00381
174 10F-1 0.00653 -0.00270 -0.00381 -0.00830 -0.00389
175 10F+2 -0.00648 0.00021 0.00507 0.00841 0.00253
176 10F-2 -0.00021 0.00672 0.00878 -0.00253 -0.00548
177 10F+3 -0.00201 -0.00116 0.00000 0.00261 0.00150
178 10F-3 -0.00517 0.00896 -0.00537 0.00491 -0.00851
179 5 H 1S 0.00610 0.01057 -0.00252 0.00233 0.00404
180 2S -0.06499 -0.11257 0.36802 0.09179 0.15898
181 3S -0.82078 -1.42164 -2.93920 -0.88025 -1.52464
182 4S -0.21509 -0.37255 -0.17062 -0.35326 -0.61187
183 5PX 0.00765 0.02217 0.01811 -0.00585 0.04377
184 5PY -0.01334 -0.00765 -0.01045 -0.05053 0.00585
185 5PZ 0.00231 0.00401 -0.05426 -0.01839 -0.03185
186 6PX -0.09550 -0.22718 -0.14845 0.03799 -0.38850
187 6PY 0.11690 0.09550 0.08571 0.43236 -0.03799
188 6PZ -0.02452 -0.04247 0.44093 0.15553 0.26938
189 7PX 0.42033 1.08296 0.97720 0.01128 0.84815
190 7PY -0.59761 -0.42033 -0.56419 -0.83513 -0.01128
191 7PZ -0.16757 -0.29025 0.10776 -0.17876 -0.30962
192 8D 0 -0.01816 -0.03145 -0.00262 -0.01047 -0.01813
193 8D+1 0.01683 0.00793 -0.01392 -0.01447 -0.01936
194 8D-1 0.01151 -0.01683 0.00804 0.00265 0.01447
195 8D+2 -0.01503 0.01674 0.00170 -0.01921 0.03277
196 8D-2 -0.01674 -0.00430 -0.00294 -0.03277 -0.01864
197 9D 0 0.18356 0.31793 0.01816 0.11405 0.19754
198 9D+1 -0.15037 -0.05991 0.09127 0.12841 0.18181
199 9D-1 -0.11373 0.15037 -0.05270 -0.03353 -0.12841
200 9D+2 0.14301 -0.21836 -0.03021 0.21149 -0.31535
201 9D-2 0.21836 0.10913 0.05233 0.31535 0.15265
202 10F 0 0.00220 0.00382 -0.01320 -0.00149 -0.00258
203 10F+1 -0.00270 -0.00965 0.00660 -0.00389 0.00381
204 10F-1 0.00653 0.00270 -0.00381 -0.00830 0.00389
205 10F+2 -0.00648 -0.00021 0.00507 0.00841 -0.00253
206 10F-2 0.00021 0.00672 -0.00878 0.00253 -0.00548
207 10F+3 0.00201 -0.00116 0.00000 -0.00261 0.00150
208 10F-3 -0.00517 -0.00896 -0.00537 0.00491 0.00851
209 6 H 1S 0.01221 0.00000 -0.00252 0.00467 0.00000
210 2S -0.12998 0.00000 0.36802 0.18358 0.00000
211 3S -1.64157 0.00000 -2.93920 -1.76050 0.00000
212 4S -0.43018 0.00000 -0.17062 -0.70652 0.00000
213 5PX 0.00000 0.00893 0.00000 0.00000 0.05391
214 5PY -0.02658 0.00000 -0.02091 -0.04039 0.00000
215 5PZ -0.00463 0.00000 0.05426 0.03678 0.00000
216 6PX 0.00000 -0.06176 0.00000 0.00000 -0.45429
217 6PY 0.28232 0.00000 0.17141 0.36657 0.00000
218 6PZ 0.04905 0.00000 -0.44093 -0.31106 0.00000
219 7PX 0.00000 0.35494 0.00000 0.00000 0.82862
220 7PY -1.32564 0.00000 -1.12838 -0.85466 0.00000
221 7PZ 0.33515 0.00000 -0.10776 0.35751 0.00000
222 8D 0 -0.03632 0.00000 -0.00262 -0.02093 0.00000
223 8D+1 0.00000 0.02123 0.00000 0.00000 -0.00571
224 8D-1 0.01764 0.00000 -0.01608 -0.02772 0.00000
225 8D+2 -0.01397 0.00000 -0.00340 -0.03756 0.00000
226 8D-2 0.00000 -0.02470 0.00000 0.00000 -0.03813
227 9D 0 0.36712 0.00000 0.01816 0.22810 0.00000
228 9D+1 0.00000 -0.20055 0.00000 0.00000 0.04061
229 9D-1 -0.14672 0.00000 0.10539 0.25595 0.00000
230 9D+2 0.23520 0.00000 0.06042 0.33472 0.00000
231 9D-2 0.00000 0.26908 0.00000 0.00000 0.39356
232 10F 0 -0.00441 0.00000 0.01320 0.00298 0.00000
233 10F+1 0.00000 -0.00497 0.00000 0.00000 0.01054
234 10F-1 0.01121 0.00000 -0.00763 -0.00157 0.00000
235 10F+2 -0.00684 0.00000 0.01014 0.00402 0.00000
236 10F-2 0.00000 0.00635 0.00000 0.00000 -0.00987
237 10F+3 0.00000 0.00232 0.00000 0.00000 -0.00301
238 10F-3 0.01035 0.00000 0.00537 -0.00983 0.00000
239 7 H 1S -0.00610 -0.01057 -0.00252 -0.00233 -0.00404
240 2S 0.06499 0.11257 0.36802 -0.09179 -0.15898
241 3S 0.82078 1.42164 -2.93920 0.88025 1.52464
242 4S 0.21509 0.37255 -0.17062 0.35326 0.61187
243 5PX 0.00765 0.02217 -0.01811 -0.00585 0.04377
244 5PY -0.01334 -0.00765 0.01045 -0.05053 0.00585
245 5PZ 0.00231 0.00401 0.05426 -0.01839 -0.03185
246 6PX -0.09550 -0.22718 0.14845 0.03799 -0.38850
247 6PY 0.11690 0.09550 -0.08571 0.43236 -0.03799
248 6PZ -0.02452 -0.04247 -0.44093 0.15553 0.26938
249 7PX 0.42033 1.08296 -0.97720 0.01128 0.84815
250 7PY -0.59761 -0.42033 0.56419 -0.83513 -0.01128
251 7PZ -0.16757 -0.29025 -0.10776 -0.17876 -0.30962
252 8D 0 0.01816 0.03145 -0.00262 0.01047 0.01813
253 8D+1 -0.01683 -0.00793 -0.01392 0.01447 0.01936
254 8D-1 -0.01151 0.01683 0.00804 -0.00265 -0.01447
255 8D+2 0.01503 -0.01674 0.00170 0.01921 -0.03277
256 8D-2 0.01674 0.00430 -0.00294 0.03277 0.01864
257 9D 0 -0.18356 -0.31793 0.01816 -0.11405 -0.19754
258 9D+1 0.15037 0.05991 0.09127 -0.12841 -0.18181
259 9D-1 0.11373 -0.15037 -0.05270 0.03353 0.12841
260 9D+2 -0.14301 0.21836 -0.03021 -0.21149 0.31535
261 9D-2 -0.21836 -0.10913 0.05233 -0.31535 -0.15265
262 10F 0 0.00220 0.00382 0.01320 -0.00149 -0.00258
263 10F+1 -0.00270 -0.00965 -0.00660 -0.00389 0.00381
264 10F-1 0.00653 0.00270 0.00381 -0.00830 0.00389
265 10F+2 -0.00648 -0.00021 -0.00507 0.00841 -0.00253
266 10F-2 0.00021 0.00672 0.00878 0.00253 -0.00548
267 10F+3 0.00201 -0.00116 0.00000 -0.00261 0.00150
268 10F-3 -0.00517 -0.00896 0.00537 0.00491 0.00851
269 8 H 1S -0.00610 0.01057 -0.00252 -0.00233 0.00404
270 2S 0.06499 -0.11257 0.36802 -0.09179 0.15898
271 3S 0.82078 -1.42164 -2.93920 0.88025 -1.52464
272 4S 0.21509 -0.37255 -0.17062 0.35326 -0.61187
273 5PX -0.00765 0.02217 0.01811 0.00585 0.04377
274 5PY -0.01334 0.00765 0.01045 -0.05053 -0.00585
275 5PZ 0.00231 -0.00401 0.05426 -0.01839 0.03185
276 6PX 0.09550 -0.22718 -0.14845 -0.03799 -0.38850
277 6PY 0.11690 -0.09550 -0.08571 0.43236 0.03799
278 6PZ -0.02452 0.04247 -0.44093 0.15553 -0.26938
279 7PX -0.42033 1.08296 0.97720 -0.01128 0.84815
280 7PY -0.59761 0.42033 0.56419 -0.83513 0.01128
281 7PZ -0.16757 0.29025 -0.10776 -0.17876 0.30962
282 8D 0 0.01816 -0.03145 -0.00262 0.01047 -0.01813
283 8D+1 0.01683 -0.00793 0.01392 -0.01447 0.01936
284 8D-1 -0.01151 -0.01683 0.00804 -0.00265 0.01447
285 8D+2 0.01503 0.01674 0.00170 0.01921 0.03277
286 8D-2 -0.01674 0.00430 0.00294 -0.03277 0.01864
287 9D 0 -0.18356 0.31793 0.01816 -0.11405 0.19754
288 9D+1 -0.15037 0.05991 -0.09127 0.12841 -0.18181
289 9D-1 0.11373 0.15037 -0.05270 0.03353 -0.12841
290 9D+2 -0.14301 -0.21836 -0.03021 -0.21149 -0.31535
291 9D-2 0.21836 -0.10913 -0.05233 0.31535 -0.15265
292 10F 0 0.00220 -0.00382 0.01320 -0.00149 0.00258
293 10F+1 0.00270 -0.00965 0.00660 0.00389 0.00381
294 10F-1 0.00653 -0.00270 0.00381 -0.00830 -0.00389
295 10F+2 -0.00648 0.00021 -0.00507 0.00841 0.00253
296 10F-2 -0.00021 0.00672 -0.00878 -0.00253 -0.00548
297 10F+3 -0.00201 -0.00116 0.00000 0.00261 0.00150
298 10F-3 -0.00517 0.00896 0.00537 0.00491 -0.00851
161 162 163 164 165
(A1G)--V (A2G)--V (EG)--V (EG)--V (A2U)--V
Eigenvalues -- 2.98284 3.00514 3.03310 3.03310 3.05434
1 1 Si 1S 0.01506 0.00000 0.00000 0.00000 0.02469
2 2S -0.03032 0.00000 0.00000 0.00000 -0.06583
3 3S 0.15052 0.00000 0.00000 0.00000 0.24077
4 4S -0.85863 0.00000 0.00000 0.00000 1.85644
5 5S 5.16416 0.00000 0.00000 0.00000 -2.15840
6 6S 0.68920 0.00000 0.00000 0.00000 -4.92710
7 7PX 0.00000 0.00000 -0.00909 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 0.00909 0.00000
9 7PZ 0.06026 0.00000 0.00000 0.00000 0.00986
10 8PX 0.00000 0.00000 -0.09236 0.00000 0.00000
11 8PY 0.00000 0.00000 0.00000 0.09236 0.00000
12 8PZ -0.08294 0.00000 0.00000 0.00000 0.05624
13 9PX 0.00000 0.00000 0.17382 0.00000 0.00000
14 9PY 0.00000 0.00000 0.00000 -0.17382 0.00000
15 9PZ -0.57021 0.00000 0.00000 0.00000 -0.65359
16 10PX 0.00000 0.00000 0.57387 0.00000 0.00000
17 10PY 0.00000 0.00000 0.00000 -0.57387 0.00000
18 10PZ 0.95900 0.00000 0.00000 0.00000 5.04122
19 11PX 0.00000 0.00000 0.85378 0.00000 0.00000
20 11PY 0.00000 0.00000 0.00000 -0.85378 0.00000
21 11PZ 0.29947 0.00000 0.00000 0.00000 0.82946
22 12D 0 -1.09944 0.00000 0.00000 0.00000 -0.60771
23 12D+1 0.00000 0.00000 -0.17348 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.17348 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.85925 0.00000
26 12D-2 0.00000 0.00000 -0.85925 0.00000 0.00000
27 13D 0 -1.19914 0.00000 0.00000 0.00000 -1.01945
28 13D+1 0.00000 0.00000 0.02871 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 -0.02871 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.25058 0.00000
31 13D-2 0.00000 0.00000 -0.25058 0.00000 0.00000
32 14D 0 0.57316 0.00000 0.00000 0.00000 0.52213
33 14D+1 0.00000 0.00000 -0.04744 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.04744 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.05002 0.00000
36 14D-2 0.00000 0.00000 -0.05002 0.00000 0.00000
37 15F 0 0.37468 0.00000 0.00000 0.00000 0.02134
38 15F+1 0.00000 0.00000 -0.23142 0.00000 0.00000
39 15F-1 0.00000 0.00000 0.00000 0.23142 0.00000
40 15F+2 0.00000 0.00000 0.00000 0.31162 0.00000
41 15F-2 0.00000 0.00000 -0.31162 0.00000 0.00000
42 15F+3 0.00000 0.84336 0.00000 0.00000 0.00000
43 15F-3 -0.92068 0.00000 0.00000 0.00000 0.52505
44 16F 0 -0.22429 0.00000 0.00000 0.00000 -0.00748
45 16F+1 0.00000 0.00000 0.16523 0.00000 0.00000
46 16F-1 0.00000 0.00000 0.00000 -0.16523 0.00000
47 16F+2 0.00000 0.00000 0.00000 -0.04816 0.00000
48 16F-2 0.00000 0.00000 0.04816 0.00000 0.00000
49 16F+3 0.00000 0.20319 0.00000 0.00000 0.00000
50 16F-3 -0.05393 0.00000 0.00000 0.00000 -0.31551
51 17G 0 -0.17065 0.00000 0.00000 0.00000 -0.11329
52 17G+1 0.00000 0.00000 0.33189 0.00000 0.00000
53 17G-1 0.00000 0.00000 0.00000 -0.33189 0.00000
54 17G+2 0.00000 0.00000 0.00000 0.25545 0.00000
55 17G-2 0.00000 0.00000 -0.25545 0.00000 0.00000
56 17G+3 0.00000 -0.31127 0.00000 0.00000 0.00000
57 17G-3 0.04842 0.00000 0.00000 0.00000 -0.17711
58 17G+4 0.00000 0.00000 0.00000 -0.06644 0.00000
59 17G-4 0.00000 0.00000 -0.06644 0.00000 0.00000
60 2 Si 1S 0.01506 0.00000 0.00000 0.00000 -0.02469
61 2S -0.03032 0.00000 0.00000 0.00000 0.06583
62 3S 0.15052 0.00000 0.00000 0.00000 -0.24077
63 4S -0.85863 0.00000 0.00000 0.00000 -1.85644
64 5S 5.16416 0.00000 0.00000 0.00000 2.15840
65 6S 0.68920 0.00000 0.00000 0.00000 4.92710
66 7PX 0.00000 0.00000 0.00909 0.00000 0.00000
67 7PY 0.00000 0.00000 0.00000 -0.00909 0.00000
68 7PZ -0.06026 0.00000 0.00000 0.00000 0.00986
69 8PX 0.00000 0.00000 0.09236 0.00000 0.00000
70 8PY 0.00000 0.00000 0.00000 -0.09236 0.00000
71 8PZ 0.08294 0.00000 0.00000 0.00000 0.05624
72 9PX 0.00000 0.00000 -0.17382 0.00000 0.00000
73 9PY 0.00000 0.00000 0.00000 0.17382 0.00000
74 9PZ 0.57021 0.00000 0.00000 0.00000 -0.65359
75 10PX 0.00000 0.00000 -0.57387 0.00000 0.00000
76 10PY 0.00000 0.00000 0.00000 0.57387 0.00000
77 10PZ -0.95900 0.00000 0.00000 0.00000 5.04122
78 11PX 0.00000 0.00000 -0.85378 0.00000 0.00000
79 11PY 0.00000 0.00000 0.00000 0.85378 0.00000
80 11PZ -0.29947 0.00000 0.00000 0.00000 0.82946
81 12D 0 -1.09944 0.00000 0.00000 0.00000 0.60771
82 12D+1 0.00000 0.00000 -0.17348 0.00000 0.00000
83 12D-1 0.00000 0.00000 0.00000 0.17348 0.00000
84 12D+2 0.00000 0.00000 0.00000 0.85925 0.00000
85 12D-2 0.00000 0.00000 -0.85925 0.00000 0.00000
86 13D 0 -1.19914 0.00000 0.00000 0.00000 1.01945
87 13D+1 0.00000 0.00000 0.02871 0.00000 0.00000
88 13D-1 0.00000 0.00000 0.00000 -0.02871 0.00000
89 13D+2 0.00000 0.00000 0.00000 0.25058 0.00000
90 13D-2 0.00000 0.00000 -0.25058 0.00000 0.00000
91 14D 0 0.57316 0.00000 0.00000 0.00000 -0.52213
92 14D+1 0.00000 0.00000 -0.04744 0.00000 0.00000
93 14D-1 0.00000 0.00000 0.00000 0.04744 0.00000
94 14D+2 0.00000 0.00000 0.00000 0.05002 0.00000
95 14D-2 0.00000 0.00000 -0.05002 0.00000 0.00000
96 15F 0 -0.37468 0.00000 0.00000 0.00000 0.02134
97 15F+1 0.00000 0.00000 0.23142 0.00000 0.00000
98 15F-1 0.00000 0.00000 0.00000 -0.23142 0.00000
99 15F+2 0.00000 0.00000 0.00000 -0.31162 0.00000
100 15F-2 0.00000 0.00000 0.31162 0.00000 0.00000
101 15F+3 0.00000 -0.84336 0.00000 0.00000 0.00000
102 15F-3 0.92068 0.00000 0.00000 0.00000 0.52505
103 16F 0 0.22429 0.00000 0.00000 0.00000 -0.00748
104 16F+1 0.00000 0.00000 -0.16523 0.00000 0.00000
105 16F-1 0.00000 0.00000 0.00000 0.16523 0.00000
106 16F+2 0.00000 0.00000 0.00000 0.04816 0.00000
107 16F-2 0.00000 0.00000 -0.04816 0.00000 0.00000
108 16F+3 0.00000 -0.20319 0.00000 0.00000 0.00000
109 16F-3 0.05393 0.00000 0.00000 0.00000 -0.31551
110 17G 0 -0.17065 0.00000 0.00000 0.00000 0.11329
111 17G+1 0.00000 0.00000 0.33189 0.00000 0.00000
112 17G-1 0.00000 0.00000 0.00000 -0.33189 0.00000
113 17G+2 0.00000 0.00000 0.00000 0.25545 0.00000
114 17G-2 0.00000 0.00000 -0.25545 0.00000 0.00000
115 17G+3 0.00000 -0.31127 0.00000 0.00000 0.00000
116 17G-3 0.04842 0.00000 0.00000 0.00000 0.17711
117 17G+4 0.00000 0.00000 0.00000 -0.06644 0.00000
118 17G-4 0.00000 0.00000 -0.06644 0.00000 0.00000
119 3 H 1S 0.00606 0.00000 0.00000 -0.00936 -0.00117
120 2S 0.18183 0.00000 0.00000 -0.29307 -0.14537
121 3S -1.91045 0.00000 0.00000 0.93028 -0.01757
122 4S -0.41597 0.00000 0.00000 1.08762 0.42217
123 5PX 0.00000 0.04768 0.05602 0.00000 0.00000
124 5PY -0.00294 0.00000 0.00000 -0.04736 -0.01729
125 5PZ 0.04730 0.00000 0.00000 -0.07825 -0.06140
126 6PX 0.00000 -0.38300 -0.47065 0.00000 0.00000
127 6PY -0.01079 0.00000 0.00000 0.45576 0.14958
128 6PZ -0.39893 0.00000 0.00000 0.67166 0.49445
129 7PX 0.00000 0.77716 0.81006 0.00000 0.00000
130 7PY 0.60994 0.00000 0.00000 -0.72167 0.20449
131 7PZ 1.05507 0.00000 0.00000 -0.80663 -0.89123
132 8D 0 0.02640 0.00000 0.00000 -0.01600 -0.03531
133 8D+1 0.00000 0.04267 -0.01465 0.00000 0.00000
134 8D-1 0.03081 0.00000 0.00000 -0.00835 -0.02654
135 8D+2 -0.00205 0.00000 0.00000 0.03071 0.00022
136 8D-2 0.00000 0.02750 0.03950 0.00000 0.00000
137 9D 0 -0.26448 0.00000 0.00000 0.14538 0.40984
138 9D+1 0.00000 -0.41776 0.14142 0.00000 0.00000
139 9D-1 -0.34750 0.00000 0.00000 0.07030 0.25693
140 9D+2 0.05582 0.00000 0.00000 -0.27609 0.04190
141 9D-2 0.00000 -0.29254 -0.40732 0.00000 0.00000
142 10F 0 -0.00563 0.00000 0.00000 0.00230 0.00043
143 10F+1 0.00000 -0.01126 0.00713 0.00000 0.00000
144 10F-1 -0.00243 0.00000 0.00000 0.01147 0.00363
145 10F+2 -0.00002 0.00000 0.00000 -0.00127 -0.00219
146 10F-2 0.00000 -0.00545 0.00081 0.00000 0.00000
147 10F+3 0.00000 0.00514 0.00619 0.00000 0.00000
148 10F-3 -0.00587 0.00000 0.00000 -0.00092 -0.00078
149 4 H 1S 0.00606 0.00000 -0.00811 0.00468 -0.00117
150 2S 0.18183 0.00000 -0.25381 0.14654 -0.14537
151 3S -1.91045 0.00000 0.80564 -0.46514 -0.01757
152 4S -0.41597 0.00000 0.94191 -0.54381 0.42217
153 5PX 0.00255 -0.02384 0.04953 0.00375 0.01497
154 5PY 0.00147 0.04130 -0.00375 -0.05386 0.00864
155 5PZ 0.04730 0.00000 -0.06777 0.03913 -0.06140
156 6PX 0.00934 0.19150 -0.45948 -0.00645 -0.12954
157 6PY 0.00539 -0.33169 0.00645 0.46693 -0.07479
158 6PZ -0.39893 0.00000 0.58168 -0.33583 0.49445
159 7PX -0.52823 -0.38858 0.74377 0.03828 -0.17710
160 7PY -0.30497 0.67304 -0.03828 -0.78796 -0.10225
161 7PZ 1.05507 0.00000 -0.69856 0.40331 -0.89123
162 8D 0 0.02640 0.00000 -0.01385 0.00800 -0.03531
163 8D+1 -0.02668 -0.02133 0.00260 -0.00996 0.02298
164 8D-1 -0.01540 0.03695 0.00996 0.00890 0.01327
165 8D+2 0.00103 0.02381 -0.03040 -0.02195 -0.00011
166 8D-2 0.00178 -0.01375 -0.01316 0.03040 -0.00019
167 9D 0 -0.26448 0.00000 0.12590 -0.07269 0.40984
168 9D+1 0.30094 0.20888 -0.01737 0.09168 -0.22251
169 9D-1 0.17375 -0.36179 -0.09168 -0.08849 -0.12847
170 9D+2 -0.02791 -0.25335 0.29592 0.23647 -0.02095
171 9D-2 -0.04834 0.14627 0.10523 -0.29592 -0.03629
172 10F 0 -0.00563 0.00000 0.00199 -0.00115 0.00043
173 10F+1 0.00210 0.00563 -0.00682 0.00805 -0.00314
174 10F-1 0.00121 -0.00975 -0.00805 -0.00248 -0.00181
175 10F+2 0.00001 -0.00472 0.00020 -0.00092 0.00109
176 10F-2 0.00002 0.00273 0.00115 -0.00020 0.00189
177 10F+3 0.00000 0.00514 -0.00310 -0.00536 0.00000
178 10F-3 -0.00587 0.00000 -0.00079 0.00046 -0.00078
179 5 H 1S 0.00606 0.00000 0.00811 0.00468 -0.00117
180 2S 0.18183 0.00000 0.25381 0.14654 -0.14537
181 3S -1.91045 0.00000 -0.80564 -0.46514 -0.01757
182 4S -0.41597 0.00000 -0.94191 -0.54381 0.42217
183 5PX -0.00255 -0.02384 0.04953 -0.00375 -0.01497
184 5PY 0.00147 -0.04130 0.00375 -0.05386 0.00864
185 5PZ 0.04730 0.00000 0.06777 0.03913 -0.06140
186 6PX -0.00934 0.19150 -0.45948 0.00645 0.12954
187 6PY 0.00539 0.33169 -0.00645 0.46693 -0.07479
188 6PZ -0.39893 0.00000 -0.58168 -0.33583 0.49445
189 7PX 0.52823 -0.38858 0.74377 -0.03828 0.17710
190 7PY -0.30497 -0.67304 0.03828 -0.78796 -0.10225
191 7PZ 1.05507 0.00000 0.69856 0.40331 -0.89123
192 8D 0 0.02640 0.00000 0.01385 0.00800 -0.03531
193 8D+1 0.02668 -0.02133 0.00260 0.00996 -0.02298
194 8D-1 -0.01540 -0.03695 -0.00996 0.00890 0.01327
195 8D+2 0.00103 -0.02381 0.03040 -0.02195 -0.00011
196 8D-2 -0.00178 -0.01375 -0.01316 -0.03040 0.00019
197 9D 0 -0.26448 0.00000 -0.12590 -0.07269 0.40984
198 9D+1 -0.30094 0.20888 -0.01737 -0.09168 0.22251
199 9D-1 0.17375 0.36179 0.09168 -0.08849 -0.12847
200 9D+2 -0.02791 0.25335 -0.29592 0.23647 -0.02095
201 9D-2 0.04834 0.14627 0.10523 0.29592 0.03629
202 10F 0 -0.00563 0.00000 -0.00199 -0.00115 0.00043
203 10F+1 -0.00210 0.00563 -0.00682 -0.00805 0.00314
204 10F-1 0.00121 0.00975 0.00805 -0.00248 -0.00181
205 10F+2 0.00001 0.00472 -0.00020 -0.00092 0.00109
206 10F-2 -0.00002 0.00273 0.00115 0.00020 -0.00189
207 10F+3 0.00000 0.00514 -0.00310 0.00536 0.00000
208 10F-3 -0.00587 0.00000 0.00079 0.00046 -0.00078
209 6 H 1S 0.00606 0.00000 0.00000 -0.00936 0.00117
210 2S 0.18183 0.00000 0.00000 -0.29307 0.14537
211 3S -1.91045 0.00000 0.00000 0.93028 0.01757
212 4S -0.41597 0.00000 0.00000 1.08762 -0.42217
213 5PX 0.00000 -0.04768 -0.05602 0.00000 0.00000
214 5PY 0.00294 0.00000 0.00000 0.04736 -0.01729
215 5PZ -0.04730 0.00000 0.00000 0.07825 -0.06140
216 6PX 0.00000 0.38300 0.47065 0.00000 0.00000
217 6PY 0.01079 0.00000 0.00000 -0.45576 0.14958
218 6PZ 0.39893 0.00000 0.00000 -0.67166 0.49445
219 7PX 0.00000 -0.77716 -0.81006 0.00000 0.00000
220 7PY -0.60994 0.00000 0.00000 0.72167 0.20449
221 7PZ -1.05507 0.00000 0.00000 0.80663 -0.89123
222 8D 0 0.02640 0.00000 0.00000 -0.01600 0.03531
223 8D+1 0.00000 0.04267 -0.01465 0.00000 0.00000
224 8D-1 0.03081 0.00000 0.00000 -0.00835 0.02654
225 8D+2 -0.00205 0.00000 0.00000 0.03071 -0.00022
226 8D-2 0.00000 0.02750 0.03950 0.00000 0.00000
227 9D 0 -0.26448 0.00000 0.00000 0.14538 -0.40984
228 9D+1 0.00000 -0.41776 0.14142 0.00000 0.00000
229 9D-1 -0.34750 0.00000 0.00000 0.07030 -0.25693
230 9D+2 0.05582 0.00000 0.00000 -0.27609 -0.04190
231 9D-2 0.00000 -0.29254 -0.40732 0.00000 0.00000
232 10F 0 0.00563 0.00000 0.00000 -0.00230 0.00043
233 10F+1 0.00000 0.01126 -0.00713 0.00000 0.00000
234 10F-1 0.00243 0.00000 0.00000 -0.01147 0.00363
235 10F+2 0.00002 0.00000 0.00000 0.00127 -0.00219
236 10F-2 0.00000 0.00545 -0.00081 0.00000 0.00000
237 10F+3 0.00000 -0.00514 -0.00619 0.00000 0.00000
238 10F-3 0.00587 0.00000 0.00000 0.00092 -0.00078
239 7 H 1S 0.00606 0.00000 0.00811 0.00468 0.00117
240 2S 0.18183 0.00000 0.25381 0.14654 0.14537
241 3S -1.91045 0.00000 -0.80564 -0.46514 0.01757
242 4S -0.41597 0.00000 -0.94191 -0.54381 -0.42217
243 5PX 0.00255 0.02384 -0.04953 0.00375 -0.01497
244 5PY -0.00147 0.04130 -0.00375 0.05386 0.00864
245 5PZ -0.04730 0.00000 -0.06777 -0.03913 -0.06140
246 6PX 0.00934 -0.19150 0.45948 -0.00645 0.12954
247 6PY -0.00539 -0.33169 0.00645 -0.46693 -0.07479
248 6PZ 0.39893 0.00000 0.58168 0.33583 0.49445
249 7PX -0.52823 0.38858 -0.74377 0.03828 0.17710
250 7PY 0.30497 0.67304 -0.03828 0.78796 -0.10225
251 7PZ -1.05507 0.00000 -0.69856 -0.40331 -0.89123
252 8D 0 0.02640 0.00000 0.01385 0.00800 0.03531
253 8D+1 0.02668 -0.02133 0.00260 0.00996 0.02298
254 8D-1 -0.01540 -0.03695 -0.00996 0.00890 -0.01327
255 8D+2 0.00103 -0.02381 0.03040 -0.02195 0.00011
256 8D-2 -0.00178 -0.01375 -0.01316 -0.03040 -0.00019
257 9D 0 -0.26448 0.00000 -0.12590 -0.07269 -0.40984
258 9D+1 -0.30094 0.20888 -0.01737 -0.09168 -0.22251
259 9D-1 0.17375 0.36179 0.09168 -0.08849 0.12847
260 9D+2 -0.02791 0.25335 -0.29592 0.23647 0.02095
261 9D-2 0.04834 0.14627 0.10523 0.29592 -0.03629
262 10F 0 0.00563 0.00000 0.00199 0.00115 0.00043
263 10F+1 0.00210 -0.00563 0.00682 0.00805 0.00314
264 10F-1 -0.00121 -0.00975 -0.00805 0.00248 -0.00181
265 10F+2 -0.00001 -0.00472 0.00020 0.00092 0.00109
266 10F-2 0.00002 -0.00273 -0.00115 -0.00020 -0.00189
267 10F+3 0.00000 -0.00514 0.00310 -0.00536 0.00000
268 10F-3 0.00587 0.00000 -0.00079 -0.00046 -0.00078
269 8 H 1S 0.00606 0.00000 -0.00811 0.00468 0.00117
270 2S 0.18183 0.00000 -0.25381 0.14654 0.14537
271 3S -1.91045 0.00000 0.80564 -0.46514 0.01757
272 4S -0.41597 0.00000 0.94191 -0.54381 -0.42217
273 5PX -0.00255 0.02384 -0.04953 -0.00375 0.01497
274 5PY -0.00147 -0.04130 0.00375 0.05386 0.00864
275 5PZ -0.04730 0.00000 0.06777 -0.03913 -0.06140
276 6PX -0.00934 -0.19150 0.45948 0.00645 -0.12954
277 6PY -0.00539 0.33169 -0.00645 -0.46693 -0.07479
278 6PZ 0.39893 0.00000 -0.58168 0.33583 0.49445
279 7PX 0.52823 0.38858 -0.74377 -0.03828 -0.17710
280 7PY 0.30497 -0.67304 0.03828 0.78796 -0.10225
281 7PZ -1.05507 0.00000 0.69856 -0.40331 -0.89123
282 8D 0 0.02640 0.00000 -0.01385 0.00800 0.03531
283 8D+1 -0.02668 -0.02133 0.00260 -0.00996 -0.02298
284 8D-1 -0.01540 0.03695 0.00996 0.00890 -0.01327
285 8D+2 0.00103 0.02381 -0.03040 -0.02195 0.00011
286 8D-2 0.00178 -0.01375 -0.01316 0.03040 0.00019
287 9D 0 -0.26448 0.00000 0.12590 -0.07269 -0.40984
288 9D+1 0.30094 0.20888 -0.01737 0.09168 0.22251
289 9D-1 0.17375 -0.36179 -0.09168 -0.08849 0.12847
290 9D+2 -0.02791 -0.25335 0.29592 0.23647 0.02095
291 9D-2 -0.04834 0.14627 0.10523 -0.29592 0.03629
292 10F 0 0.00563 0.00000 -0.00199 0.00115 0.00043
293 10F+1 -0.00210 -0.00563 0.00682 -0.00805 -0.00314
294 10F-1 -0.00121 0.00975 0.00805 0.00248 -0.00181
295 10F+2 -0.00001 0.00472 -0.00020 0.00092 0.00109
296 10F-2 -0.00002 -0.00273 -0.00115 0.00020 0.00189
297 10F+3 0.00000 -0.00514 0.00310 0.00536 0.00000
298 10F-3 0.00587 0.00000 0.00079 -0.00046 -0.00078
166 167 168 169 170
(A2U)--V (EG)--V (EG)--V (EU)--V (EU)--V
Eigenvalues -- 3.10784 3.14574 3.14574 3.17718 3.17718
1 1 Si 1S 0.02382 0.00000 0.00000 0.00000 0.00000
2 2S -0.01835 0.00000 0.00000 0.00000 0.00000
3 3S 0.26960 0.00000 0.00000 0.00000 0.00000
4 4S 1.73732 0.00000 0.00000 0.00000 0.00000
5 5S -1.82179 0.00000 0.00000 0.00000 0.00000
6 6S -7.04593 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 -0.02234 0.00000 0.02336 0.00000
8 7PY 0.00000 0.00000 -0.02234 0.00000 -0.02336
9 7PZ -0.00600 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 0.12078 0.00000 -0.14027 0.00000
11 8PY 0.00000 0.00000 0.12078 0.00000 0.14027
12 8PZ 0.14877 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 -0.07266 0.00000 -0.17883 0.00000
14 9PY 0.00000 0.00000 -0.07266 0.00000 0.17883
15 9PZ -0.57747 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 1.70103 0.00000 -0.01207 0.00000
17 10PY 0.00000 0.00000 1.70103 0.00000 0.01207
18 10PZ 8.12901 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.11841 0.00000 0.31584 0.00000
20 11PY 0.00000 0.00000 0.11841 0.00000 -0.31584
21 11PZ 1.76556 0.00000 0.00000 0.00000 0.00000
22 12D 0 -2.70302 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 -1.05219 0.00000 0.10560 0.00000
24 12D-1 0.00000 0.00000 -1.05219 0.00000 -0.10560
25 12D+2 0.00000 0.00000 -0.14376 0.00000 -0.04403
26 12D-2 0.00000 -0.14376 0.00000 0.04403 0.00000
27 13D 0 -2.01022 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.39153 0.00000 -0.20892 0.00000
29 13D-1 0.00000 0.00000 0.39153 0.00000 0.20892
30 13D+2 0.00000 0.00000 0.21037 0.00000 0.24292
31 13D-2 0.00000 0.21037 0.00000 -0.24292 0.00000
32 14D 0 0.45694 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.07574 0.00000 -0.16427 0.00000
34 14D-1 0.00000 0.00000 0.07574 0.00000 0.16427
35 14D+2 0.00000 0.00000 -0.16853 0.00000 -0.27228
36 14D-2 0.00000 -0.16853 0.00000 0.27228 0.00000
37 15F 0 1.06715 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.30541 0.00000 0.01090 0.00000
39 15F-1 0.00000 0.00000 0.30541 0.00000 -0.01090
40 15F+2 0.00000 0.00000 0.02889 0.00000 -0.05606
41 15F-2 0.00000 0.02889 0.00000 0.05606 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.39078 0.00000 0.00000 0.00000 0.00000
44 16F 0 -0.16939 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 -0.27240 0.00000 0.28844 0.00000
46 16F-1 0.00000 0.00000 -0.27240 0.00000 -0.28844
47 16F+2 0.00000 0.00000 -0.15237 0.00000 -0.10078
48 16F-2 0.00000 -0.15237 0.00000 0.10078 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 -0.23497 0.00000 0.00000 0.00000 0.00000
51 17G 0 -1.08504 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 -0.33777 0.00000 0.28931 0.00000
53 17G-1 0.00000 0.00000 -0.33777 0.00000 -0.28931
54 17G+2 0.00000 0.00000 -0.17248 0.00000 -0.16367
55 17G-2 0.00000 -0.17248 0.00000 0.16367 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.50922 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.86718 0.00000 0.79477
59 17G-4 0.00000 -0.86718 0.00000 0.79477 0.00000
60 2 Si 1S -0.02382 0.00000 0.00000 0.00000 0.00000
61 2S 0.01835 0.00000 0.00000 0.00000 0.00000
62 3S -0.26960 0.00000 0.00000 0.00000 0.00000
63 4S -1.73732 0.00000 0.00000 0.00000 0.00000
64 5S 1.82179 0.00000 0.00000 0.00000 0.00000
65 6S 7.04593 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 0.02234 0.00000 0.02336 0.00000
67 7PY 0.00000 0.00000 0.02234 0.00000 -0.02336
68 7PZ -0.00600 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 -0.12078 0.00000 -0.14027 0.00000
70 8PY 0.00000 0.00000 -0.12078 0.00000 0.14027
71 8PZ 0.14877 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 0.07266 0.00000 -0.17883 0.00000
73 9PY 0.00000 0.00000 0.07266 0.00000 0.17883
74 9PZ -0.57747 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 -1.70103 0.00000 -0.01207 0.00000
76 10PY 0.00000 0.00000 -1.70103 0.00000 0.01207
77 10PZ 8.12901 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 -0.11841 0.00000 0.31584 0.00000
79 11PY 0.00000 0.00000 -0.11841 0.00000 -0.31584
80 11PZ 1.76556 0.00000 0.00000 0.00000 0.00000
81 12D 0 2.70302 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 -1.05219 0.00000 -0.10560 0.00000
83 12D-1 0.00000 0.00000 -1.05219 0.00000 0.10560
84 12D+2 0.00000 0.00000 -0.14376 0.00000 0.04403
85 12D-2 0.00000 -0.14376 0.00000 -0.04403 0.00000
86 13D 0 2.01022 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.39153 0.00000 0.20892 0.00000
88 13D-1 0.00000 0.00000 0.39153 0.00000 -0.20892
89 13D+2 0.00000 0.00000 0.21037 0.00000 -0.24292
90 13D-2 0.00000 0.21037 0.00000 0.24292 0.00000
91 14D 0 -0.45694 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.07574 0.00000 0.16427 0.00000
93 14D-1 0.00000 0.00000 0.07574 0.00000 -0.16427
94 14D+2 0.00000 0.00000 -0.16853 0.00000 0.27228
95 14D-2 0.00000 -0.16853 0.00000 -0.27228 0.00000
96 15F 0 1.06715 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 -0.30541 0.00000 0.01090 0.00000
98 15F-1 0.00000 0.00000 -0.30541 0.00000 -0.01090
99 15F+2 0.00000 0.00000 -0.02889 0.00000 -0.05606
100 15F-2 0.00000 -0.02889 0.00000 0.05606 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 -0.39078 0.00000 0.00000 0.00000 0.00000
103 16F 0 -0.16939 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.27240 0.00000 0.28844 0.00000
105 16F-1 0.00000 0.00000 0.27240 0.00000 -0.28844
106 16F+2 0.00000 0.00000 0.15237 0.00000 -0.10078
107 16F-2 0.00000 0.15237 0.00000 0.10078 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 -0.23497 0.00000 0.00000 0.00000 0.00000
110 17G 0 1.08504 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 -0.33777 0.00000 -0.28931 0.00000
112 17G-1 0.00000 0.00000 -0.33777 0.00000 0.28931
113 17G+2 0.00000 0.00000 -0.17248 0.00000 0.16367
114 17G-2 0.00000 -0.17248 0.00000 -0.16367 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.50922 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.86718 0.00000 -0.79477
118 17G-4 0.00000 -0.86718 0.00000 -0.79477 0.00000
119 3 H 1S 0.00523 0.00000 0.00029 0.00000 -0.00765
120 2S -0.16247 0.00000 -0.48044 0.00000 -0.53210
121 3S -1.14668 0.00000 -0.36064 0.00000 0.12610
122 4S 0.21183 0.00000 0.27254 0.00000 0.60364
123 5PX 0.00000 0.06150 0.00000 -0.06808 0.00000
124 5PY -0.06802 0.00000 -0.09606 0.00000 -0.09259
125 5PZ 0.03768 0.00000 -0.00990 0.00000 -0.04715
126 6PX 0.00000 -0.48024 0.00000 0.54241 0.00000
127 6PY 0.55358 0.00000 0.85315 0.00000 0.81746
128 6PZ -0.27329 0.00000 0.04676 0.00000 0.39362
129 7PX 0.00000 -0.20109 0.00000 -0.05032 0.00000
130 7PY 0.20195 0.00000 -0.48871 0.00000 -0.64506
131 7PZ 0.11731 0.00000 0.25175 0.00000 -0.25200
132 8D 0 -0.00401 0.00000 0.01960 0.00000 0.01095
133 8D+1 0.00000 -0.04387 0.00000 0.03620 0.00000
134 8D-1 -0.01977 0.00000 -0.00569 0.00000 0.00455
135 8D+2 -0.01538 0.00000 -0.00567 0.00000 -0.01174
136 8D-2 0.00000 -0.02797 0.00000 0.01250 0.00000
137 9D 0 0.10636 0.00000 -0.16020 0.00000 -0.08399
138 9D+1 0.00000 0.45537 0.00000 -0.36263 0.00000
139 9D-1 0.19200 0.00000 0.00833 0.00000 -0.07415
140 9D+2 0.25488 0.00000 0.12007 0.00000 0.15344
141 9D-2 0.00000 0.38746 0.00000 -0.20509 0.00000
142 10F 0 -0.00431 0.00000 -0.00553 0.00000 -0.00280
143 10F+1 0.00000 0.01063 0.00000 -0.00942 0.00000
144 10F-1 -0.01893 0.00000 0.00732 0.00000 0.01056
145 10F+2 0.01665 0.00000 0.00739 0.00000 0.01351
146 10F-2 0.00000 -0.01016 0.00000 0.00681 0.00000
147 10F+3 0.00000 0.02826 0.00000 -0.02819 0.00000
148 10F-3 -0.01013 0.00000 0.00285 0.00000 0.00807
149 4 H 1S 0.00523 -0.00025 -0.00015 -0.00663 0.00383
150 2S -0.16247 0.41608 0.24022 -0.46081 0.26605
151 3S -1.14668 0.31232 0.18032 0.10920 -0.06305
152 4S 0.21183 -0.23602 -0.13627 0.52276 -0.30182
153 5PX 0.05890 -0.05667 -0.06822 0.05243 -0.06957
154 5PY 0.03401 -0.06822 0.02211 0.06957 0.02791
155 5PZ 0.03768 0.00857 0.00495 -0.04083 0.02357
156 6PX -0.47942 0.51980 0.57737 -0.47749 0.58884
157 6PY -0.27679 0.57737 -0.14690 -0.58884 -0.20244
158 6PZ -0.27329 -0.04050 -0.02338 0.34088 -0.19681
159 7PX -0.17489 -0.41680 -0.12454 0.47122 -0.30111
160 7PY -0.10097 -0.12454 -0.27299 0.30111 -0.12353
161 7PZ 0.11731 -0.21802 -0.12588 -0.21824 0.12600
162 8D 0 -0.00401 -0.01697 -0.00980 0.00948 -0.00547
163 8D+1 0.01712 -0.01523 0.01653 0.00564 0.01765
164 8D-1 0.00988 0.01653 -0.03432 -0.01765 -0.02601
165 8D+2 0.00769 0.00966 -0.02240 -0.00033 -0.01231
166 8D-2 0.01332 -0.01124 0.00966 0.01193 0.00033
167 9D 0 0.10636 0.13874 0.08010 -0.07274 0.04199
168 9D+1 -0.16628 0.12009 -0.19358 -0.03504 -0.18913
169 9D-1 -0.09600 -0.19358 0.34361 0.18913 0.25344
170 9D+2 -0.12744 -0.11578 0.32062 0.02236 0.19218
171 9D-2 -0.22073 0.18692 -0.11578 -0.16635 -0.02236
172 10F 0 -0.00431 0.00479 0.00276 -0.00243 0.00140
173 10F+1 0.01639 0.00815 -0.00143 -0.01028 0.00049
174 10F-1 0.00946 -0.00143 0.00980 -0.00049 0.00971
175 10F+2 -0.00832 0.00760 -0.00577 -0.00880 -0.00173
176 10F-2 -0.01442 0.00300 0.00760 -0.00843 0.00880
177 10F+3 0.00000 -0.01413 0.02447 0.01410 0.02441
178 10F-3 -0.01013 -0.00246 -0.00142 0.00698 -0.00403
179 5 H 1S 0.00523 0.00025 -0.00015 0.00663 0.00383
180 2S -0.16247 -0.41608 0.24022 0.46081 0.26605
181 3S -1.14668 -0.31232 0.18032 -0.10920 -0.06305
182 4S 0.21183 0.23602 -0.13627 -0.52276 -0.30182
183 5PX -0.05890 -0.05667 0.06822 0.05243 0.06957
184 5PY 0.03401 0.06822 0.02211 -0.06957 0.02791
185 5PZ 0.03768 -0.00857 0.00495 0.04083 0.02357
186 6PX 0.47942 0.51980 -0.57737 -0.47749 -0.58884
187 6PY -0.27679 -0.57737 -0.14690 0.58884 -0.20244
188 6PZ -0.27329 0.04050 -0.02338 -0.34088 -0.19681
189 7PX 0.17489 -0.41680 0.12454 0.47122 0.30111
190 7PY -0.10097 0.12454 -0.27299 -0.30111 -0.12353
191 7PZ 0.11731 0.21802 -0.12588 0.21824 0.12600
192 8D 0 -0.00401 0.01697 -0.00980 -0.00948 -0.00547
193 8D+1 -0.01712 -0.01523 -0.01653 0.00564 -0.01765
194 8D-1 0.00988 -0.01653 -0.03432 0.01765 -0.02601
195 8D+2 0.00769 -0.00966 -0.02240 0.00033 -0.01231
196 8D-2 -0.01332 -0.01124 -0.00966 0.01193 -0.00033
197 9D 0 0.10636 -0.13874 0.08010 0.07274 0.04199
198 9D+1 0.16628 0.12009 0.19358 -0.03504 0.18913
199 9D-1 -0.09600 0.19358 0.34361 -0.18913 0.25344
200 9D+2 -0.12744 0.11578 0.32062 -0.02236 0.19218
201 9D-2 0.22073 0.18692 0.11578 -0.16635 0.02236
202 10F 0 -0.00431 -0.00479 0.00276 0.00243 0.00140
203 10F+1 -0.01639 0.00815 0.00143 -0.01028 -0.00049
204 10F-1 0.00946 0.00143 0.00980 0.00049 0.00971
205 10F+2 -0.00832 -0.00760 -0.00577 0.00880 -0.00173
206 10F-2 0.01442 0.00300 -0.00760 -0.00843 -0.00880
207 10F+3 0.00000 -0.01413 -0.02447 0.01410 -0.02441
208 10F-3 -0.01013 0.00246 -0.00142 -0.00698 -0.00403
209 6 H 1S -0.00523 0.00000 0.00029 0.00000 0.00765
210 2S 0.16247 0.00000 -0.48044 0.00000 0.53210
211 3S 1.14668 0.00000 -0.36064 0.00000 -0.12610
212 4S -0.21183 0.00000 0.27254 0.00000 -0.60364
213 5PX 0.00000 -0.06150 0.00000 -0.06808 0.00000
214 5PY -0.06802 0.00000 0.09606 0.00000 -0.09259
215 5PZ 0.03768 0.00000 0.00990 0.00000 -0.04715
216 6PX 0.00000 0.48024 0.00000 0.54241 0.00000
217 6PY 0.55358 0.00000 -0.85315 0.00000 0.81746
218 6PZ -0.27329 0.00000 -0.04676 0.00000 0.39362
219 7PX 0.00000 0.20109 0.00000 -0.05032 0.00000
220 7PY 0.20195 0.00000 0.48871 0.00000 -0.64506
221 7PZ 0.11731 0.00000 -0.25175 0.00000 -0.25200
222 8D 0 0.00401 0.00000 0.01960 0.00000 -0.01095
223 8D+1 0.00000 -0.04387 0.00000 -0.03620 0.00000
224 8D-1 0.01977 0.00000 -0.00569 0.00000 -0.00455
225 8D+2 0.01538 0.00000 -0.00567 0.00000 0.01174
226 8D-2 0.00000 -0.02797 0.00000 -0.01250 0.00000
227 9D 0 -0.10636 0.00000 -0.16020 0.00000 0.08399
228 9D+1 0.00000 0.45537 0.00000 0.36263 0.00000
229 9D-1 -0.19200 0.00000 0.00833 0.00000 0.07415
230 9D+2 -0.25488 0.00000 0.12007 0.00000 -0.15344
231 9D-2 0.00000 0.38746 0.00000 0.20509 0.00000
232 10F 0 -0.00431 0.00000 0.00553 0.00000 -0.00280
233 10F+1 0.00000 -0.01063 0.00000 -0.00942 0.00000
234 10F-1 -0.01893 0.00000 -0.00732 0.00000 0.01056
235 10F+2 0.01665 0.00000 -0.00739 0.00000 0.01351
236 10F-2 0.00000 0.01016 0.00000 0.00681 0.00000
237 10F+3 0.00000 -0.02826 0.00000 -0.02819 0.00000
238 10F-3 -0.01013 0.00000 -0.00285 0.00000 0.00807
239 7 H 1S -0.00523 0.00025 -0.00015 -0.00663 -0.00383
240 2S 0.16247 -0.41608 0.24022 -0.46081 -0.26605
241 3S 1.14668 -0.31232 0.18032 0.10920 0.06305
242 4S -0.21183 0.23602 -0.13627 0.52276 0.30182
243 5PX -0.05890 0.05667 -0.06822 0.05243 0.06957
244 5PY 0.03401 -0.06822 -0.02211 -0.06957 0.02791
245 5PZ 0.03768 0.00857 -0.00495 0.04083 0.02357
246 6PX 0.47942 -0.51980 0.57737 -0.47749 -0.58884
247 6PY -0.27679 0.57737 0.14690 0.58884 -0.20244
248 6PZ -0.27329 -0.04050 0.02338 -0.34088 -0.19681
249 7PX 0.17489 0.41680 -0.12454 0.47122 0.30111
250 7PY -0.10097 -0.12454 0.27299 -0.30111 -0.12353
251 7PZ 0.11731 -0.21802 0.12588 0.21824 0.12600
252 8D 0 0.00401 0.01697 -0.00980 0.00948 0.00547
253 8D+1 0.01712 -0.01523 -0.01653 -0.00564 0.01765
254 8D-1 -0.00988 -0.01653 -0.03432 -0.01765 0.02601
255 8D+2 -0.00769 -0.00966 -0.02240 -0.00033 0.01231
256 8D-2 0.01332 -0.01124 -0.00966 -0.01193 0.00033
257 9D 0 -0.10636 -0.13874 0.08010 -0.07274 -0.04199
258 9D+1 -0.16628 0.12009 0.19358 0.03504 -0.18913
259 9D-1 0.09600 0.19358 0.34361 0.18913 -0.25344
260 9D+2 0.12744 0.11578 0.32062 0.02236 -0.19218
261 9D-2 -0.22073 0.18692 0.11578 0.16635 -0.02236
262 10F 0 -0.00431 0.00479 -0.00276 0.00243 0.00140
263 10F+1 -0.01639 -0.00815 -0.00143 -0.01028 -0.00049
264 10F-1 0.00946 -0.00143 -0.00980 0.00049 0.00971
265 10F+2 -0.00832 0.00760 0.00577 0.00880 -0.00173
266 10F-2 0.01442 -0.00300 0.00760 -0.00843 -0.00880
267 10F+3 0.00000 0.01413 0.02447 0.01410 -0.02441
268 10F-3 -0.01013 -0.00246 0.00142 -0.00698 -0.00403
269 8 H 1S -0.00523 -0.00025 -0.00015 0.00663 -0.00383
270 2S 0.16247 0.41608 0.24022 0.46081 -0.26605
271 3S 1.14668 0.31232 0.18032 -0.10920 0.06305
272 4S -0.21183 -0.23602 -0.13627 -0.52276 0.30182
273 5PX 0.05890 0.05667 0.06822 0.05243 -0.06957
274 5PY 0.03401 0.06822 -0.02211 0.06957 0.02791
275 5PZ 0.03768 -0.00857 -0.00495 -0.04083 0.02357
276 6PX -0.47942 -0.51980 -0.57737 -0.47749 0.58884
277 6PY -0.27679 -0.57737 0.14690 -0.58884 -0.20244
278 6PZ -0.27329 0.04050 0.02338 0.34088 -0.19681
279 7PX -0.17489 0.41680 0.12454 0.47122 -0.30111
280 7PY -0.10097 0.12454 0.27299 0.30111 -0.12353
281 7PZ 0.11731 0.21802 0.12588 -0.21824 0.12600
282 8D 0 0.00401 -0.01697 -0.00980 -0.00948 0.00547
283 8D+1 -0.01712 -0.01523 0.01653 -0.00564 -0.01765
284 8D-1 -0.00988 0.01653 -0.03432 0.01765 0.02601
285 8D+2 -0.00769 0.00966 -0.02240 0.00033 0.01231
286 8D-2 -0.01332 -0.01124 0.00966 -0.01193 -0.00033
287 9D 0 -0.10636 0.13874 0.08010 0.07274 -0.04199
288 9D+1 0.16628 0.12009 -0.19358 0.03504 0.18913
289 9D-1 0.09600 -0.19358 0.34361 -0.18913 -0.25344
290 9D+2 0.12744 -0.11578 0.32062 -0.02236 -0.19218
291 9D-2 0.22073 0.18692 -0.11578 0.16635 0.02236
292 10F 0 -0.00431 -0.00479 -0.00276 -0.00243 0.00140
293 10F+1 0.01639 -0.00815 0.00143 -0.01028 0.00049
294 10F-1 0.00946 0.00143 -0.00980 -0.00049 0.00971
295 10F+2 -0.00832 -0.00760 0.00577 -0.00880 -0.00173
296 10F-2 -0.01442 -0.00300 -0.00760 -0.00843 0.00880
297 10F+3 0.00000 0.01413 -0.02447 0.01410 0.02441
298 10F-3 -0.01013 0.00246 0.00142 0.00698 -0.00403
171 172 173 174 175
(EU)--V (EU)--V (EG)--V (EG)--V (A1G)--V
Eigenvalues -- 3.22294 3.22294 3.31358 3.31358 3.42857
1 1 Si 1S 0.00000 0.00000 0.00000 0.00000 0.04155
2 2S 0.00000 0.00000 0.00000 0.00000 -0.11621
3 3S 0.00000 0.00000 0.00000 0.00000 0.40189
4 4S 0.00000 0.00000 0.00000 0.00000 -0.99567
5 5S 0.00000 0.00000 0.00000 0.00000 8.46876
6 6S 0.00000 0.00000 0.00000 0.00000 -0.90971
7 7PX 0.00000 -0.00309 0.00000 0.01443 0.00000
8 7PY 0.00309 0.00000 0.01443 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00145
10 8PX 0.00000 0.04233 0.00000 0.01589 0.00000
11 8PY -0.04233 0.00000 0.01589 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.11036
13 9PX 0.00000 -0.04087 0.00000 -0.20380 0.00000
14 9PY 0.04087 0.00000 -0.20380 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.04973
16 10PX 0.00000 0.07991 0.00000 1.98073 0.00000
17 10PY -0.07991 0.00000 1.98073 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 2.66825
19 11PX 0.00000 -0.38988 0.00000 0.39346 0.00000
20 11PY 0.38988 0.00000 0.39346 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.29615
22 12D 0 0.00000 0.00000 0.00000 0.00000 -1.24344
23 12D+1 0.00000 0.24907 0.00000 -1.34815 0.00000
24 12D-1 -0.24907 0.00000 -1.34815 0.00000 0.00000
25 12D+2 -0.81563 0.00000 -0.08875 0.00000 0.00000
26 12D-2 0.00000 0.81563 0.00000 -0.08875 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.05173
28 13D+1 0.00000 0.86103 0.00000 -1.73386 0.00000
29 13D-1 -0.86103 0.00000 -1.73386 0.00000 0.00000
30 13D+2 -0.49040 0.00000 -0.08147 0.00000 0.00000
31 13D-2 0.00000 0.49040 0.00000 -0.08147 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00186
33 14D+1 0.00000 -0.04899 0.00000 0.80214 0.00000
34 14D-1 0.04899 0.00000 0.80214 0.00000 0.00000
35 14D+2 0.13351 0.00000 -0.13302 0.00000 0.00000
36 14D-2 0.00000 -0.13351 0.00000 -0.13302 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.33860
38 15F+1 0.00000 0.49514 0.00000 1.16036 0.00000
39 15F-1 -0.49514 0.00000 1.16036 0.00000 0.00000
40 15F+2 0.50857 0.00000 0.17496 0.00000 0.00000
41 15F-2 0.00000 -0.50857 0.00000 0.17496 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 -0.37588
44 16F 0 0.00000 0.00000 0.00000 0.00000 -0.94059
45 16F+1 0.00000 -0.01617 0.00000 -0.07437 0.00000
46 16F-1 0.01617 0.00000 -0.07437 0.00000 0.00000
47 16F+2 0.04861 0.00000 0.11780 0.00000 0.00000
48 16F-2 0.00000 -0.04861 0.00000 0.11780 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 -0.35450
51 17G 0 0.00000 0.00000 0.00000 0.00000 -0.73932
52 17G+1 0.00000 -0.35831 0.00000 -0.91025 0.00000
53 17G-1 0.35831 0.00000 -0.91025 0.00000 0.00000
54 17G+2 -0.31373 0.00000 0.19963 0.00000 0.00000
55 17G-2 0.00000 0.31373 0.00000 0.19963 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 -0.49242
58 17G+4 0.07391 0.00000 -0.05046 0.00000 0.00000
59 17G-4 0.00000 0.07391 0.00000 0.05046 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.04155
61 2S 0.00000 0.00000 0.00000 0.00000 -0.11621
62 3S 0.00000 0.00000 0.00000 0.00000 0.40189
63 4S 0.00000 0.00000 0.00000 0.00000 -0.99567
64 5S 0.00000 0.00000 0.00000 0.00000 8.46876
65 6S 0.00000 0.00000 0.00000 0.00000 -0.90971
66 7PX 0.00000 -0.00309 0.00000 -0.01443 0.00000
67 7PY 0.00309 0.00000 -0.01443 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 -0.00145
69 8PX 0.00000 0.04233 0.00000 -0.01589 0.00000
70 8PY -0.04233 0.00000 -0.01589 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 -0.11036
72 9PX 0.00000 -0.04087 0.00000 0.20380 0.00000
73 9PY 0.04087 0.00000 0.20380 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 -0.04973
75 10PX 0.00000 0.07991 0.00000 -1.98073 0.00000
76 10PY -0.07991 0.00000 -1.98073 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 -2.66825
78 11PX 0.00000 -0.38988 0.00000 -0.39346 0.00000
79 11PY 0.38988 0.00000 -0.39346 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 -0.29615
81 12D 0 0.00000 0.00000 0.00000 0.00000 -1.24344
82 12D+1 0.00000 -0.24907 0.00000 -1.34815 0.00000
83 12D-1 0.24907 0.00000 -1.34815 0.00000 0.00000
84 12D+2 0.81563 0.00000 -0.08875 0.00000 0.00000
85 12D-2 0.00000 -0.81563 0.00000 -0.08875 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 -0.05173
87 13D+1 0.00000 -0.86103 0.00000 -1.73386 0.00000
88 13D-1 0.86103 0.00000 -1.73386 0.00000 0.00000
89 13D+2 0.49040 0.00000 -0.08147 0.00000 0.00000
90 13D-2 0.00000 -0.49040 0.00000 -0.08147 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00186
92 14D+1 0.00000 0.04899 0.00000 0.80214 0.00000
93 14D-1 -0.04899 0.00000 0.80214 0.00000 0.00000
94 14D+2 -0.13351 0.00000 -0.13302 0.00000 0.00000
95 14D-2 0.00000 0.13351 0.00000 -0.13302 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 -0.33860
97 15F+1 0.00000 0.49514 0.00000 -1.16036 0.00000
98 15F-1 -0.49514 0.00000 -1.16036 0.00000 0.00000
99 15F+2 0.50857 0.00000 -0.17496 0.00000 0.00000
100 15F-2 0.00000 -0.50857 0.00000 -0.17496 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.37588
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.94059
104 16F+1 0.00000 -0.01617 0.00000 0.07437 0.00000
105 16F-1 0.01617 0.00000 0.07437 0.00000 0.00000
106 16F+2 0.04861 0.00000 -0.11780 0.00000 0.00000
107 16F-2 0.00000 -0.04861 0.00000 -0.11780 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.35450
110 17G 0 0.00000 0.00000 0.00000 0.00000 -0.73932
111 17G+1 0.00000 0.35831 0.00000 -0.91025 0.00000
112 17G-1 -0.35831 0.00000 -0.91025 0.00000 0.00000
113 17G+2 0.31373 0.00000 0.19963 0.00000 0.00000
114 17G-2 0.00000 -0.31373 0.00000 0.19963 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 -0.49242
117 17G+4 -0.07391 0.00000 -0.05046 0.00000 0.00000
118 17G-4 0.00000 -0.07391 0.00000 0.05046 0.00000
119 3 H 1S 0.00818 0.00000 0.01887 0.00000 0.00265
120 2S 0.27058 0.00000 0.06848 0.00000 0.18922
121 3S -0.14010 0.00000 -0.08760 0.00000 -2.85341
122 4S -0.63651 0.00000 -0.22679 0.00000 -0.00105
123 5PX 0.00000 -0.03829 0.00000 0.01044 0.00000
124 5PY 0.02272 0.00000 0.00510 0.00000 -0.05913
125 5PZ 0.06394 0.00000 0.01852 0.00000 0.00666
126 6PX 0.00000 0.32522 0.00000 -0.07918 0.00000
127 6PY -0.21087 0.00000 -0.06492 0.00000 0.48604
128 6PZ -0.53745 0.00000 -0.18318 0.00000 -0.05606
129 7PX 0.00000 -0.67780 0.00000 0.10085 0.00000
130 7PY -0.09186 0.00000 0.13290 0.00000 1.25827
131 7PZ 1.18757 0.00000 0.63617 0.00000 0.09887
132 8D 0 0.04722 0.00000 0.00254 0.00000 -0.03616
133 8D+1 0.00000 0.00866 0.00000 0.00939 0.00000
134 8D-1 0.02741 0.00000 0.03964 0.00000 -0.01008
135 8D+2 -0.00087 0.00000 0.00351 0.00000 -0.04149
136 8D-2 0.00000 -0.03690 0.00000 -0.00146 0.00000
137 9D 0 -0.50352 0.00000 -0.13843 0.00000 0.46796
138 9D+1 0.00000 -0.06378 0.00000 -0.08170 0.00000
139 9D-1 -0.31512 0.00000 -0.42987 0.00000 0.07762
140 9D+2 -0.02838 0.00000 -0.02917 0.00000 0.55372
141 9D-2 0.00000 0.41242 0.00000 0.00199 0.00000
142 10F 0 -0.00978 0.00000 -0.00705 0.00000 -0.00015
143 10F+1 0.00000 -0.00253 0.00000 -0.00943 0.00000
144 10F-1 -0.01700 0.00000 0.02089 0.00000 -0.00345
145 10F+2 -0.00054 0.00000 0.00954 0.00000 0.00747
146 10F-2 0.00000 -0.01172 0.00000 -0.00272 0.00000
147 10F+3 0.00000 -0.01222 0.00000 0.00392 0.00000
148 10F-3 0.00567 0.00000 -0.00244 0.00000 -0.01262
149 4 H 1S -0.00409 0.00708 -0.00944 -0.01634 0.00265
150 2S -0.13529 0.23433 -0.03424 -0.05930 0.18922
151 3S 0.07005 -0.12133 0.04380 0.07586 -2.85341
152 4S 0.31825 -0.55123 0.11340 0.19641 -0.00105
153 5PX -0.00674 -0.02661 -0.00232 0.00643 0.05121
154 5PY 0.03440 0.00674 0.00911 -0.00232 0.02957
155 5PZ -0.03197 0.05537 -0.00926 -0.01604 0.00666
156 6PX 0.04951 0.23946 0.00618 -0.06848 -0.42092
157 6PY -0.29663 -0.04951 -0.07561 0.00618 -0.24302
158 6PZ 0.26872 -0.46545 0.09159 0.15864 -0.05606
159 7PX -0.33327 -0.10055 0.01388 0.12489 -1.08970
160 7PY 0.48538 0.33327 0.10886 0.01388 -0.62914
161 7PZ -0.59378 1.02846 -0.31809 -0.55094 0.09887
162 8D 0 -0.02361 0.04090 -0.00127 -0.00220 -0.03616
163 8D+1 0.01562 -0.01839 0.01310 0.03208 0.00873
164 8D-1 0.00036 -0.01562 0.01695 0.01310 0.00504
165 8D+2 0.02746 0.01636 -0.00022 0.00215 0.02074
166 8D-2 -0.01636 -0.00857 0.00215 0.00227 0.03593
167 9D 0 0.25176 -0.43606 0.06921 0.11988 0.46796
168 9D+1 -0.16407 0.22040 -0.15076 -0.34282 -0.06723
169 9D-1 -0.03095 0.16407 -0.16874 -0.15076 -0.03881
170 9D+2 -0.31641 -0.16629 -0.00580 -0.01349 -0.27686
171 9D-2 0.16629 0.12439 -0.01349 -0.02138 -0.47954
172 10F 0 0.00489 -0.00847 0.00353 0.00611 -0.00015
173 10F+1 -0.00846 0.01212 0.01313 0.01331 0.00299
174 10F-1 -0.00235 0.00846 -0.00185 0.01313 0.00173
175 10F+2 0.00865 0.00531 0.00035 0.00531 -0.00373
176 10F-2 -0.00531 -0.00252 0.00531 0.00648 -0.00647
177 10F+3 0.01058 0.00611 0.00339 -0.00196 0.00000
178 10F-3 -0.00284 0.00491 0.00122 0.00211 -0.01262
179 5 H 1S -0.00409 -0.00708 -0.00944 0.01634 0.00265
180 2S -0.13529 -0.23433 -0.03424 0.05930 0.18922
181 3S 0.07005 0.12133 0.04380 -0.07586 -2.85341
182 4S 0.31825 0.55123 0.11340 -0.19641 -0.00105
183 5PX 0.00674 -0.02661 0.00232 0.00643 -0.05121
184 5PY 0.03440 -0.00674 0.00911 0.00232 0.02957
185 5PZ -0.03197 -0.05537 -0.00926 0.01604 0.00666
186 6PX -0.04951 0.23946 -0.00618 -0.06848 0.42092
187 6PY -0.29663 0.04951 -0.07561 -0.00618 -0.24302
188 6PZ 0.26872 0.46545 0.09159 -0.15864 -0.05606
189 7PX 0.33327 -0.10055 -0.01388 0.12489 1.08970
190 7PY 0.48538 -0.33327 0.10886 -0.01388 -0.62914
191 7PZ -0.59378 -1.02846 -0.31809 0.55094 0.09887
192 8D 0 -0.02361 -0.04090 -0.00127 0.00220 -0.03616
193 8D+1 -0.01562 -0.01839 -0.01310 0.03208 -0.00873
194 8D-1 0.00036 0.01562 0.01695 -0.01310 0.00504
195 8D+2 0.02746 -0.01636 -0.00022 -0.00215 0.02074
196 8D-2 0.01636 -0.00857 -0.00215 0.00227 -0.03593
197 9D 0 0.25176 0.43606 0.06921 -0.11988 0.46796
198 9D+1 0.16407 0.22040 0.15076 -0.34282 0.06723
199 9D-1 -0.03095 -0.16407 -0.16874 0.15076 -0.03881
200 9D+2 -0.31641 0.16629 -0.00580 0.01349 -0.27686
201 9D-2 -0.16629 0.12439 0.01349 -0.02138 0.47954
202 10F 0 0.00489 0.00847 0.00353 -0.00611 -0.00015
203 10F+1 0.00846 0.01212 -0.01313 0.01331 -0.00299
204 10F-1 -0.00235 -0.00846 -0.00185 -0.01313 0.00173
205 10F+2 0.00865 -0.00531 0.00035 -0.00531 -0.00373
206 10F-2 0.00531 -0.00252 -0.00531 0.00648 0.00647
207 10F+3 -0.01058 0.00611 -0.00339 -0.00196 0.00000
208 10F-3 -0.00284 -0.00491 0.00122 -0.00211 -0.01262
209 6 H 1S -0.00818 0.00000 0.01887 0.00000 0.00265
210 2S -0.27058 0.00000 0.06848 0.00000 0.18922
211 3S 0.14010 0.00000 -0.08760 0.00000 -2.85341
212 4S 0.63651 0.00000 -0.22679 0.00000 -0.00105
213 5PX 0.00000 -0.03829 0.00000 -0.01044 0.00000
214 5PY 0.02272 0.00000 -0.00510 0.00000 0.05913
215 5PZ 0.06394 0.00000 -0.01852 0.00000 -0.00666
216 6PX 0.00000 0.32522 0.00000 0.07918 0.00000
217 6PY -0.21087 0.00000 0.06492 0.00000 -0.48604
218 6PZ -0.53745 0.00000 0.18318 0.00000 0.05606
219 7PX 0.00000 -0.67780 0.00000 -0.10085 0.00000
220 7PY -0.09186 0.00000 -0.13290 0.00000 -1.25827
221 7PZ 1.18757 0.00000 -0.63617 0.00000 -0.09887
222 8D 0 -0.04722 0.00000 0.00254 0.00000 -0.03616
223 8D+1 0.00000 -0.00866 0.00000 0.00939 0.00000
224 8D-1 -0.02741 0.00000 0.03964 0.00000 -0.01008
225 8D+2 0.00087 0.00000 0.00351 0.00000 -0.04149
226 8D-2 0.00000 0.03690 0.00000 -0.00146 0.00000
227 9D 0 0.50352 0.00000 -0.13843 0.00000 0.46796
228 9D+1 0.00000 0.06378 0.00000 -0.08170 0.00000
229 9D-1 0.31512 0.00000 -0.42987 0.00000 0.07762
230 9D+2 0.02838 0.00000 -0.02917 0.00000 0.55372
231 9D-2 0.00000 -0.41242 0.00000 0.00199 0.00000
232 10F 0 -0.00978 0.00000 0.00705 0.00000 0.00015
233 10F+1 0.00000 -0.00253 0.00000 0.00943 0.00000
234 10F-1 -0.01700 0.00000 -0.02089 0.00000 0.00345
235 10F+2 -0.00054 0.00000 -0.00954 0.00000 -0.00747
236 10F-2 0.00000 -0.01172 0.00000 0.00272 0.00000
237 10F+3 0.00000 -0.01222 0.00000 -0.00392 0.00000
238 10F-3 0.00567 0.00000 0.00244 0.00000 0.01262
239 7 H 1S 0.00409 0.00708 -0.00944 0.01634 0.00265
240 2S 0.13529 0.23433 -0.03424 0.05930 0.18922
241 3S -0.07005 -0.12133 0.04380 -0.07586 -2.85341
242 4S -0.31825 -0.55123 0.11340 -0.19641 -0.00105
243 5PX 0.00674 -0.02661 -0.00232 -0.00643 0.05121
244 5PY 0.03440 -0.00674 -0.00911 -0.00232 -0.02957
245 5PZ -0.03197 -0.05537 0.00926 -0.01604 -0.00666
246 6PX -0.04951 0.23946 0.00618 0.06848 -0.42092
247 6PY -0.29663 0.04951 0.07561 0.00618 0.24302
248 6PZ 0.26872 0.46545 -0.09159 0.15864 0.05606
249 7PX 0.33327 -0.10055 0.01388 -0.12489 -1.08970
250 7PY 0.48538 -0.33327 -0.10886 0.01388 0.62914
251 7PZ -0.59378 -1.02846 0.31809 -0.55094 -0.09887
252 8D 0 0.02361 0.04090 -0.00127 0.00220 -0.03616
253 8D+1 0.01562 0.01839 -0.01310 0.03208 -0.00873
254 8D-1 -0.00036 -0.01562 0.01695 -0.01310 0.00504
255 8D+2 -0.02746 0.01636 -0.00022 -0.00215 0.02074
256 8D-2 -0.01636 0.00857 -0.00215 0.00227 -0.03593
257 9D 0 -0.25176 -0.43606 0.06921 -0.11988 0.46796
258 9D+1 -0.16407 -0.22040 0.15076 -0.34282 0.06723
259 9D-1 0.03095 0.16407 -0.16874 0.15076 -0.03881
260 9D+2 0.31641 -0.16629 -0.00580 0.01349 -0.27686
261 9D-2 0.16629 -0.12439 0.01349 -0.02138 0.47954
262 10F 0 0.00489 0.00847 -0.00353 0.00611 0.00015
263 10F+1 0.00846 0.01212 0.01313 -0.01331 0.00299
264 10F-1 -0.00235 -0.00846 0.00185 0.01313 -0.00173
265 10F+2 0.00865 -0.00531 -0.00035 0.00531 0.00373
266 10F-2 0.00531 -0.00252 0.00531 -0.00648 -0.00647
267 10F+3 -0.01058 0.00611 0.00339 0.00196 0.00000
268 10F-3 -0.00284 -0.00491 -0.00122 0.00211 0.01262
269 8 H 1S 0.00409 -0.00708 -0.00944 -0.01634 0.00265
270 2S 0.13529 -0.23433 -0.03424 -0.05930 0.18922
271 3S -0.07005 0.12133 0.04380 0.07586 -2.85341
272 4S -0.31825 0.55123 0.11340 0.19641 -0.00105
273 5PX -0.00674 -0.02661 0.00232 -0.00643 -0.05121
274 5PY 0.03440 0.00674 -0.00911 0.00232 -0.02957
275 5PZ -0.03197 0.05537 0.00926 0.01604 -0.00666
276 6PX 0.04951 0.23946 -0.00618 0.06848 0.42092
277 6PY -0.29663 -0.04951 0.07561 -0.00618 0.24302
278 6PZ 0.26872 -0.46545 -0.09159 -0.15864 0.05606
279 7PX -0.33327 -0.10055 -0.01388 -0.12489 1.08970
280 7PY 0.48538 0.33327 -0.10886 -0.01388 0.62914
281 7PZ -0.59378 1.02846 0.31809 0.55094 -0.09887
282 8D 0 0.02361 -0.04090 -0.00127 -0.00220 -0.03616
283 8D+1 -0.01562 0.01839 0.01310 0.03208 0.00873
284 8D-1 -0.00036 0.01562 0.01695 0.01310 0.00504
285 8D+2 -0.02746 -0.01636 -0.00022 0.00215 0.02074
286 8D-2 0.01636 0.00857 0.00215 0.00227 0.03593
287 9D 0 -0.25176 0.43606 0.06921 0.11988 0.46796
288 9D+1 0.16407 -0.22040 -0.15076 -0.34282 -0.06723
289 9D-1 0.03095 -0.16407 -0.16874 -0.15076 -0.03881
290 9D+2 0.31641 0.16629 -0.00580 -0.01349 -0.27686
291 9D-2 -0.16629 -0.12439 -0.01349 -0.02138 -0.47954
292 10F 0 0.00489 -0.00847 -0.00353 -0.00611 0.00015
293 10F+1 -0.00846 0.01212 -0.01313 -0.01331 -0.00299
294 10F-1 -0.00235 0.00846 0.00185 -0.01313 -0.00173
295 10F+2 0.00865 0.00531 -0.00035 -0.00531 0.00373
296 10F-2 -0.00531 -0.00252 -0.00531 -0.00648 0.00647
297 10F+3 0.01058 0.00611 -0.00339 0.00196 0.00000
298 10F-3 -0.00284 0.00491 -0.00122 -0.00211 0.01262
176 177 178 179 180
(EG)--V (EG)--V (A2U)--V (EU)--V (EU)--V
Eigenvalues -- 3.47831 3.47831 3.50078 3.50836 3.50836
1 1 Si 1S 0.00000 0.00000 0.04402 0.00000 0.00000
2 2S 0.00000 0.00000 -0.01393 0.00000 0.00000
3 3S 0.00000 0.00000 0.54948 0.00000 0.00000
4 4S 0.00000 0.00000 2.23625 0.00000 0.00000
5 5S 0.00000 0.00000 0.35694 0.00000 0.00000
6 6S 0.00000 0.00000 -4.26379 0.00000 0.00000
7 7PX -0.04457 0.00000 0.00000 0.00000 -0.06077
8 7PY 0.00000 -0.04457 0.00000 -0.06077 0.00000
9 7PZ 0.00000 0.00000 0.06441 0.00000 0.00000
10 8PX -0.07136 0.00000 0.00000 0.00000 -0.08396
11 8PY 0.00000 -0.07136 0.00000 -0.08396 0.00000
12 8PZ 0.00000 0.00000 0.12930 0.00000 0.00000
13 9PX 0.37573 0.00000 0.00000 0.00000 0.41569
14 9PY 0.00000 0.37573 0.00000 0.41569 0.00000
15 9PZ 0.00000 0.00000 -0.41202 0.00000 0.00000
16 10PX -1.25195 0.00000 0.00000 0.00000 -0.79750
17 10PY 0.00000 -1.25195 0.00000 -0.79750 0.00000
18 10PZ 0.00000 0.00000 6.93115 0.00000 0.00000
19 11PX 0.09603 0.00000 0.00000 0.00000 0.12979
20 11PY 0.00000 0.09603 0.00000 0.12979 0.00000
21 11PZ 0.00000 0.00000 1.23378 0.00000 0.00000
22 12D 0 0.00000 0.00000 -2.16506 0.00000 0.00000
23 12D+1 0.15343 0.00000 0.00000 0.00000 -0.22145
24 12D-1 0.00000 0.15343 0.00000 -0.22145 0.00000
25 12D+2 0.00000 0.49639 0.00000 0.51020 0.00000
26 12D-2 0.49639 0.00000 0.00000 0.00000 0.51020
27 13D 0 0.00000 0.00000 -3.79689 0.00000 0.00000
28 13D+1 0.07663 0.00000 0.00000 0.00000 0.15631
29 13D-1 0.00000 0.07663 0.00000 0.15631 0.00000
30 13D+2 0.00000 2.24992 0.00000 1.89660 0.00000
31 13D-2 2.24992 0.00000 0.00000 0.00000 1.89660
32 14D 0 0.00000 0.00000 0.82170 0.00000 0.00000
33 14D+1 0.08524 0.00000 0.00000 0.00000 0.04607
34 14D-1 0.00000 0.08524 0.00000 0.04607 0.00000
35 14D+2 0.00000 -0.51076 0.00000 -0.39854 0.00000
36 14D-2 -0.51076 0.00000 0.00000 0.00000 -0.39854
37 15F 0 0.00000 0.00000 0.91571 0.00000 0.00000
38 15F+1 0.26111 0.00000 0.00000 0.00000 0.23926
39 15F-1 0.00000 0.26111 0.00000 0.23926 0.00000
40 15F+2 0.00000 0.55378 0.00000 0.72691 0.00000
41 15F-2 0.55378 0.00000 0.00000 0.00000 0.72691
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 -0.55211 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.36679 0.00000 0.00000
45 16F+1 0.37114 0.00000 0.00000 0.00000 0.20414
46 16F-1 0.00000 0.37114 0.00000 0.20414 0.00000
47 16F+2 0.00000 0.34760 0.00000 0.45374 0.00000
48 16F-2 0.34760 0.00000 0.00000 0.00000 0.45374
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 -0.58831 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.05301 0.00000 0.00000
52 17G+1 0.06807 0.00000 0.00000 0.00000 0.20075
53 17G-1 0.00000 0.06807 0.00000 0.20075 0.00000
54 17G+2 0.00000 -0.23808 0.00000 -0.43906 0.00000
55 17G-2 -0.23808 0.00000 0.00000 0.00000 -0.43906
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.19532 0.00000 0.00000
58 17G+4 0.00000 0.06529 0.00000 0.25998 0.00000
59 17G-4 -0.06529 0.00000 0.00000 0.00000 -0.25998
60 2 Si 1S 0.00000 0.00000 -0.04402 0.00000 0.00000
61 2S 0.00000 0.00000 0.01393 0.00000 0.00000
62 3S 0.00000 0.00000 -0.54948 0.00000 0.00000
63 4S 0.00000 0.00000 -2.23625 0.00000 0.00000
64 5S 0.00000 0.00000 -0.35694 0.00000 0.00000
65 6S 0.00000 0.00000 4.26379 0.00000 0.00000
66 7PX 0.04457 0.00000 0.00000 0.00000 -0.06077
67 7PY 0.00000 0.04457 0.00000 -0.06077 0.00000
68 7PZ 0.00000 0.00000 0.06441 0.00000 0.00000
69 8PX 0.07136 0.00000 0.00000 0.00000 -0.08396
70 8PY 0.00000 0.07136 0.00000 -0.08396 0.00000
71 8PZ 0.00000 0.00000 0.12930 0.00000 0.00000
72 9PX -0.37573 0.00000 0.00000 0.00000 0.41569
73 9PY 0.00000 -0.37573 0.00000 0.41569 0.00000
74 9PZ 0.00000 0.00000 -0.41202 0.00000 0.00000
75 10PX 1.25195 0.00000 0.00000 0.00000 -0.79750
76 10PY 0.00000 1.25195 0.00000 -0.79750 0.00000
77 10PZ 0.00000 0.00000 6.93115 0.00000 0.00000
78 11PX -0.09603 0.00000 0.00000 0.00000 0.12979
79 11PY 0.00000 -0.09603 0.00000 0.12979 0.00000
80 11PZ 0.00000 0.00000 1.23378 0.00000 0.00000
81 12D 0 0.00000 0.00000 2.16506 0.00000 0.00000
82 12D+1 0.15343 0.00000 0.00000 0.00000 0.22145
83 12D-1 0.00000 0.15343 0.00000 0.22145 0.00000
84 12D+2 0.00000 0.49639 0.00000 -0.51020 0.00000
85 12D-2 0.49639 0.00000 0.00000 0.00000 -0.51020
86 13D 0 0.00000 0.00000 3.79689 0.00000 0.00000
87 13D+1 0.07663 0.00000 0.00000 0.00000 -0.15631
88 13D-1 0.00000 0.07663 0.00000 -0.15631 0.00000
89 13D+2 0.00000 2.24992 0.00000 -1.89660 0.00000
90 13D-2 2.24992 0.00000 0.00000 0.00000 -1.89660
91 14D 0 0.00000 0.00000 -0.82170 0.00000 0.00000
92 14D+1 0.08524 0.00000 0.00000 0.00000 -0.04607
93 14D-1 0.00000 0.08524 0.00000 -0.04607 0.00000
94 14D+2 0.00000 -0.51076 0.00000 0.39854 0.00000
95 14D-2 -0.51076 0.00000 0.00000 0.00000 0.39854
96 15F 0 0.00000 0.00000 0.91571 0.00000 0.00000
97 15F+1 -0.26111 0.00000 0.00000 0.00000 0.23926
98 15F-1 0.00000 -0.26111 0.00000 0.23926 0.00000
99 15F+2 0.00000 -0.55378 0.00000 0.72691 0.00000
100 15F-2 -0.55378 0.00000 0.00000 0.00000 0.72691
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 -0.55211 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.36679 0.00000 0.00000
104 16F+1 -0.37114 0.00000 0.00000 0.00000 0.20414
105 16F-1 0.00000 -0.37114 0.00000 0.20414 0.00000
106 16F+2 0.00000 -0.34760 0.00000 0.45374 0.00000
107 16F-2 -0.34760 0.00000 0.00000 0.00000 0.45374
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 -0.58831 0.00000 0.00000
110 17G 0 0.00000 0.00000 -0.05301 0.00000 0.00000
111 17G+1 0.06807 0.00000 0.00000 0.00000 -0.20075
112 17G-1 0.00000 0.06807 0.00000 -0.20075 0.00000
113 17G+2 0.00000 -0.23808 0.00000 0.43906 0.00000
114 17G-2 -0.23808 0.00000 0.00000 0.00000 0.43906
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 -0.19532 0.00000 0.00000
117 17G+4 0.00000 0.06529 0.00000 -0.25998 0.00000
118 17G-4 -0.06529 0.00000 0.00000 0.00000 0.25998
119 3 H 1S 0.00000 0.01869 -0.00440 0.02268 0.00000
120 2S 0.00000 0.35942 0.34688 0.40237 0.00000
121 3S 0.00000 1.44551 -2.47658 1.17166 0.00000
122 4S 0.00000 -0.18657 -0.11484 -0.25496 0.00000
123 5PX -0.00496 0.00000 0.00000 0.00000 0.00684
124 5PY 0.00000 0.06968 -0.00479 0.06752 0.00000
125 5PZ 0.00000 0.02675 -0.02247 0.04282 0.00000
126 6PX -0.00956 0.00000 0.00000 0.00000 -0.11434
127 6PY 0.00000 -0.59098 0.04645 -0.55952 0.00000
128 6PZ 0.00000 -0.24303 0.21769 -0.39230 0.00000
129 7PX -1.00510 0.00000 0.00000 0.00000 -0.99528
130 7PY 0.00000 0.23078 0.97262 0.30663 0.00000
131 7PZ 0.00000 -0.49501 0.84999 -0.03653 0.00000
132 8D 0 0.00000 -0.02778 0.01826 -0.00679 0.00000
133 8D+1 -0.01419 0.00000 0.00000 0.00000 -0.02493
134 8D-1 0.00000 -0.01717 0.05098 -0.01039 0.00000
135 8D+2 0.00000 -0.02917 -0.01215 -0.02993 0.00000
136 8D-2 -0.06736 0.00000 0.00000 0.00000 -0.06729
137 9D 0 0.00000 0.32579 -0.19125 0.11082 0.00000
138 9D+1 0.16626 0.00000 0.00000 0.00000 0.27299
139 9D-1 0.00000 0.25775 -0.63595 0.16419 0.00000
140 9D+2 0.00000 0.25275 0.16126 0.28798 0.00000
141 9D-2 0.84025 0.00000 0.00000 0.00000 0.83958
142 10F 0 0.00000 -0.00514 0.00013 -0.01515 0.00000
143 10F+1 -0.01007 0.00000 0.00000 0.00000 -0.00652
144 10F-1 0.00000 0.00991 -0.00342 -0.00428 0.00000
145 10F+2 0.00000 0.01452 -0.00474 0.01548 0.00000
146 10F-2 -0.01103 0.00000 0.00000 0.00000 -0.00326
147 10F+3 -0.01323 0.00000 0.00000 0.00000 -0.00723
148 10F-3 0.00000 0.00195 0.00987 0.00380 0.00000
149 4 H 1S -0.01619 -0.00934 -0.00440 -0.01134 -0.01964
150 2S -0.31127 -0.17971 0.34688 -0.20118 -0.34846
151 3S -1.25185 -0.72275 -2.47658 -0.58583 -1.01469
152 4S 0.16158 0.09329 -0.11484 0.12748 0.22080
153 5PX 0.05102 0.03232 0.00414 0.02628 0.05235
154 5PY 0.03232 0.01370 0.00239 0.02201 0.02628
155 5PZ -0.02317 -0.01337 -0.02247 -0.02141 -0.03709
156 6PX -0.44563 -0.25176 -0.04023 -0.19277 -0.44822
157 6PY -0.25176 -0.15491 -0.02323 -0.22563 -0.19277
158 6PZ 0.21047 0.12152 0.21769 0.19615 0.33974
159 7PX -0.07819 0.53515 -0.84232 0.56374 -0.01885
160 7PY 0.53515 -0.69613 -0.48631 -0.66980 0.56374
161 7PZ 0.42869 0.24750 0.84999 0.01826 0.03163
162 8D 0 0.02406 0.01389 0.01826 0.00340 0.00588
163 8D+1 -0.01642 -0.00129 -0.04415 0.00630 -0.01402
164 8D-1 -0.00129 -0.01493 -0.02549 -0.02129 0.00630
165 8D+2 0.01654 -0.05782 0.00607 -0.05795 0.01618
166 8D-2 -0.03872 0.01654 0.01052 0.01618 -0.03927
167 9D 0 -0.28214 -0.16289 -0.19125 -0.05541 -0.09597
168 9D+1 0.23487 0.03962 0.55075 -0.04711 0.19139
169 9D-1 0.03962 0.18913 0.31797 0.24579 -0.04711
170 9D+2 -0.25439 0.69337 -0.08063 0.70168 -0.23885
171 9D-2 0.39963 -0.25439 -0.13966 -0.23885 0.42588
172 10F 0 0.00445 0.00257 0.00013 0.00757 0.01312
173 10F+1 0.00491 0.00865 0.00297 0.00097 -0.00484
174 10F-1 0.00865 -0.00508 0.00171 -0.00596 0.00097
175 10F+2 0.01106 -0.00464 0.00237 0.00142 0.00811
176 10F-2 0.00814 0.01106 0.00411 0.00811 0.01079
177 10F+3 0.00661 -0.01145 0.00000 -0.00626 0.00361
178 10F-3 -0.00169 -0.00098 0.00987 -0.00190 -0.00329
179 5 H 1S 0.01619 -0.00934 -0.00440 -0.01134 0.01964
180 2S 0.31127 -0.17971 0.34688 -0.20118 0.34846
181 3S 1.25185 -0.72275 -2.47658 -0.58583 1.01469
182 4S -0.16158 0.09329 -0.11484 0.12748 -0.22080
183 5PX 0.05102 -0.03232 -0.00414 -0.02628 0.05235
184 5PY -0.03232 0.01370 0.00239 0.02201 -0.02628
185 5PZ 0.02317 -0.01337 -0.02247 -0.02141 0.03709
186 6PX -0.44563 0.25176 0.04023 0.19277 -0.44822
187 6PY 0.25176 -0.15491 -0.02323 -0.22563 0.19277
188 6PZ -0.21047 0.12152 0.21769 0.19615 -0.33974
189 7PX -0.07819 -0.53515 0.84232 -0.56374 -0.01885
190 7PY -0.53515 -0.69613 -0.48631 -0.66980 -0.56374
191 7PZ -0.42869 0.24750 0.84999 0.01826 -0.03163
192 8D 0 -0.02406 0.01389 0.01826 0.00340 -0.00588
193 8D+1 -0.01642 0.00129 0.04415 -0.00630 -0.01402
194 8D-1 0.00129 -0.01493 -0.02549 -0.02129 -0.00630
195 8D+2 -0.01654 -0.05782 0.00607 -0.05795 -0.01618
196 8D-2 -0.03872 -0.01654 -0.01052 -0.01618 -0.03927
197 9D 0 0.28214 -0.16289 -0.19125 -0.05541 0.09597
198 9D+1 0.23487 -0.03962 -0.55075 0.04711 0.19139
199 9D-1 -0.03962 0.18913 0.31797 0.24579 0.04711
200 9D+2 0.25439 0.69337 -0.08063 0.70168 0.23885
201 9D-2 0.39963 0.25439 0.13966 0.23885 0.42588
202 10F 0 -0.00445 0.00257 0.00013 0.00757 -0.01312
203 10F+1 0.00491 -0.00865 -0.00297 -0.00097 -0.00484
204 10F-1 -0.00865 -0.00508 0.00171 -0.00596 -0.00097
205 10F+2 -0.01106 -0.00464 0.00237 0.00142 -0.00811
206 10F-2 0.00814 -0.01106 -0.00411 -0.00811 0.01079
207 10F+3 0.00661 0.01145 0.00000 0.00626 0.00361
208 10F-3 0.00169 -0.00098 0.00987 -0.00190 0.00329
209 6 H 1S 0.00000 0.01869 0.00440 -0.02268 0.00000
210 2S 0.00000 0.35942 -0.34688 -0.40237 0.00000
211 3S 0.00000 1.44551 2.47658 -1.17166 0.00000
212 4S 0.00000 -0.18657 0.11484 0.25496 0.00000
213 5PX 0.00496 0.00000 0.00000 0.00000 0.00684
214 5PY 0.00000 -0.06968 -0.00479 0.06752 0.00000
215 5PZ 0.00000 -0.02675 -0.02247 0.04282 0.00000
216 6PX 0.00956 0.00000 0.00000 0.00000 -0.11434
217 6PY 0.00000 0.59098 0.04645 -0.55952 0.00000
218 6PZ 0.00000 0.24303 0.21769 -0.39230 0.00000
219 7PX 1.00510 0.00000 0.00000 0.00000 -0.99528
220 7PY 0.00000 -0.23078 0.97262 0.30663 0.00000
221 7PZ 0.00000 0.49501 0.84999 -0.03653 0.00000
222 8D 0 0.00000 -0.02778 -0.01826 0.00679 0.00000
223 8D+1 -0.01419 0.00000 0.00000 0.00000 0.02493
224 8D-1 0.00000 -0.01717 -0.05098 0.01039 0.00000
225 8D+2 0.00000 -0.02917 0.01215 0.02993 0.00000
226 8D-2 -0.06736 0.00000 0.00000 0.00000 0.06729
227 9D 0 0.00000 0.32579 0.19125 -0.11082 0.00000
228 9D+1 0.16626 0.00000 0.00000 0.00000 -0.27299
229 9D-1 0.00000 0.25775 0.63595 -0.16419 0.00000
230 9D+2 0.00000 0.25275 -0.16126 -0.28798 0.00000
231 9D-2 0.84025 0.00000 0.00000 0.00000 -0.83958
232 10F 0 0.00000 0.00514 0.00013 -0.01515 0.00000
233 10F+1 0.01007 0.00000 0.00000 0.00000 -0.00652
234 10F-1 0.00000 -0.00991 -0.00342 -0.00428 0.00000
235 10F+2 0.00000 -0.01452 -0.00474 0.01548 0.00000
236 10F-2 0.01103 0.00000 0.00000 0.00000 -0.00326
237 10F+3 0.01323 0.00000 0.00000 0.00000 -0.00723
238 10F-3 0.00000 -0.00195 0.00987 0.00380 0.00000
239 7 H 1S 0.01619 -0.00934 0.00440 0.01134 -0.01964
240 2S 0.31127 -0.17971 -0.34688 0.20118 -0.34846
241 3S 1.25185 -0.72275 2.47658 0.58583 -1.01469
242 4S -0.16158 0.09329 0.11484 -0.12748 0.22080
243 5PX -0.05102 0.03232 -0.00414 -0.02628 0.05235
244 5PY 0.03232 -0.01370 0.00239 0.02201 -0.02628
245 5PZ -0.02317 0.01337 -0.02247 -0.02141 0.03709
246 6PX 0.44563 -0.25176 0.04023 0.19277 -0.44822
247 6PY -0.25176 0.15491 -0.02323 -0.22563 0.19277
248 6PZ 0.21047 -0.12152 0.21769 0.19615 -0.33974
249 7PX 0.07819 0.53515 0.84232 -0.56374 -0.01885
250 7PY 0.53515 0.69613 -0.48631 -0.66980 -0.56374
251 7PZ 0.42869 -0.24750 0.84999 0.01826 -0.03163
252 8D 0 -0.02406 0.01389 -0.01826 -0.00340 0.00588
253 8D+1 -0.01642 0.00129 -0.04415 0.00630 0.01402
254 8D-1 0.00129 -0.01493 0.02549 0.02129 0.00630
255 8D+2 -0.01654 -0.05782 -0.00607 0.05795 0.01618
256 8D-2 -0.03872 -0.01654 0.01052 0.01618 0.03927
257 9D 0 0.28214 -0.16289 0.19125 0.05541 -0.09597
258 9D+1 0.23487 -0.03962 0.55075 -0.04711 -0.19139
259 9D-1 -0.03962 0.18913 -0.31797 -0.24579 -0.04711
260 9D+2 0.25439 0.69337 0.08063 -0.70168 -0.23885
261 9D-2 0.39963 0.25439 -0.13966 -0.23885 -0.42588
262 10F 0 0.00445 -0.00257 0.00013 0.00757 -0.01312
263 10F+1 -0.00491 0.00865 -0.00297 -0.00097 -0.00484
264 10F-1 0.00865 0.00508 0.00171 -0.00596 -0.00097
265 10F+2 0.01106 0.00464 0.00237 0.00142 -0.00811
266 10F-2 -0.00814 0.01106 -0.00411 -0.00811 0.01079
267 10F+3 -0.00661 -0.01145 0.00000 0.00626 0.00361
268 10F-3 -0.00169 0.00098 0.00987 -0.00190 0.00329
269 8 H 1S -0.01619 -0.00934 0.00440 0.01134 0.01964
270 2S -0.31127 -0.17971 -0.34688 0.20118 0.34846
271 3S -1.25185 -0.72275 2.47658 0.58583 1.01469
272 4S 0.16158 0.09329 0.11484 -0.12748 -0.22080
273 5PX -0.05102 -0.03232 0.00414 0.02628 0.05235
274 5PY -0.03232 -0.01370 0.00239 0.02201 0.02628
275 5PZ 0.02317 0.01337 -0.02247 -0.02141 -0.03709
276 6PX 0.44563 0.25176 -0.04023 -0.19277 -0.44822
277 6PY 0.25176 0.15491 -0.02323 -0.22563 -0.19277
278 6PZ -0.21047 -0.12152 0.21769 0.19615 0.33974
279 7PX 0.07819 -0.53515 -0.84232 0.56374 -0.01885
280 7PY -0.53515 0.69613 -0.48631 -0.66980 0.56374
281 7PZ -0.42869 -0.24750 0.84999 0.01826 0.03163
282 8D 0 0.02406 0.01389 -0.01826 -0.00340 -0.00588
283 8D+1 -0.01642 -0.00129 0.04415 -0.00630 0.01402
284 8D-1 -0.00129 -0.01493 0.02549 0.02129 -0.00630
285 8D+2 0.01654 -0.05782 -0.00607 0.05795 -0.01618
286 8D-2 -0.03872 0.01654 -0.01052 -0.01618 0.03927
287 9D 0 -0.28214 -0.16289 0.19125 0.05541 0.09597
288 9D+1 0.23487 0.03962 -0.55075 0.04711 -0.19139
289 9D-1 0.03962 0.18913 -0.31797 -0.24579 0.04711
290 9D+2 -0.25439 0.69337 0.08063 -0.70168 0.23885
291 9D-2 0.39963 -0.25439 0.13966 0.23885 -0.42588
292 10F 0 -0.00445 -0.00257 0.00013 0.00757 0.01312
293 10F+1 -0.00491 -0.00865 0.00297 0.00097 -0.00484
294 10F-1 -0.00865 0.00508 0.00171 -0.00596 0.00097
295 10F+2 -0.01106 0.00464 0.00237 0.00142 0.00811
296 10F-2 -0.00814 -0.01106 0.00411 0.00811 0.01079
297 10F+3 -0.00661 0.01145 0.00000 -0.00626 0.00361
298 10F-3 0.00169 0.00098 0.00987 -0.00190 -0.00329
181 182 183 184 185
(A2U)--V (EU)--V (EU)--V (A1G)--V (EG)--V
Eigenvalues -- 3.63230 3.64999 3.64999 3.68318 3.74094
1 1 Si 1S 0.02756 0.00000 0.00000 -0.02255 0.00000
2 2S 0.05682 0.00000 0.00000 -0.09903 0.00000
3 3S 0.40999 0.00000 0.00000 -0.41253 0.00000
4 4S 0.51232 0.00000 0.00000 -4.02144 0.00000
5 5S 3.73284 0.00000 0.00000 7.06508 0.00000
6 6S 1.13666 0.00000 0.00000 -1.34315 0.00000
7 7PX 0.00000 -0.09431 0.00000 0.00000 -0.17201
8 7PY 0.00000 0.00000 0.09431 0.00000 0.00000
9 7PZ -0.11388 0.00000 0.00000 0.08171 0.00000
10 8PX 0.00000 0.03381 0.00000 0.00000 0.01888
11 8PY 0.00000 0.00000 -0.03381 0.00000 0.00000
12 8PZ -0.06642 0.00000 0.00000 0.11099 0.00000
13 9PX 0.00000 1.20020 0.00000 0.00000 1.86121
14 9PY 0.00000 0.00000 -1.20020 0.00000 0.00000
15 9PZ 0.90999 0.00000 0.00000 -0.66364 0.00000
16 10PX 0.00000 1.09045 0.00000 0.00000 2.40333
17 10PY 0.00000 0.00000 -1.09045 0.00000 0.00000
18 10PZ 0.47411 0.00000 0.00000 1.48113 0.00000
19 11PX 0.00000 0.31343 0.00000 0.00000 0.13817
20 11PY 0.00000 0.00000 -0.31343 0.00000 0.00000
21 11PZ 0.16833 0.00000 0.00000 0.06035 0.00000
22 12D 0 0.10971 0.00000 0.00000 -0.93166 0.00000
23 12D+1 0.00000 0.10809 0.00000 0.00000 0.02919
24 12D-1 0.00000 0.00000 -0.10809 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.53693 0.00000 0.00000
26 12D-2 0.00000 -0.53693 0.00000 0.00000 -0.37025
27 13D 0 0.79878 0.00000 0.00000 -1.13356 0.00000
28 13D+1 0.00000 -0.85704 0.00000 0.00000 0.59363
29 13D-1 0.00000 0.00000 0.85704 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.32848 0.00000 0.00000
31 13D-2 0.00000 -0.32848 0.00000 0.00000 -1.21112
32 14D 0 -0.46766 0.00000 0.00000 0.44298 0.00000
33 14D+1 0.00000 0.46571 0.00000 0.00000 0.34747
34 14D-1 0.00000 0.00000 -0.46571 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.40353 0.00000 0.00000
36 14D-2 0.00000 -0.40353 0.00000 0.00000 -0.45510
37 15F 0 -0.23751 0.00000 0.00000 -0.24234 0.00000
38 15F+1 0.00000 -0.59961 0.00000 0.00000 -0.16381
39 15F-1 0.00000 0.00000 0.59961 0.00000 0.00000
40 15F+2 0.00000 0.00000 -0.78649 0.00000 0.00000
41 15F-2 0.00000 0.78649 0.00000 0.00000 0.10863
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.31817 0.00000 0.00000 -1.44074 0.00000
44 16F 0 0.02722 0.00000 0.00000 -0.53390 0.00000
45 16F+1 0.00000 -0.39485 0.00000 0.00000 -0.40169
46 16F-1 0.00000 0.00000 0.39485 0.00000 0.00000
47 16F+2 0.00000 0.00000 -0.12431 0.00000 0.00000
48 16F-2 0.00000 0.12431 0.00000 0.00000 -0.28111
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.33119 0.00000 0.00000 -0.61210 0.00000
51 17G 0 -0.31204 0.00000 0.00000 -0.05171 0.00000
52 17G+1 0.00000 0.17600 0.00000 0.00000 0.38482
53 17G-1 0.00000 0.00000 -0.17600 0.00000 0.00000
54 17G+2 0.00000 0.00000 -0.72199 0.00000 0.00000
55 17G-2 0.00000 0.72199 0.00000 0.00000 0.22319
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.41772 0.00000 0.00000 -0.88980 0.00000
58 17G+4 0.00000 0.00000 -0.00350 0.00000 0.00000
59 17G-4 0.00000 -0.00350 0.00000 0.00000 0.11691
60 2 Si 1S -0.02756 0.00000 0.00000 -0.02255 0.00000
61 2S -0.05682 0.00000 0.00000 -0.09903 0.00000
62 3S -0.40999 0.00000 0.00000 -0.41253 0.00000
63 4S -0.51232 0.00000 0.00000 -4.02144 0.00000
64 5S -3.73284 0.00000 0.00000 7.06508 0.00000
65 6S -1.13666 0.00000 0.00000 -1.34315 0.00000
66 7PX 0.00000 -0.09431 0.00000 0.00000 0.17201
67 7PY 0.00000 0.00000 0.09431 0.00000 0.00000
68 7PZ -0.11388 0.00000 0.00000 -0.08171 0.00000
69 8PX 0.00000 0.03381 0.00000 0.00000 -0.01888
70 8PY 0.00000 0.00000 -0.03381 0.00000 0.00000
71 8PZ -0.06642 0.00000 0.00000 -0.11099 0.00000
72 9PX 0.00000 1.20020 0.00000 0.00000 -1.86121
73 9PY 0.00000 0.00000 -1.20020 0.00000 0.00000
74 9PZ 0.90999 0.00000 0.00000 0.66364 0.00000
75 10PX 0.00000 1.09045 0.00000 0.00000 -2.40333
76 10PY 0.00000 0.00000 -1.09045 0.00000 0.00000
77 10PZ 0.47411 0.00000 0.00000 -1.48113 0.00000
78 11PX 0.00000 0.31343 0.00000 0.00000 -0.13817
79 11PY 0.00000 0.00000 -0.31343 0.00000 0.00000
80 11PZ 0.16833 0.00000 0.00000 -0.06035 0.00000
81 12D 0 -0.10971 0.00000 0.00000 -0.93166 0.00000
82 12D+1 0.00000 -0.10809 0.00000 0.00000 0.02919
83 12D-1 0.00000 0.00000 0.10809 0.00000 0.00000
84 12D+2 0.00000 0.00000 -0.53693 0.00000 0.00000
85 12D-2 0.00000 0.53693 0.00000 0.00000 -0.37025
86 13D 0 -0.79878 0.00000 0.00000 -1.13356 0.00000
87 13D+1 0.00000 0.85704 0.00000 0.00000 0.59363
88 13D-1 0.00000 0.00000 -0.85704 0.00000 0.00000
89 13D+2 0.00000 0.00000 -0.32848 0.00000 0.00000
90 13D-2 0.00000 0.32848 0.00000 0.00000 -1.21112
91 14D 0 0.46766 0.00000 0.00000 0.44298 0.00000
92 14D+1 0.00000 -0.46571 0.00000 0.00000 0.34747
93 14D-1 0.00000 0.00000 0.46571 0.00000 0.00000
94 14D+2 0.00000 0.00000 -0.40353 0.00000 0.00000
95 14D-2 0.00000 0.40353 0.00000 0.00000 -0.45510
96 15F 0 -0.23751 0.00000 0.00000 0.24234 0.00000
97 15F+1 0.00000 -0.59961 0.00000 0.00000 0.16381
98 15F-1 0.00000 0.00000 0.59961 0.00000 0.00000
99 15F+2 0.00000 0.00000 -0.78649 0.00000 0.00000
100 15F-2 0.00000 0.78649 0.00000 0.00000 -0.10863
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.31817 0.00000 0.00000 1.44074 0.00000
103 16F 0 0.02722 0.00000 0.00000 0.53390 0.00000
104 16F+1 0.00000 -0.39485 0.00000 0.00000 0.40169
105 16F-1 0.00000 0.00000 0.39485 0.00000 0.00000
106 16F+2 0.00000 0.00000 -0.12431 0.00000 0.00000
107 16F-2 0.00000 0.12431 0.00000 0.00000 0.28111
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.33119 0.00000 0.00000 0.61210 0.00000
110 17G 0 0.31204 0.00000 0.00000 -0.05171 0.00000
111 17G+1 0.00000 -0.17600 0.00000 0.00000 0.38482
112 17G-1 0.00000 0.00000 0.17600 0.00000 0.00000
113 17G+2 0.00000 0.00000 0.72199 0.00000 0.00000
114 17G-2 0.00000 -0.72199 0.00000 0.00000 0.22319
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 -0.41772 0.00000 0.00000 -0.88980 0.00000
117 17G+4 0.00000 0.00000 0.00350 0.00000 0.00000
118 17G-4 0.00000 0.00350 0.00000 0.00000 0.11691
119 3 H 1S 0.01356 0.00000 -0.00708 -0.02019 0.00000
120 2S 0.81890 0.00000 -0.66744 -0.77776 0.00000
121 3S -1.67275 0.00000 1.59688 -1.64707 0.00000
122 4S -0.53732 0.00000 0.68714 0.45249 0.00000
123 5PX 0.00000 0.00082 0.00000 0.00000 -0.01424
124 5PY 0.06373 0.00000 -0.03338 -0.10643 0.00000
125 5PZ 0.02197 0.00000 0.02806 -0.02764 0.00000
126 6PX 0.00000 -0.02176 0.00000 0.00000 0.10815
127 6PY -0.47359 0.00000 0.27537 0.82085 0.00000
128 6PZ -0.17891 0.00000 -0.28127 0.26302 0.00000
129 7PX 0.00000 -0.12320 0.00000 0.00000 -0.00889
130 7PY 1.51051 0.00000 -0.82470 -0.29837 0.00000
131 7PZ 0.07833 0.00000 -1.32683 0.13699 0.00000
132 8D 0 -0.03390 0.00000 -0.01359 0.02059 0.00000
133 8D+1 0.00000 0.01872 0.00000 0.00000 0.01039
134 8D-1 0.00858 0.00000 -0.08917 -0.01352 0.00000
135 8D+2 -0.03923 0.00000 0.02672 0.01791 0.00000
136 8D-2 0.00000 -0.01151 0.00000 0.00000 0.00811
137 9D 0 0.41214 0.00000 0.18022 -0.20583 0.00000
138 9D+1 0.00000 -0.20200 0.00000 0.00000 -0.13082
139 9D-1 -0.06261 0.00000 1.01472 0.08656 0.00000
140 9D+2 0.45226 0.00000 -0.21820 -0.11807 0.00000
141 9D-2 0.00000 0.12020 0.00000 0.00000 -0.09021
142 10F 0 -0.00222 0.00000 -0.01088 -0.00842 0.00000
143 10F+1 0.00000 -0.00826 0.00000 0.00000 0.00230
144 10F-1 0.01311 0.00000 -0.02161 -0.01947 0.00000
145 10F+2 0.01363 0.00000 -0.01998 -0.01344 0.00000
146 10F-2 0.00000 -0.01596 0.00000 0.00000 -0.00592
147 10F+3 0.00000 -0.01015 0.00000 0.00000 -0.00631
148 10F-3 -0.00412 0.00000 -0.01475 -0.00576 0.00000
149 4 H 1S 0.01356 -0.00613 0.00354 -0.02019 0.01131
150 2S 0.81890 -0.57802 0.33372 -0.77776 -0.76277
151 3S -1.67275 1.38294 -0.79844 -1.64707 3.23243
152 4S -0.53732 0.59508 -0.34357 0.45249 0.41158
153 5PX -0.05519 0.02524 -0.01410 0.09217 -0.00767
154 5PY -0.03186 0.01410 -0.00896 0.05321 0.00379
155 5PZ 0.02197 0.02430 -0.01403 -0.02764 0.00705
156 6PX 0.41014 -0.21197 0.10982 -0.71088 0.10780
157 6PY 0.23680 -0.10982 0.08516 -0.41043 -0.00020
158 6PZ -0.17891 -0.24359 0.14063 0.26302 -0.09437
159 7PX -1.30814 0.58772 -0.41045 0.25840 1.45561
160 7PY -0.75526 0.41045 -0.11378 0.14919 0.84553
161 7PZ 0.07833 -1.14907 0.66342 0.13699 -0.97961
162 8D 0 -0.03390 -0.01177 0.00679 0.02059 0.01064
163 8D+1 -0.00743 0.07156 -0.03050 0.01171 0.05523
164 8D-1 -0.00429 0.03050 -0.03634 0.00676 0.02589
165 8D+2 0.01961 -0.00659 0.01531 -0.00895 -0.03286
166 8D-2 0.03397 -0.02292 0.00659 -0.01551 -0.04881
167 9D 0 0.41214 0.15607 -0.09011 -0.20583 -0.11294
168 9D+1 0.05423 -0.81154 0.35192 -0.07497 -0.62899
169 9D-1 0.03131 -0.35192 0.40518 -0.04328 -0.28762
170 9D+2 -0.22613 0.04243 -0.14470 0.05904 0.36780
171 9D-2 -0.39167 0.19370 -0.04243 0.10225 0.54684
172 10F 0 -0.00222 -0.00942 0.00544 -0.00842 -0.01466
173 10F+1 -0.01135 0.01415 -0.01293 0.01686 -0.00247
174 10F-1 -0.00656 0.01293 0.00079 0.00974 -0.00275
175 10F+2 -0.00682 0.01556 0.00698 0.00672 0.00930
176 10F-2 -0.01181 0.01099 -0.01556 0.01164 0.01019
177 10F+3 0.00000 0.00507 0.00879 0.00000 0.00315
178 10F-3 -0.00412 -0.01277 0.00738 -0.00576 -0.02270
179 5 H 1S 0.01356 0.00613 0.00354 -0.02019 -0.01131
180 2S 0.81890 0.57802 0.33372 -0.77776 0.76277
181 3S -1.67275 -1.38294 -0.79844 -1.64707 -3.23243
182 4S -0.53732 -0.59508 -0.34357 0.45249 -0.41158
183 5PX 0.05519 0.02524 0.01410 -0.09217 -0.00767
184 5PY -0.03186 -0.01410 -0.00896 0.05321 -0.00379
185 5PZ 0.02197 -0.02430 -0.01403 -0.02764 -0.00705
186 6PX -0.41014 -0.21197 -0.10982 0.71088 0.10780
187 6PY 0.23680 0.10982 0.08516 -0.41043 0.00020
188 6PZ -0.17891 0.24359 0.14063 0.26302 0.09437
189 7PX 1.30814 0.58772 0.41045 -0.25840 1.45561
190 7PY -0.75526 -0.41045 -0.11378 0.14919 -0.84553
191 7PZ 0.07833 1.14907 0.66342 0.13699 0.97961
192 8D 0 -0.03390 0.01177 0.00679 0.02059 -0.01064
193 8D+1 0.00743 0.07156 0.03050 -0.01171 0.05523
194 8D-1 -0.00429 -0.03050 -0.03634 0.00676 -0.02589
195 8D+2 0.01961 0.00659 0.01531 -0.00895 0.03286
196 8D-2 -0.03397 -0.02292 -0.00659 0.01551 -0.04881
197 9D 0 0.41214 -0.15607 -0.09011 -0.20583 0.11294
198 9D+1 -0.05423 -0.81154 -0.35192 0.07497 -0.62899
199 9D-1 0.03131 0.35192 0.40518 -0.04328 0.28762
200 9D+2 -0.22613 -0.04243 -0.14470 0.05904 -0.36780
201 9D-2 0.39167 0.19370 0.04243 -0.10225 0.54684
202 10F 0 -0.00222 0.00942 0.00544 -0.00842 0.01466
203 10F+1 0.01135 0.01415 0.01293 -0.01686 -0.00247
204 10F-1 -0.00656 -0.01293 0.00079 0.00974 0.00275
205 10F+2 -0.00682 -0.01556 0.00698 0.00672 -0.00930
206 10F-2 0.01181 0.01099 0.01556 -0.01164 0.01019
207 10F+3 0.00000 0.00507 -0.00879 0.00000 0.00315
208 10F-3 -0.00412 0.01277 0.00738 -0.00576 0.02270
209 6 H 1S -0.01356 0.00000 0.00708 -0.02019 0.00000
210 2S -0.81890 0.00000 0.66744 -0.77776 0.00000
211 3S 1.67275 0.00000 -1.59688 -1.64707 0.00000
212 4S 0.53732 0.00000 -0.68714 0.45249 0.00000
213 5PX 0.00000 0.00082 0.00000 0.00000 0.01424
214 5PY 0.06373 0.00000 -0.03338 0.10643 0.00000
215 5PZ 0.02197 0.00000 0.02806 0.02764 0.00000
216 6PX 0.00000 -0.02176 0.00000 0.00000 -0.10815
217 6PY -0.47359 0.00000 0.27537 -0.82085 0.00000
218 6PZ -0.17891 0.00000 -0.28127 -0.26302 0.00000
219 7PX 0.00000 -0.12320 0.00000 0.00000 0.00889
220 7PY 1.51051 0.00000 -0.82470 0.29837 0.00000
221 7PZ 0.07833 0.00000 -1.32683 -0.13699 0.00000
222 8D 0 0.03390 0.00000 0.01359 0.02059 0.00000
223 8D+1 0.00000 -0.01872 0.00000 0.00000 0.01039
224 8D-1 -0.00858 0.00000 0.08917 -0.01352 0.00000
225 8D+2 0.03923 0.00000 -0.02672 0.01791 0.00000
226 8D-2 0.00000 0.01151 0.00000 0.00000 0.00811
227 9D 0 -0.41214 0.00000 -0.18022 -0.20583 0.00000
228 9D+1 0.00000 0.20200 0.00000 0.00000 -0.13082
229 9D-1 0.06261 0.00000 -1.01472 0.08656 0.00000
230 9D+2 -0.45226 0.00000 0.21820 -0.11807 0.00000
231 9D-2 0.00000 -0.12020 0.00000 0.00000 -0.09021
232 10F 0 -0.00222 0.00000 -0.01088 0.00842 0.00000
233 10F+1 0.00000 -0.00826 0.00000 0.00000 -0.00230
234 10F-1 0.01311 0.00000 -0.02161 0.01947 0.00000
235 10F+2 0.01363 0.00000 -0.01998 0.01344 0.00000
236 10F-2 0.00000 -0.01596 0.00000 0.00000 0.00592
237 10F+3 0.00000 -0.01015 0.00000 0.00000 0.00631
238 10F-3 -0.00412 0.00000 -0.01475 0.00576 0.00000
239 7 H 1S -0.01356 -0.00613 -0.00354 -0.02019 -0.01131
240 2S -0.81890 -0.57802 -0.33372 -0.77776 0.76277
241 3S 1.67275 1.38294 0.79844 -1.64707 -3.23243
242 4S 0.53732 0.59508 0.34357 0.45249 -0.41158
243 5PX 0.05519 0.02524 0.01410 0.09217 0.00767
244 5PY -0.03186 -0.01410 -0.00896 -0.05321 0.00379
245 5PZ 0.02197 -0.02430 -0.01403 0.02764 0.00705
246 6PX -0.41014 -0.21197 -0.10982 -0.71088 -0.10780
247 6PY 0.23680 0.10982 0.08516 0.41043 -0.00020
248 6PZ -0.17891 0.24359 0.14063 -0.26302 -0.09437
249 7PX 1.30814 0.58772 0.41045 0.25840 -1.45561
250 7PY -0.75526 -0.41045 -0.11378 -0.14919 0.84553
251 7PZ 0.07833 1.14907 0.66342 -0.13699 -0.97961
252 8D 0 0.03390 -0.01177 -0.00679 0.02059 -0.01064
253 8D+1 -0.00743 -0.07156 -0.03050 -0.01171 0.05523
254 8D-1 0.00429 0.03050 0.03634 0.00676 -0.02589
255 8D+2 -0.01961 -0.00659 -0.01531 -0.00895 0.03286
256 8D-2 0.03397 0.02292 0.00659 0.01551 -0.04881
257 9D 0 -0.41214 0.15607 0.09011 -0.20583 0.11294
258 9D+1 0.05423 0.81154 0.35192 0.07497 -0.62899
259 9D-1 -0.03131 -0.35192 -0.40518 -0.04328 0.28762
260 9D+2 0.22613 0.04243 0.14470 0.05904 -0.36780
261 9D-2 -0.39167 -0.19370 -0.04243 -0.10225 0.54684
262 10F 0 -0.00222 0.00942 0.00544 0.00842 -0.01466
263 10F+1 0.01135 0.01415 0.01293 0.01686 0.00247
264 10F-1 -0.00656 -0.01293 0.00079 -0.00974 -0.00275
265 10F+2 -0.00682 -0.01556 0.00698 -0.00672 0.00930
266 10F-2 0.01181 0.01099 0.01556 0.01164 -0.01019
267 10F+3 0.00000 0.00507 -0.00879 0.00000 -0.00315
268 10F-3 -0.00412 0.01277 0.00738 0.00576 -0.02270
269 8 H 1S -0.01356 0.00613 -0.00354 -0.02019 0.01131
270 2S -0.81890 0.57802 -0.33372 -0.77776 -0.76277
271 3S 1.67275 -1.38294 0.79844 -1.64707 3.23243
272 4S 0.53732 -0.59508 0.34357 0.45249 0.41158
273 5PX -0.05519 0.02524 -0.01410 -0.09217 0.00767
274 5PY -0.03186 0.01410 -0.00896 -0.05321 -0.00379
275 5PZ 0.02197 0.02430 -0.01403 0.02764 -0.00705
276 6PX 0.41014 -0.21197 0.10982 0.71088 -0.10780
277 6PY 0.23680 -0.10982 0.08516 0.41043 0.00020
278 6PZ -0.17891 -0.24359 0.14063 -0.26302 0.09437
279 7PX -1.30814 0.58772 -0.41045 -0.25840 -1.45561
280 7PY -0.75526 0.41045 -0.11378 -0.14919 -0.84553
281 7PZ 0.07833 -1.14907 0.66342 -0.13699 0.97961
282 8D 0 0.03390 0.01177 -0.00679 0.02059 0.01064
283 8D+1 0.00743 -0.07156 0.03050 0.01171 0.05523
284 8D-1 0.00429 -0.03050 0.03634 0.00676 0.02589
285 8D+2 -0.01961 0.00659 -0.01531 -0.00895 -0.03286
286 8D-2 -0.03397 0.02292 -0.00659 -0.01551 -0.04881
287 9D 0 -0.41214 -0.15607 0.09011 -0.20583 -0.11294
288 9D+1 -0.05423 0.81154 -0.35192 -0.07497 -0.62899
289 9D-1 -0.03131 0.35192 -0.40518 -0.04328 -0.28762
290 9D+2 0.22613 -0.04243 0.14470 0.05904 0.36780
291 9D-2 0.39167 -0.19370 0.04243 0.10225 0.54684
292 10F 0 -0.00222 -0.00942 0.00544 0.00842 0.01466
293 10F+1 -0.01135 0.01415 -0.01293 -0.01686 0.00247
294 10F-1 -0.00656 0.01293 0.00079 -0.00974 0.00275
295 10F+2 -0.00682 0.01556 0.00698 -0.00672 -0.00930
296 10F-2 -0.01181 0.01099 -0.01556 -0.01164 -0.01019
297 10F+3 0.00000 0.00507 0.00879 0.00000 -0.00315
298 10F-3 -0.00412 -0.01277 0.00738 0.00576 0.02270
186 187 188 189 190
(EG)--V (EG)--V (EG)--V (A1U)--V (A1G)--V
Eigenvalues -- 3.74094 3.76994 3.76994 3.79926 3.83922
1 1 Si 1S 0.00000 0.00000 0.00000 0.00000 0.02792
2 2S 0.00000 0.00000 0.00000 0.00000 -0.09306
3 3S 0.00000 0.00000 0.00000 0.00000 0.25825
4 4S 0.00000 0.00000 0.00000 0.00000 -4.28759
5 5S 0.00000 0.00000 0.00000 0.00000 16.68303
6 6S 0.00000 0.00000 0.00000 0.00000 1.02540
7 7PX 0.00000 -0.01665 0.00000 0.00000 0.00000
8 7PY 0.17201 0.00000 0.01665 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 -0.08287
10 8PX 0.00000 0.05341 0.00000 0.00000 0.00000
11 8PY -0.01888 0.00000 -0.05341 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.04862
13 9PX 0.00000 0.40034 0.00000 0.00000 0.00000
14 9PY -1.86121 0.00000 -0.40034 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 1.03136
16 10PX 0.00000 1.29937 0.00000 0.00000 0.00000
17 10PY -2.40333 0.00000 -1.29937 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 3.20968
19 11PX 0.00000 0.11395 0.00000 0.00000 0.00000
20 11PY -0.13817 0.00000 -0.11395 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.21253
22 12D 0 0.00000 0.00000 0.00000 0.00000 -1.26096
23 12D+1 0.00000 -0.16606 0.00000 0.00000 0.00000
24 12D-1 -0.02919 0.00000 0.16606 0.00000 0.00000
25 12D+2 0.37025 0.00000 0.20683 0.00000 0.00000
26 12D-2 0.00000 -0.20683 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 -2.78464
28 13D+1 0.00000 0.93228 0.00000 0.00000 0.00000
29 13D-1 -0.59363 0.00000 -0.93228 0.00000 0.00000
30 13D+2 1.21112 0.00000 0.92825 0.00000 0.00000
31 13D-2 0.00000 -0.92825 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.11881
33 14D+1 0.00000 0.02896 0.00000 0.00000 0.00000
34 14D-1 -0.34747 0.00000 -0.02896 0.00000 0.00000
35 14D+2 0.45510 0.00000 0.01264 0.00000 0.00000
36 14D-2 0.00000 -0.01264 0.00000 0.00000 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 -0.71150
38 15F+1 0.00000 0.72643 0.00000 0.00000 0.00000
39 15F-1 0.16381 0.00000 -0.72643 0.00000 0.00000
40 15F+2 -0.10863 0.00000 0.50829 0.00000 0.00000
41 15F-2 0.00000 -0.50829 0.00000 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.76006 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 -1.92252
44 16F 0 0.00000 0.00000 0.00000 0.00000 -0.41540
45 16F+1 0.00000 0.58617 0.00000 0.00000 0.00000
46 16F-1 0.40169 0.00000 -0.58617 0.00000 0.00000
47 16F+2 0.28111 0.00000 0.76416 0.00000 0.00000
48 16F-2 0.00000 -0.76416 0.00000 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 1.06645 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 -1.08647
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.59695
52 17G+1 0.00000 -0.32476 0.00000 0.00000 0.00000
53 17G-1 -0.38482 0.00000 0.32476 0.00000 0.00000
54 17G+2 -0.22319 0.00000 0.57147 0.00000 0.00000
55 17G-2 0.00000 -0.57147 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.94468 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00528
58 17G+4 0.11691 0.00000 0.46863 0.00000 0.00000
59 17G-4 0.00000 0.46863 0.00000 0.00000 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.02792
61 2S 0.00000 0.00000 0.00000 0.00000 -0.09306
62 3S 0.00000 0.00000 0.00000 0.00000 0.25825
63 4S 0.00000 0.00000 0.00000 0.00000 -4.28759
64 5S 0.00000 0.00000 0.00000 0.00000 16.68303
65 6S 0.00000 0.00000 0.00000 0.00000 1.02540
66 7PX 0.00000 0.01665 0.00000 0.00000 0.00000
67 7PY -0.17201 0.00000 -0.01665 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.08287
69 8PX 0.00000 -0.05341 0.00000 0.00000 0.00000
70 8PY 0.01888 0.00000 0.05341 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 -0.04862
72 9PX 0.00000 -0.40034 0.00000 0.00000 0.00000
73 9PY 1.86121 0.00000 0.40034 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 -1.03136
75 10PX 0.00000 -1.29937 0.00000 0.00000 0.00000
76 10PY 2.40333 0.00000 1.29937 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 -3.20968
78 11PX 0.00000 -0.11395 0.00000 0.00000 0.00000
79 11PY 0.13817 0.00000 0.11395 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 -0.21253
81 12D 0 0.00000 0.00000 0.00000 0.00000 -1.26096
82 12D+1 0.00000 -0.16606 0.00000 0.00000 0.00000
83 12D-1 -0.02919 0.00000 0.16606 0.00000 0.00000
84 12D+2 0.37025 0.00000 0.20683 0.00000 0.00000
85 12D-2 0.00000 -0.20683 0.00000 0.00000 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 -2.78464
87 13D+1 0.00000 0.93228 0.00000 0.00000 0.00000
88 13D-1 -0.59363 0.00000 -0.93228 0.00000 0.00000
89 13D+2 1.21112 0.00000 0.92825 0.00000 0.00000
90 13D-2 0.00000 -0.92825 0.00000 0.00000 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.11881
92 14D+1 0.00000 0.02896 0.00000 0.00000 0.00000
93 14D-1 -0.34747 0.00000 -0.02896 0.00000 0.00000
94 14D+2 0.45510 0.00000 0.01264 0.00000 0.00000
95 14D-2 0.00000 -0.01264 0.00000 0.00000 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.71150
97 15F+1 0.00000 -0.72643 0.00000 0.00000 0.00000
98 15F-1 -0.16381 0.00000 0.72643 0.00000 0.00000
99 15F+2 0.10863 0.00000 -0.50829 0.00000 0.00000
100 15F-2 0.00000 0.50829 0.00000 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.76006 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 1.92252
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.41540
104 16F+1 0.00000 -0.58617 0.00000 0.00000 0.00000
105 16F-1 -0.40169 0.00000 0.58617 0.00000 0.00000
106 16F+2 -0.28111 0.00000 -0.76416 0.00000 0.00000
107 16F-2 0.00000 0.76416 0.00000 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 1.06645 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 1.08647
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.59695
111 17G+1 0.00000 -0.32476 0.00000 0.00000 0.00000
112 17G-1 -0.38482 0.00000 0.32476 0.00000 0.00000
113 17G+2 -0.22319 0.00000 0.57147 0.00000 0.00000
114 17G-2 0.00000 -0.57147 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 -0.94468 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00528
117 17G+4 0.11691 0.00000 0.46863 0.00000 0.00000
118 17G-4 0.00000 0.46863 0.00000 0.00000 0.00000
119 3 H 1S 0.01306 0.00000 0.02771 0.00000 -0.01431
120 2S -0.88078 0.00000 -0.07878 0.00000 0.51335
121 3S 3.73249 0.00000 1.73843 0.00000 -6.51537
122 4S 0.47525 0.00000 0.06058 0.00000 -0.49532
123 5PX 0.00000 -0.02607 0.00000 -0.05015 0.00000
124 5PY 0.00548 0.00000 0.05686 0.00000 -0.04359
125 5PZ 0.00814 0.00000 -0.02813 0.00000 -0.03935
126 6PX 0.00000 0.26001 0.00000 0.48092 0.00000
127 6PY -0.10768 0.00000 -0.53374 0.00000 0.38132
128 6PZ -0.10897 0.00000 0.32648 0.00000 0.41513
129 7PX 0.00000 0.32735 0.00000 0.59463 0.00000
130 7PY -1.94378 0.00000 -0.87288 0.00000 2.40561
131 7PZ -1.13115 0.00000 0.41594 0.00000 1.43977
132 8D 0 0.01229 0.00000 0.05765 0.00000 0.00828
133 8D+1 0.00000 0.00847 0.00000 0.01746 0.00000
134 8D-1 -0.07018 0.00000 0.03886 0.00000 0.05888
135 8D+2 0.06778 0.00000 0.04120 0.00000 -0.02881
136 8D-2 0.00000 0.03790 0.00000 0.06817 0.00000
137 9D 0 -0.13041 0.00000 -0.61713 0.00000 -0.07832
138 9D+1 0.00000 -0.12287 0.00000 -0.24481 0.00000
139 9D-1 0.79504 0.00000 -0.44513 0.00000 -0.81776
140 9D+2 -0.75918 0.00000 -0.50287 0.00000 0.44370
141 9D-2 0.00000 -0.40309 0.00000 -0.68430 0.00000
142 10F 0 -0.01693 0.00000 -0.01821 0.00000 -0.00810
143 10F+1 0.00000 -0.00260 0.00000 0.00194 0.00000
144 10F-1 0.00406 0.00000 -0.00982 0.00000 -0.00827
145 10F+2 -0.01555 0.00000 0.01306 0.00000 -0.00607
146 10F-2 0.00000 0.00480 0.00000 -0.01103 0.00000
147 10F+3 0.00000 0.00843 0.00000 0.00616 0.00000
148 10F-3 -0.02622 0.00000 -0.00892 0.00000 -0.00304
149 4 H 1S -0.00653 0.02400 -0.01386 0.00000 -0.01431
150 2S 0.44039 -0.06822 0.03939 0.00000 0.51335
151 3S -1.86625 1.50553 -0.86922 0.00000 -6.51537
152 4S -0.23763 0.05247 -0.03029 0.00000 -0.49532
153 5PX -0.00379 -0.04916 0.01333 0.02507 0.03775
154 5PY 0.01205 -0.01333 0.03377 -0.04343 0.02179
155 5PZ -0.00407 -0.02436 0.01406 0.00000 -0.03935
156 6PX 0.00020 0.46531 -0.11853 -0.24046 -0.33023
157 6PY -0.10803 0.11853 -0.32844 0.41649 -0.19066
158 6PZ 0.05449 0.28274 -0.16324 0.00000 0.41513
159 7PX -0.84553 0.73649 -0.23622 -0.29731 -2.08332
160 7PY -0.47927 0.23622 -0.46373 0.51496 -1.20280
161 7PZ 0.56558 0.36022 -0.20797 0.00000 1.43977
162 8D 0 -0.00614 0.04993 -0.02882 0.00000 0.00828
163 8D+1 -0.02589 -0.02703 0.02049 -0.00873 -0.05099
164 8D-1 -0.02533 -0.02049 0.00336 0.01512 -0.02944
165 8D+2 0.01087 -0.03425 -0.01812 0.05903 0.01441
166 8D-2 0.03286 -0.02143 0.03425 -0.03408 0.02495
167 9D 0 0.06520 -0.53445 0.30857 0.00000 -0.07832
168 9D+1 0.28762 0.30313 -0.24595 0.12240 0.70820
169 9D-1 0.29687 0.24595 -0.01913 -0.21201 0.40888
170 9D+2 -0.12214 0.39230 0.17660 -0.59262 -0.22185
171 9D-2 -0.36780 0.27638 -0.39230 0.34215 -0.38426
172 10F 0 0.00846 -0.01577 0.00910 0.00000 -0.00810
173 10F+1 0.00275 0.00672 -0.00538 -0.00097 0.00717
174 10F-1 -0.00071 0.00538 -0.00050 0.00168 0.00414
175 10F+2 0.00055 -0.00774 -0.00034 -0.00955 0.00303
176 10F-2 -0.00930 -0.00859 0.00774 0.00552 0.00525
177 10F+3 0.00546 -0.00422 -0.00730 0.00616 0.00000
178 10F-3 0.01311 -0.00773 0.00446 0.00000 -0.00304
179 5 H 1S -0.00653 -0.02400 -0.01386 0.00000 -0.01431
180 2S 0.44039 0.06822 0.03939 0.00000 0.51335
181 3S -1.86625 -1.50553 -0.86922 0.00000 -6.51537
182 4S -0.23763 -0.05247 -0.03029 0.00000 -0.49532
183 5PX 0.00379 -0.04916 -0.01333 0.02507 -0.03775
184 5PY 0.01205 0.01333 0.03377 0.04343 0.02179
185 5PZ -0.00407 0.02436 0.01406 0.00000 -0.03935
186 6PX -0.00020 0.46531 0.11853 -0.24046 0.33023
187 6PY -0.10803 -0.11853 -0.32844 -0.41649 -0.19066
188 6PZ 0.05449 -0.28274 -0.16324 0.00000 0.41513
189 7PX 0.84553 0.73649 0.23622 -0.29731 2.08332
190 7PY -0.47927 -0.23622 -0.46373 -0.51496 -1.20280
191 7PZ 0.56558 -0.36022 -0.20797 0.00000 1.43977
192 8D 0 -0.00614 -0.04993 -0.02882 0.00000 0.00828
193 8D+1 0.02589 -0.02703 -0.02049 -0.00873 0.05099
194 8D-1 -0.02533 0.02049 0.00336 -0.01512 -0.02944
195 8D+2 0.01087 0.03425 -0.01812 -0.05903 0.01441
196 8D-2 -0.03286 -0.02143 -0.03425 -0.03408 -0.02495
197 9D 0 0.06520 0.53445 0.30857 0.00000 -0.07832
198 9D+1 -0.28762 0.30313 0.24595 0.12240 -0.70820
199 9D-1 0.29687 -0.24595 -0.01913 0.21201 0.40888
200 9D+2 -0.12214 -0.39230 0.17660 0.59262 -0.22185
201 9D-2 0.36780 0.27638 0.39230 0.34215 0.38426
202 10F 0 0.00846 0.01577 0.00910 0.00000 -0.00810
203 10F+1 -0.00275 0.00672 0.00538 -0.00097 -0.00717
204 10F-1 -0.00071 -0.00538 -0.00050 -0.00168 0.00414
205 10F+2 0.00055 0.00774 -0.00034 0.00955 0.00303
206 10F-2 0.00930 -0.00859 -0.00774 0.00552 -0.00525
207 10F+3 -0.00546 -0.00422 0.00730 0.00616 0.00000
208 10F-3 0.01311 0.00773 0.00446 0.00000 -0.00304
209 6 H 1S 0.01306 0.00000 0.02771 0.00000 -0.01431
210 2S -0.88078 0.00000 -0.07878 0.00000 0.51335
211 3S 3.73249 0.00000 1.73843 0.00000 -6.51537
212 4S 0.47525 0.00000 0.06058 0.00000 -0.49532
213 5PX 0.00000 0.02607 0.00000 -0.05015 0.00000
214 5PY -0.00548 0.00000 -0.05686 0.00000 0.04359
215 5PZ -0.00814 0.00000 0.02813 0.00000 0.03935
216 6PX 0.00000 -0.26001 0.00000 0.48092 0.00000
217 6PY 0.10768 0.00000 0.53374 0.00000 -0.38132
218 6PZ 0.10897 0.00000 -0.32648 0.00000 -0.41513
219 7PX 0.00000 -0.32735 0.00000 0.59463 0.00000
220 7PY 1.94378 0.00000 0.87288 0.00000 -2.40561
221 7PZ 1.13115 0.00000 -0.41594 0.00000 -1.43977
222 8D 0 0.01229 0.00000 0.05765 0.00000 0.00828
223 8D+1 0.00000 0.00847 0.00000 -0.01746 0.00000
224 8D-1 -0.07018 0.00000 0.03886 0.00000 0.05888
225 8D+2 0.06778 0.00000 0.04120 0.00000 -0.02881
226 8D-2 0.00000 0.03790 0.00000 -0.06817 0.00000
227 9D 0 -0.13041 0.00000 -0.61713 0.00000 -0.07832
228 9D+1 0.00000 -0.12287 0.00000 0.24481 0.00000
229 9D-1 0.79504 0.00000 -0.44513 0.00000 -0.81776
230 9D+2 -0.75918 0.00000 -0.50287 0.00000 0.44370
231 9D-2 0.00000 -0.40309 0.00000 0.68430 0.00000
232 10F 0 0.01693 0.00000 0.01821 0.00000 0.00810
233 10F+1 0.00000 0.00260 0.00000 0.00194 0.00000
234 10F-1 -0.00406 0.00000 0.00982 0.00000 0.00827
235 10F+2 0.01555 0.00000 -0.01306 0.00000 0.00607
236 10F-2 0.00000 -0.00480 0.00000 -0.01103 0.00000
237 10F+3 0.00000 -0.00843 0.00000 0.00616 0.00000
238 10F-3 0.02622 0.00000 0.00892 0.00000 0.00304
239 7 H 1S -0.00653 -0.02400 -0.01386 0.00000 -0.01431
240 2S 0.44039 0.06822 0.03939 0.00000 0.51335
241 3S -1.86625 -1.50553 -0.86922 0.00000 -6.51537
242 4S -0.23763 -0.05247 -0.03029 0.00000 -0.49532
243 5PX -0.00379 0.04916 0.01333 0.02507 0.03775
244 5PY -0.01205 -0.01333 -0.03377 0.04343 -0.02179
245 5PZ 0.00407 -0.02436 -0.01406 0.00000 0.03935
246 6PX 0.00020 -0.46531 -0.11853 -0.24046 -0.33023
247 6PY 0.10803 0.11853 0.32844 -0.41649 0.19066
248 6PZ -0.05449 0.28274 0.16324 0.00000 -0.41513
249 7PX -0.84553 -0.73649 -0.23622 -0.29731 -2.08332
250 7PY 0.47927 0.23622 0.46373 -0.51496 1.20280
251 7PZ -0.56558 0.36022 0.20797 0.00000 -1.43977
252 8D 0 -0.00614 -0.04993 -0.02882 0.00000 0.00828
253 8D+1 0.02589 -0.02703 -0.02049 0.00873 0.05099
254 8D-1 -0.02533 0.02049 0.00336 0.01512 -0.02944
255 8D+2 0.01087 0.03425 -0.01812 0.05903 0.01441
256 8D-2 -0.03286 -0.02143 -0.03425 0.03408 -0.02495
257 9D 0 0.06520 0.53445 0.30857 0.00000 -0.07832
258 9D+1 -0.28762 0.30313 0.24595 -0.12240 -0.70820
259 9D-1 0.29687 -0.24595 -0.01913 -0.21201 0.40888
260 9D+2 -0.12214 -0.39230 0.17660 -0.59262 -0.22185
261 9D-2 0.36780 0.27638 0.39230 -0.34215 0.38426
262 10F 0 -0.00846 -0.01577 -0.00910 0.00000 0.00810
263 10F+1 0.00275 -0.00672 -0.00538 -0.00097 0.00717
264 10F-1 0.00071 0.00538 0.00050 -0.00168 -0.00414
265 10F+2 -0.00055 -0.00774 0.00034 0.00955 -0.00303
266 10F-2 -0.00930 0.00859 0.00774 0.00552 0.00525
267 10F+3 0.00546 0.00422 -0.00730 0.00616 0.00000
268 10F-3 -0.01311 -0.00773 -0.00446 0.00000 0.00304
269 8 H 1S -0.00653 0.02400 -0.01386 0.00000 -0.01431
270 2S 0.44039 -0.06822 0.03939 0.00000 0.51335
271 3S -1.86625 1.50553 -0.86922 0.00000 -6.51537
272 4S -0.23763 0.05247 -0.03029 0.00000 -0.49532
273 5PX 0.00379 0.04916 -0.01333 0.02507 -0.03775
274 5PY -0.01205 0.01333 -0.03377 -0.04343 -0.02179
275 5PZ 0.00407 0.02436 -0.01406 0.00000 0.03935
276 6PX -0.00020 -0.46531 0.11853 -0.24046 0.33023
277 6PY 0.10803 -0.11853 0.32844 0.41649 0.19066
278 6PZ -0.05449 -0.28274 0.16324 0.00000 -0.41513
279 7PX 0.84553 -0.73649 0.23622 -0.29731 2.08332
280 7PY 0.47927 -0.23622 0.46373 0.51496 1.20280
281 7PZ -0.56558 -0.36022 0.20797 0.00000 -1.43977
282 8D 0 -0.00614 0.04993 -0.02882 0.00000 0.00828
283 8D+1 -0.02589 -0.02703 0.02049 0.00873 -0.05099
284 8D-1 -0.02533 -0.02049 0.00336 -0.01512 -0.02944
285 8D+2 0.01087 -0.03425 -0.01812 -0.05903 0.01441
286 8D-2 0.03286 -0.02143 0.03425 0.03408 0.02495
287 9D 0 0.06520 -0.53445 0.30857 0.00000 -0.07832
288 9D+1 0.28762 0.30313 -0.24595 -0.12240 0.70820
289 9D-1 0.29687 0.24595 -0.01913 0.21201 0.40888
290 9D+2 -0.12214 0.39230 0.17660 0.59262 -0.22185
291 9D-2 -0.36780 0.27638 -0.39230 -0.34215 -0.38426
292 10F 0 -0.00846 0.01577 -0.00910 0.00000 0.00810
293 10F+1 -0.00275 -0.00672 0.00538 -0.00097 -0.00717
294 10F-1 0.00071 -0.00538 0.00050 0.00168 -0.00414
295 10F+2 -0.00055 0.00774 0.00034 -0.00955 -0.00303
296 10F-2 0.00930 0.00859 -0.00774 0.00552 -0.00525
297 10F+3 -0.00546 0.00422 0.00730 0.00616 0.00000
298 10F-3 -0.01311 0.00773 -0.00446 0.00000 0.00304
191 192 193 194 195
(EU)--V (EU)--V (A2G)--V (A2U)--V (A2G)--V
Eigenvalues -- 3.84598 3.84598 3.95412 4.13076 6.07821
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2 2S 0.00000 0.00000 0.00000 -0.16100 0.00000
3 3S 0.00000 0.00000 0.00000 -0.13931 0.00000
4 4S 0.00000 0.00000 0.00000 -8.92644 0.00000
5 5S 0.00000 0.00000 0.00000 25.25411 0.00000
6 6S 0.00000 0.00000 0.00000 2.73420 0.00000
7 7PX -0.13620 0.00000 0.00000 0.00000 0.00000
8 7PY 0.00000 0.13620 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 -0.17918 0.00000
10 8PX 0.00971 0.00000 0.00000 0.00000 0.00000
11 8PY 0.00000 -0.00971 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 -0.05209 0.00000
13 9PX 1.52703 0.00000 0.00000 0.00000 0.00000
14 9PY 0.00000 -1.52703 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 2.08563 0.00000
16 10PX 1.98209 0.00000 0.00000 0.00000 0.00000
17 10PY 0.00000 -1.98209 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 -3.17303 0.00000
19 11PX 0.10200 0.00000 0.00000 0.00000 0.00000
20 11PY 0.00000 -0.10200 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 -0.64689 0.00000
22 12D 0 0.00000 0.00000 0.00000 0.93784 0.00000
23 12D+1 0.25011 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 -0.25011 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.36470 0.00000 0.00000 0.00000
26 12D-2 -0.36470 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.58412 0.00000
28 13D+1 1.56836 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 -1.56836 0.00000 0.00000 0.00000
30 13D+2 0.00000 1.46905 0.00000 0.00000 0.00000
31 13D-2 -1.46905 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 -0.80589 0.00000
33 14D+1 0.07835 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 -0.07835 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.22899 0.00000 0.00000 0.00000
36 14D-2 -0.22899 0.00000 0.00000 0.00000 0.00000
37 15F 0 0.00000 0.00000 0.00000 -2.10058 0.00000
38 15F+1 0.46694 0.00000 0.00000 0.00000 0.00000
39 15F-1 0.00000 -0.46694 0.00000 0.00000 0.00000
40 15F+2 0.00000 0.41371 0.00000 0.00000 0.00000
41 15F-2 -0.41371 0.00000 0.00000 0.00000 0.00000
42 15F+3 0.00000 0.00000 1.26096 0.00000 0.11699
43 15F-3 0.00000 0.00000 0.00000 -1.52369 0.00000
44 16F 0 0.00000 0.00000 0.00000 -1.29609 0.00000
45 16F+1 0.25299 0.00000 0.00000 0.00000 0.00000
46 16F-1 0.00000 -0.25299 0.00000 0.00000 0.00000
47 16F+2 0.00000 0.70530 0.00000 0.00000 0.00000
48 16F-2 -0.70530 0.00000 0.00000 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.97162 0.00000 0.00317
50 16F-3 0.00000 0.00000 0.00000 -1.25898 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.61361 0.00000
52 17G+1 0.03764 0.00000 0.00000 0.00000 0.00000
53 17G-1 0.00000 -0.03764 0.00000 0.00000 0.00000
54 17G+2 0.00000 0.60988 0.00000 0.00000 0.00000
55 17G-2 -0.60988 0.00000 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 1.08897 0.00000 0.03828
57 17G-3 0.00000 0.00000 0.00000 -0.57829 0.00000
58 17G+4 0.00000 0.54029 0.00000 0.00000 0.00000
59 17G-4 0.54029 0.00000 0.00000 0.00000 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 -0.00270 0.00000
61 2S 0.00000 0.00000 0.00000 0.16100 0.00000
62 3S 0.00000 0.00000 0.00000 0.13931 0.00000
63 4S 0.00000 0.00000 0.00000 8.92644 0.00000
64 5S 0.00000 0.00000 0.00000 -25.25411 0.00000
65 6S 0.00000 0.00000 0.00000 -2.73420 0.00000
66 7PX -0.13620 0.00000 0.00000 0.00000 0.00000
67 7PY 0.00000 0.13620 0.00000 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.00000 -0.17918 0.00000
69 8PX 0.00971 0.00000 0.00000 0.00000 0.00000
70 8PY 0.00000 -0.00971 0.00000 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.00000 -0.05209 0.00000
72 9PX 1.52703 0.00000 0.00000 0.00000 0.00000
73 9PY 0.00000 -1.52703 0.00000 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.00000 2.08563 0.00000
75 10PX 1.98209 0.00000 0.00000 0.00000 0.00000
76 10PY 0.00000 -1.98209 0.00000 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 -3.17303 0.00000
78 11PX 0.10200 0.00000 0.00000 0.00000 0.00000
79 11PY 0.00000 -0.10200 0.00000 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.00000 -0.64689 0.00000
81 12D 0 0.00000 0.00000 0.00000 -0.93784 0.00000
82 12D+1 -0.25011 0.00000 0.00000 0.00000 0.00000
83 12D-1 0.00000 0.25011 0.00000 0.00000 0.00000
84 12D+2 0.00000 -0.36470 0.00000 0.00000 0.00000
85 12D-2 0.36470 0.00000 0.00000 0.00000 0.00000
86 13D 0 0.00000 0.00000 0.00000 -0.58412 0.00000
87 13D+1 -1.56836 0.00000 0.00000 0.00000 0.00000
88 13D-1 0.00000 1.56836 0.00000 0.00000 0.00000
89 13D+2 0.00000 -1.46905 0.00000 0.00000 0.00000
90 13D-2 1.46905 0.00000 0.00000 0.00000 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.80589 0.00000
92 14D+1 -0.07835 0.00000 0.00000 0.00000 0.00000
93 14D-1 0.00000 0.07835 0.00000 0.00000 0.00000
94 14D+2 0.00000 -0.22899 0.00000 0.00000 0.00000
95 14D-2 0.22899 0.00000 0.00000 0.00000 0.00000
96 15F 0 0.00000 0.00000 0.00000 -2.10058 0.00000
97 15F+1 0.46694 0.00000 0.00000 0.00000 0.00000
98 15F-1 0.00000 -0.46694 0.00000 0.00000 0.00000
99 15F+2 0.00000 0.41371 0.00000 0.00000 0.00000
100 15F-2 -0.41371 0.00000 0.00000 0.00000 0.00000
101 15F+3 0.00000 0.00000 -1.26096 0.00000 -0.11699
102 15F-3 0.00000 0.00000 0.00000 -1.52369 0.00000
103 16F 0 0.00000 0.00000 0.00000 -1.29609 0.00000
104 16F+1 0.25299 0.00000 0.00000 0.00000 0.00000
105 16F-1 0.00000 -0.25299 0.00000 0.00000 0.00000
106 16F+2 0.00000 0.70530 0.00000 0.00000 0.00000
107 16F-2 -0.70530 0.00000 0.00000 0.00000 0.00000
108 16F+3 0.00000 0.00000 -0.97162 0.00000 -0.00317
109 16F-3 0.00000 0.00000 0.00000 -1.25898 0.00000
110 17G 0 0.00000 0.00000 0.00000 -0.61361 0.00000
111 17G+1 -0.03764 0.00000 0.00000 0.00000 0.00000
112 17G-1 0.00000 0.03764 0.00000 0.00000 0.00000
113 17G+2 0.00000 -0.60988 0.00000 0.00000 0.00000
114 17G-2 0.60988 0.00000 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 1.08897 0.00000 0.03828
116 17G-3 0.00000 0.00000 0.00000 0.57829 0.00000
117 17G+4 0.00000 -0.54029 0.00000 0.00000 0.00000
118 17G-4 -0.54029 0.00000 0.00000 0.00000 0.00000
119 3 H 1S 0.00000 0.02169 0.00000 -0.01658 0.00000
120 2S 0.00000 -0.67284 0.00000 0.31413 0.00000
121 3S 0.00000 3.72108 0.00000 -6.66338 0.00000
122 4S 0.00000 0.39980 0.00000 -0.17123 0.00000
123 5PX -0.03060 0.00000 -0.04448 0.00000 0.00012
124 5PY 0.00000 0.03671 0.00000 -0.07756 0.00000
125 5PZ 0.00000 -0.03554 0.00000 -0.03005 0.00000
126 6PX 0.30517 0.00000 0.48646 0.00000 0.00147
127 6PY 0.00000 -0.41492 0.00000 0.67244 0.00000
128 6PZ 0.00000 0.35591 0.00000 0.27182 0.00000
129 7PX 0.23498 0.00000 0.84560 0.00000 0.07296
130 7PY 0.00000 -2.05863 0.00000 2.61723 0.00000
131 7PZ 0.00000 -0.22753 0.00000 1.15157 0.00000
132 8D 0 0.00000 0.05682 0.00000 -0.01374 0.00000
133 8D+1 0.00906 0.00000 0.01607 0.00000 -0.00266
134 8D-1 0.00000 0.00167 0.00000 0.03498 0.00000
135 8D+2 0.00000 0.07174 0.00000 -0.03862 0.00000
136 8D-2 0.03440 0.00000 0.06986 0.00000 -0.00469
137 9D 0 0.00000 -0.59401 0.00000 0.18797 0.00000
138 9D+1 -0.15213 0.00000 -0.27313 0.00000 -0.01361
139 9D-1 0.00000 0.00073 0.00000 -0.54539 0.00000
140 9D+2 0.00000 -0.89561 0.00000 0.59205 0.00000
141 9D-2 -0.36748 0.00000 -0.73922 0.00000 -0.02245
142 10F 0 0.00000 -0.01827 0.00000 -0.00696 0.00000
143 10F+1 -0.00578 0.00000 0.01154 0.00000 0.25838
144 10F-1 0.00000 0.00455 0.00000 0.00201 0.00000
145 10F+2 0.00000 0.00415 0.00000 -0.00462 0.00000
146 10F-2 0.00679 0.00000 -0.00602 0.00000 -0.24406
147 10F+3 0.00526 0.00000 0.01077 0.00000 -0.20164
148 10F-3 0.00000 -0.02010 0.00000 -0.00461 0.00000
149 4 H 1S 0.01879 -0.01085 0.00000 -0.01658 0.00000
150 2S -0.58270 0.33642 0.00000 0.31413 0.00000
151 3S 3.22255 -1.86054 0.00000 -6.66338 0.00000
152 4S 0.34623 -0.19990 0.00000 -0.17123 0.00000
153 5PX -0.03518 0.00264 0.02224 0.06717 -0.00006
154 5PY -0.00264 0.03213 -0.03852 0.03878 0.00011
155 5PZ -0.03078 0.01777 0.00000 -0.03005 0.00000
156 6PX 0.38748 -0.04752 -0.24323 -0.58235 -0.00074
157 6PY 0.04752 -0.33261 0.42128 -0.33622 0.00127
158 6PZ 0.30822 -0.17795 0.00000 0.27182 0.00000
159 7PX 1.60272 -0.78966 -0.42280 -2.26659 -0.03648
160 7PY 0.78966 -0.69089 0.73231 -1.30862 0.06319
161 7PZ -0.19705 0.11377 0.00000 1.15157 0.00000
162 8D 0 0.04921 -0.02841 0.00000 -0.01374 0.00000
163 8D+1 0.00101 0.00465 -0.00803 -0.03030 0.00133
164 8D-1 -0.00465 -0.00637 0.01391 -0.01749 -0.00230
165 8D+2 -0.04596 -0.00786 0.06050 0.01931 -0.00407
166 8D-2 -0.04521 0.04596 -0.03493 0.03345 0.00235
167 9D 0 -0.51443 0.29700 0.00000 0.18797 0.00000
168 9D+1 -0.03858 -0.06556 0.13656 0.47232 0.00681
169 9D-1 0.06556 0.11428 -0.23654 0.27269 -0.01179
170 9D+2 0.54693 0.05171 -0.64018 -0.29602 -0.01944
171 9D-2 0.57984 -0.54693 0.36961 -0.51273 0.01122
172 10F 0 -0.01582 0.00913 0.00000 -0.00696 0.00000
173 10F+1 -0.00486 -0.00053 -0.00577 -0.00174 -0.12919
174 10F-1 0.00053 0.00548 0.00999 -0.00101 0.22376
175 10F+2 -0.00474 -0.00406 -0.00521 0.00231 -0.21136
176 10F-2 -0.00142 0.00474 0.00301 0.00400 0.12203
177 10F+3 -0.00263 -0.00456 0.01077 0.00000 -0.20164
178 10F-3 -0.01741 0.01005 0.00000 -0.00461 0.00000
179 5 H 1S -0.01879 -0.01085 0.00000 -0.01658 0.00000
180 2S 0.58270 0.33642 0.00000 0.31413 0.00000
181 3S -3.22255 -1.86054 0.00000 -6.66338 0.00000
182 4S -0.34623 -0.19990 0.00000 -0.17123 0.00000
183 5PX -0.03518 -0.00264 0.02224 -0.06717 -0.00006
184 5PY 0.00264 0.03213 0.03852 0.03878 -0.00011
185 5PZ 0.03078 0.01777 0.00000 -0.03005 0.00000
186 6PX 0.38748 0.04752 -0.24323 0.58235 -0.00074
187 6PY -0.04752 -0.33261 -0.42128 -0.33622 -0.00127
188 6PZ -0.30822 -0.17795 0.00000 0.27182 0.00000
189 7PX 1.60272 0.78966 -0.42280 2.26659 -0.03648
190 7PY -0.78966 -0.69089 -0.73231 -1.30862 -0.06319
191 7PZ 0.19705 0.11377 0.00000 1.15157 0.00000
192 8D 0 -0.04921 -0.02841 0.00000 -0.01374 0.00000
193 8D+1 0.00101 -0.00465 -0.00803 0.03030 0.00133
194 8D-1 0.00465 -0.00637 -0.01391 -0.01749 0.00230
195 8D+2 0.04596 -0.00786 -0.06050 0.01931 0.00407
196 8D-2 -0.04521 -0.04596 -0.03493 -0.03345 0.00235
197 9D 0 0.51443 0.29700 0.00000 0.18797 0.00000
198 9D+1 -0.03858 0.06556 0.13656 -0.47232 0.00681
199 9D-1 -0.06556 0.11428 0.23654 0.27269 0.01179
200 9D+2 -0.54693 0.05171 0.64018 -0.29602 0.01944
201 9D-2 0.57984 0.54693 0.36961 0.51273 0.01122
202 10F 0 0.01582 0.00913 0.00000 -0.00696 0.00000
203 10F+1 -0.00486 0.00053 -0.00577 0.00174 -0.12919
204 10F-1 -0.00053 0.00548 -0.00999 -0.00101 -0.22376
205 10F+2 0.00474 -0.00406 0.00521 0.00231 0.21136
206 10F-2 -0.00142 -0.00474 0.00301 -0.00400 0.12203
207 10F+3 -0.00263 0.00456 0.01077 0.00000 -0.20164
208 10F-3 0.01741 0.01005 0.00000 -0.00461 0.00000
209 6 H 1S 0.00000 -0.02169 0.00000 0.01658 0.00000
210 2S 0.00000 0.67284 0.00000 -0.31413 0.00000
211 3S 0.00000 -3.72108 0.00000 6.66338 0.00000
212 4S 0.00000 -0.39980 0.00000 0.17123 0.00000
213 5PX -0.03060 0.00000 0.04448 0.00000 -0.00012
214 5PY 0.00000 0.03671 0.00000 -0.07756 0.00000
215 5PZ 0.00000 -0.03554 0.00000 -0.03005 0.00000
216 6PX 0.30517 0.00000 -0.48646 0.00000 -0.00147
217 6PY 0.00000 -0.41492 0.00000 0.67244 0.00000
218 6PZ 0.00000 0.35591 0.00000 0.27182 0.00000
219 7PX 0.23498 0.00000 -0.84560 0.00000 -0.07296
220 7PY 0.00000 -2.05863 0.00000 2.61723 0.00000
221 7PZ 0.00000 -0.22753 0.00000 1.15157 0.00000
222 8D 0 0.00000 -0.05682 0.00000 0.01374 0.00000
223 8D+1 -0.00906 0.00000 0.01607 0.00000 -0.00266
224 8D-1 0.00000 -0.00167 0.00000 -0.03498 0.00000
225 8D+2 0.00000 -0.07174 0.00000 0.03862 0.00000
226 8D-2 -0.03440 0.00000 0.06986 0.00000 -0.00469
227 9D 0 0.00000 0.59401 0.00000 -0.18797 0.00000
228 9D+1 0.15213 0.00000 -0.27313 0.00000 -0.01361
229 9D-1 0.00000 -0.00073 0.00000 0.54539 0.00000
230 9D+2 0.00000 0.89561 0.00000 -0.59205 0.00000
231 9D-2 0.36748 0.00000 -0.73922 0.00000 -0.02245
232 10F 0 0.00000 -0.01827 0.00000 -0.00696 0.00000
233 10F+1 -0.00578 0.00000 -0.01154 0.00000 -0.25838
234 10F-1 0.00000 0.00455 0.00000 0.00201 0.00000
235 10F+2 0.00000 0.00415 0.00000 -0.00462 0.00000
236 10F-2 0.00679 0.00000 0.00602 0.00000 0.24406
237 10F+3 0.00526 0.00000 -0.01077 0.00000 0.20164
238 10F-3 0.00000 -0.02010 0.00000 -0.00461 0.00000
239 7 H 1S 0.01879 0.01085 0.00000 0.01658 0.00000
240 2S -0.58270 -0.33642 0.00000 -0.31413 0.00000
241 3S 3.22255 1.86054 0.00000 6.66338 0.00000
242 4S 0.34623 0.19990 0.00000 0.17123 0.00000
243 5PX -0.03518 -0.00264 -0.02224 -0.06717 0.00006
244 5PY 0.00264 0.03213 -0.03852 0.03878 0.00011
245 5PZ 0.03078 0.01777 0.00000 -0.03005 0.00000
246 6PX 0.38748 0.04752 0.24323 0.58235 0.00074
247 6PY -0.04752 -0.33261 0.42128 -0.33622 0.00127
248 6PZ -0.30822 -0.17795 0.00000 0.27182 0.00000
249 7PX 1.60272 0.78966 0.42280 2.26659 0.03648
250 7PY -0.78966 -0.69089 0.73231 -1.30862 0.06319
251 7PZ 0.19705 0.11377 0.00000 1.15157 0.00000
252 8D 0 0.04921 0.02841 0.00000 0.01374 0.00000
253 8D+1 -0.00101 0.00465 -0.00803 -0.03030 0.00133
254 8D-1 -0.00465 0.00637 -0.01391 0.01749 0.00230
255 8D+2 -0.04596 0.00786 -0.06050 -0.01931 0.00407
256 8D-2 0.04521 0.04596 -0.03493 0.03345 0.00235
257 9D 0 -0.51443 -0.29700 0.00000 -0.18797 0.00000
258 9D+1 0.03858 -0.06556 0.13656 0.47232 0.00681
259 9D-1 0.06556 -0.11428 0.23654 -0.27269 0.01179
260 9D+2 0.54693 -0.05171 0.64018 0.29602 0.01944
261 9D-2 -0.57984 -0.54693 0.36961 -0.51273 0.01122
262 10F 0 0.01582 0.00913 0.00000 -0.00696 0.00000
263 10F+1 -0.00486 0.00053 0.00577 0.00174 0.12919
264 10F-1 -0.00053 0.00548 0.00999 -0.00101 0.22376
265 10F+2 0.00474 -0.00406 -0.00521 0.00231 -0.21136
266 10F-2 -0.00142 -0.00474 -0.00301 -0.00400 -0.12203
267 10F+3 -0.00263 0.00456 -0.01077 0.00000 0.20164
268 10F-3 0.01741 0.01005 0.00000 -0.00461 0.00000
269 8 H 1S -0.01879 0.01085 0.00000 0.01658 0.00000
270 2S 0.58270 -0.33642 0.00000 -0.31413 0.00000
271 3S -3.22255 1.86054 0.00000 6.66338 0.00000
272 4S -0.34623 0.19990 0.00000 0.17123 0.00000
273 5PX -0.03518 0.00264 -0.02224 0.06717 0.00006
274 5PY -0.00264 0.03213 0.03852 0.03878 -0.00011
275 5PZ -0.03078 0.01777 0.00000 -0.03005 0.00000
276 6PX 0.38748 -0.04752 0.24323 -0.58235 0.00074
277 6PY 0.04752 -0.33261 -0.42128 -0.33622 -0.00127
278 6PZ 0.30822 -0.17795 0.00000 0.27182 0.00000
279 7PX 1.60272 -0.78966 0.42280 -2.26659 0.03648
280 7PY 0.78966 -0.69089 -0.73231 -1.30862 -0.06319
281 7PZ -0.19705 0.11377 0.00000 1.15157 0.00000
282 8D 0 -0.04921 0.02841 0.00000 0.01374 0.00000
283 8D+1 -0.00101 -0.00465 -0.00803 0.03030 0.00133
284 8D-1 0.00465 0.00637 0.01391 0.01749 -0.00230
285 8D+2 0.04596 0.00786 0.06050 -0.01931 -0.00407
286 8D-2 0.04521 -0.04596 -0.03493 -0.03345 0.00235
287 9D 0 0.51443 -0.29700 0.00000 -0.18797 0.00000
288 9D+1 0.03858 0.06556 0.13656 -0.47232 0.00681
289 9D-1 -0.06556 -0.11428 -0.23654 -0.27269 -0.01179
290 9D+2 -0.54693 -0.05171 -0.64018 0.29602 -0.01944
291 9D-2 -0.57984 0.54693 0.36961 0.51273 0.01122
292 10F 0 -0.01582 0.00913 0.00000 -0.00696 0.00000
293 10F+1 -0.00486 -0.00053 0.00577 -0.00174 0.12919
294 10F-1 0.00053 0.00548 -0.00999 -0.00101 -0.22376
295 10F+2 -0.00474 -0.00406 0.00521 0.00231 0.21136
296 10F-2 -0.00142 0.00474 -0.00301 0.00400 -0.12203
297 10F+3 -0.00263 -0.00456 -0.01077 0.00000 0.20164
298 10F-3 -0.01741 0.01005 0.00000 -0.00461 0.00000
196 197 198 199 200
(A1U)--V (EG)--V (EG)--V (EU)--V (EU)--V
Eigenvalues -- 6.07957 6.11320 6.11320 6.11586 6.11586
1 1 Si 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 -0.05194 0.00000 0.00000 -0.06848
8 7PY 0.00000 0.00000 -0.05194 0.06848 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.05437 0.00000 0.00000 -0.06488
11 8PY 0.00000 0.00000 -0.05437 0.06488 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.17332 0.00000 0.00000 0.22217
14 9PY 0.00000 0.00000 0.17332 -0.22217 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 -0.09077 0.00000 0.00000 0.53673
17 10PY 0.00000 0.00000 -0.09077 -0.53673 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 -0.00869 0.00000 0.00000 0.12736
20 11PY 0.00000 0.00000 -0.00869 -0.12736 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 0.18748 0.00000 0.00000 0.14093
24 12D-1 0.00000 0.00000 0.18748 -0.14093 0.00000
25 12D+2 0.00000 0.00000 -0.04261 0.25756 0.00000
26 12D-2 0.00000 -0.04261 0.00000 0.00000 -0.25756
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.09387 0.00000 0.00000 0.02414
29 13D-1 0.00000 0.00000 0.09387 -0.02414 0.00000
30 13D+2 0.00000 0.00000 -0.04752 0.22631 0.00000
31 13D-2 0.00000 -0.04752 0.00000 0.00000 -0.22631
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 -0.02782 0.00000 0.00000 0.02618
34 14D-1 0.00000 0.00000 -0.02782 -0.02618 0.00000
35 14D+2 0.00000 0.00000 -0.03010 -0.00175 0.00000
36 14D-2 0.00000 -0.03010 0.00000 0.00000 0.00175
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 -0.25294 0.00000 0.00000 -0.12589
39 15F-1 0.00000 0.00000 -0.25294 0.12589 0.00000
40 15F+2 0.00000 0.00000 0.01693 0.05570 0.00000
41 15F-2 0.00000 0.01693 0.00000 0.00000 -0.05570
42 15F+3 0.07790 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 0.02662 0.00000 0.00000 0.02630
46 16F-1 0.00000 0.00000 0.02662 -0.02630 0.00000
47 16F+2 0.00000 0.00000 0.02756 -0.02428 0.00000
48 16F-2 0.00000 0.02756 0.00000 0.00000 0.02428
49 16F+3 0.00165 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 0.04228 0.00000 0.00000 0.02432
53 17G-1 0.00000 0.00000 0.04228 -0.02432 0.00000
54 17G+2 0.00000 0.00000 0.00306 0.01766 0.00000
55 17G-2 0.00000 0.00306 0.00000 0.00000 -0.01766
56 17G+3 0.03127 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.01463 0.02192 0.00000
59 17G-4 0.00000 -0.01463 0.00000 0.00000 0.02192
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00000
61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
62 3S 0.00000 0.00000 0.00000 0.00000 0.00000
63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
64 5S 0.00000 0.00000 0.00000 0.00000 0.00000
65 6S 0.00000 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 0.05194 0.00000 0.00000 -0.06848
67 7PY 0.00000 0.00000 0.05194 0.06848 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 0.05437 0.00000 0.00000 -0.06488
70 8PY 0.00000 0.00000 0.05437 0.06488 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 -0.17332 0.00000 0.00000 0.22217
73 9PY 0.00000 0.00000 -0.17332 -0.22217 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 0.09077 0.00000 0.00000 0.53673
76 10PY 0.00000 0.00000 0.09077 -0.53673 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 0.00869 0.00000 0.00000 0.12736
79 11PY 0.00000 0.00000 0.00869 -0.12736 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.18748 0.00000 0.00000 -0.14093
83 12D-1 0.00000 0.00000 0.18748 0.14093 0.00000
84 12D+2 0.00000 0.00000 -0.04261 -0.25756 0.00000
85 12D-2 0.00000 -0.04261 0.00000 0.00000 0.25756
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.09387 0.00000 0.00000 -0.02414
88 13D-1 0.00000 0.00000 0.09387 0.02414 0.00000
89 13D+2 0.00000 0.00000 -0.04752 -0.22631 0.00000
90 13D-2 0.00000 -0.04752 0.00000 0.00000 0.22631
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 -0.02782 0.00000 0.00000 -0.02618
93 14D-1 0.00000 0.00000 -0.02782 0.02618 0.00000
94 14D+2 0.00000 0.00000 -0.03010 0.00175 0.00000
95 14D-2 0.00000 -0.03010 0.00000 0.00000 -0.00175
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.25294 0.00000 0.00000 -0.12589
98 15F-1 0.00000 0.00000 0.25294 0.12589 0.00000
99 15F+2 0.00000 0.00000 -0.01693 0.05570 0.00000
100 15F-2 0.00000 -0.01693 0.00000 0.00000 -0.05570
101 15F+3 0.07790 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 -0.02662 0.00000 0.00000 0.02630
105 16F-1 0.00000 0.00000 -0.02662 -0.02630 0.00000
106 16F+2 0.00000 0.00000 -0.02756 -0.02428 0.00000
107 16F-2 0.00000 -0.02756 0.00000 0.00000 0.02428
108 16F+3 0.00165 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.04228 0.00000 0.00000 -0.02432
112 17G-1 0.00000 0.00000 0.04228 0.02432 0.00000
113 17G+2 0.00000 0.00000 0.00306 -0.01766 0.00000
114 17G-2 0.00000 0.00306 0.00000 0.00000 0.01766
115 17G+3 -0.03127 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.01463 -0.02192 0.00000
118 17G-4 0.00000 -0.01463 0.00000 0.00000 -0.02192
119 3 H 1S 0.00000 0.00000 -0.00003 -0.01616 0.00000
120 2S 0.00000 0.00000 0.02639 -0.07553 0.00000
121 3S 0.00000 0.00000 -0.17387 0.63638 0.00000
122 4S 0.00000 0.00000 -0.05016 0.25178 0.00000
123 5PX -0.00203 -0.00056 0.00000 0.00000 0.00533
124 5PY 0.00000 0.00000 0.00968 -0.02347 0.00000
125 5PZ 0.00000 0.00000 0.00618 -0.01046 0.00000
126 6PX 0.00084 -0.00356 0.00000 0.00000 0.00248
127 6PY 0.00000 0.00000 -0.00483 0.01441 0.00000
128 6PZ 0.00000 0.00000 -0.00695 0.02394 0.00000
129 7PX 0.05288 -0.01832 0.00000 0.00000 0.04477
130 7PY 0.00000 0.00000 0.05002 -0.23844 0.00000
131 7PZ 0.00000 0.00000 0.11500 -0.18650 0.00000
132 8D 0 0.00000 0.00000 -0.00256 0.00793 0.00000
133 8D+1 -0.00202 -0.00057 0.00000 0.00000 -0.00067
134 8D-1 0.00000 0.00000 -0.01634 0.02154 0.00000
135 8D+2 0.00000 0.00000 0.00029 -0.00530 0.00000
136 8D-2 -0.00390 -0.00116 0.00000 0.00000 0.00266
137 9D 0 0.00000 0.00000 0.00022 -0.00393 0.00000
138 9D+1 -0.00962 0.00972 0.00000 0.00000 -0.00145
139 9D-1 0.00000 0.00000 -0.04228 0.05450 0.00000
140 9D+2 0.00000 0.00000 0.00634 -0.03419 0.00000
141 9D-2 -0.01658 0.00610 0.00000 0.00000 -0.01734
142 10F 0 0.00000 0.00000 0.09020 0.15096 0.00000
143 10F+1 0.26521 0.49180 0.00000 0.00000 0.39444
144 10F-1 0.00000 0.00000 0.13942 -0.23659 0.00000
145 10F+2 0.00000 0.00000 0.01098 -0.17760 0.00000
146 10F-2 -0.24101 -0.12862 0.00000 0.00000 -0.09064
147 10F+3 -0.19633 -0.14782 0.00000 0.00000 -0.04299
148 10F-3 0.00000 0.00000 -0.16652 0.24155 0.00000
149 4 H 1S 0.00000 0.00003 0.00002 0.00808 -0.01400
150 2S 0.00000 -0.02286 -0.01320 0.03777 -0.06541
151 3S 0.00000 0.15058 0.08694 -0.31819 0.55113
152 4S 0.00000 0.04344 0.02508 -0.12589 0.21805
153 5PX 0.00101 0.00712 0.00444 -0.00785 0.01894
154 5PY -0.00176 0.00444 0.00200 -0.00987 0.00785
155 5PZ 0.00000 -0.00535 -0.00309 0.00523 -0.00906
156 6PX -0.00042 -0.00451 -0.00055 0.00731 -0.01018
157 6PY 0.00073 -0.00055 -0.00388 0.00174 -0.00731
158 6PZ 0.00000 0.00602 0.00348 -0.01197 0.02073
159 7PX -0.02644 0.03293 0.02959 -0.08386 0.19002
160 7PY 0.04580 0.02959 -0.00123 -0.09319 0.08386
161 7PZ 0.00000 -0.09960 -0.05750 0.09325 -0.16151
162 8D 0 0.00000 0.00222 0.00128 -0.00396 0.00686
163 8D+1 0.00101 -0.01240 -0.00683 0.00904 -0.01632
164 8D-1 -0.00175 -0.00683 -0.00451 0.00589 -0.00904
165 8D+2 -0.00338 0.00062 -0.00079 -0.00332 0.00114
166 8D-2 0.00195 -0.00007 0.00062 -0.00114 0.00464
167 9D 0 0.00000 -0.00019 -0.00011 0.00197 -0.00341
168 9D+1 0.00481 -0.02928 -0.02252 0.02297 -0.04124
169 9D-1 -0.00833 -0.02252 -0.00328 0.01471 -0.02297
170 9D+2 -0.01435 0.00010 0.00616 0.00446 0.02231
171 9D-2 0.00829 0.00628 0.00010 -0.02231 0.02131
172 10F 0 0.00000 -0.07812 -0.04510 -0.07548 0.13073
173 10F+1 -0.13261 0.22752 -0.15259 0.06835 0.27606
174 10F-1 0.22968 -0.15259 0.40371 -0.35498 -0.06835
175 10F+2 -0.20872 0.06045 -0.09372 0.02358 0.11615
176 10F-2 0.12050 -0.02392 0.06045 -0.11615 0.11054
177 10F+3 -0.19633 0.07391 -0.12802 0.03723 0.02150
178 10F-3 0.00000 0.14421 0.08326 -0.12078 0.20919
179 5 H 1S 0.00000 -0.00003 0.00002 0.00808 0.01400
180 2S 0.00000 0.02286 -0.01320 0.03777 0.06541
181 3S 0.00000 -0.15058 0.08694 -0.31819 -0.55113
182 4S 0.00000 -0.04344 0.02508 -0.12589 -0.21805
183 5PX 0.00101 0.00712 -0.00444 0.00785 0.01894
184 5PY 0.00176 -0.00444 0.00200 -0.00987 -0.00785
185 5PZ 0.00000 0.00535 -0.00309 0.00523 0.00906
186 6PX -0.00042 -0.00451 0.00055 -0.00731 -0.01018
187 6PY -0.00073 0.00055 -0.00388 0.00174 0.00731
188 6PZ 0.00000 -0.00602 0.00348 -0.01197 -0.02073
189 7PX -0.02644 0.03293 -0.02959 0.08386 0.19002
190 7PY -0.04580 -0.02959 -0.00123 -0.09319 -0.08386
191 7PZ 0.00000 0.09960 -0.05750 0.09325 0.16151
192 8D 0 0.00000 -0.00222 0.00128 -0.00396 -0.00686
193 8D+1 0.00101 -0.01240 0.00683 -0.00904 -0.01632
194 8D-1 0.00175 0.00683 -0.00451 0.00589 0.00904
195 8D+2 0.00338 -0.00062 -0.00079 -0.00332 -0.00114
196 8D-2 0.00195 -0.00007 -0.00062 0.00114 0.00464
197 9D 0 0.00000 0.00019 -0.00011 0.00197 0.00341
198 9D+1 0.00481 -0.02928 0.02252 -0.02297 -0.04124
199 9D-1 0.00833 0.02252 -0.00328 0.01471 0.02297
200 9D+2 0.01435 -0.00010 0.00616 0.00446 -0.02231
201 9D-2 0.00829 0.00628 -0.00010 0.02231 0.02131
202 10F 0 0.00000 0.07812 -0.04510 -0.07548 -0.13073
203 10F+1 -0.13261 0.22752 0.15259 -0.06835 0.27606
204 10F-1 -0.22968 0.15259 0.40371 -0.35498 0.06835
205 10F+2 0.20872 -0.06045 -0.09372 0.02358 -0.11615
206 10F-2 0.12050 -0.02392 -0.06045 0.11615 0.11054
207 10F+3 -0.19633 0.07391 0.12802 -0.03723 0.02150
208 10F-3 0.00000 -0.14421 0.08326 -0.12078 -0.20919
209 6 H 1S 0.00000 0.00000 -0.00003 0.01616 0.00000
210 2S 0.00000 0.00000 0.02639 0.07553 0.00000
211 3S 0.00000 0.00000 -0.17387 -0.63638 0.00000
212 4S 0.00000 0.00000 -0.05016 -0.25178 0.00000
213 5PX -0.00203 0.00056 0.00000 0.00000 0.00533
214 5PY 0.00000 0.00000 -0.00968 -0.02347 0.00000
215 5PZ 0.00000 0.00000 -0.00618 -0.01046 0.00000
216 6PX 0.00084 0.00356 0.00000 0.00000 0.00248
217 6PY 0.00000 0.00000 0.00483 0.01441 0.00000
218 6PZ 0.00000 0.00000 0.00695 0.02394 0.00000
219 7PX 0.05288 0.01832 0.00000 0.00000 0.04477
220 7PY 0.00000 0.00000 -0.05002 -0.23844 0.00000
221 7PZ 0.00000 0.00000 -0.11500 -0.18650 0.00000
222 8D 0 0.00000 0.00000 -0.00256 -0.00793 0.00000
223 8D+1 0.00202 -0.00057 0.00000 0.00000 0.00067
224 8D-1 0.00000 0.00000 -0.01634 -0.02154 0.00000
225 8D+2 0.00000 0.00000 0.00029 0.00530 0.00000
226 8D-2 0.00390 -0.00116 0.00000 0.00000 -0.00266
227 9D 0 0.00000 0.00000 0.00022 0.00393 0.00000
228 9D+1 0.00962 0.00972 0.00000 0.00000 0.00145
229 9D-1 0.00000 0.00000 -0.04228 -0.05450 0.00000
230 9D+2 0.00000 0.00000 0.00634 0.03419 0.00000
231 9D-2 0.01658 0.00610 0.00000 0.00000 0.01734
232 10F 0 0.00000 0.00000 -0.09020 0.15096 0.00000
233 10F+1 0.26521 -0.49180 0.00000 0.00000 0.39444
234 10F-1 0.00000 0.00000 -0.13942 -0.23659 0.00000
235 10F+2 0.00000 0.00000 -0.01098 -0.17760 0.00000
236 10F-2 -0.24101 0.12862 0.00000 0.00000 -0.09064
237 10F+3 -0.19633 0.14782 0.00000 0.00000 -0.04299
238 10F-3 0.00000 0.00000 0.16652 0.24155 0.00000
239 7 H 1S 0.00000 -0.00003 0.00002 -0.00808 -0.01400
240 2S 0.00000 0.02286 -0.01320 -0.03777 -0.06541
241 3S 0.00000 -0.15058 0.08694 0.31819 0.55113
242 4S 0.00000 -0.04344 0.02508 0.12589 0.21805
243 5PX 0.00101 -0.00712 0.00444 0.00785 0.01894
244 5PY 0.00176 0.00444 -0.00200 -0.00987 -0.00785
245 5PZ 0.00000 -0.00535 0.00309 0.00523 0.00906
246 6PX -0.00042 0.00451 -0.00055 -0.00731 -0.01018
247 6PY -0.00073 -0.00055 0.00388 0.00174 0.00731
248 6PZ 0.00000 0.00602 -0.00348 -0.01197 -0.02073
249 7PX -0.02644 -0.03293 0.02959 0.08386 0.19002
250 7PY -0.04580 0.02959 0.00123 -0.09319 -0.08386
251 7PZ 0.00000 -0.09960 0.05750 0.09325 0.16151
252 8D 0 0.00000 -0.00222 0.00128 0.00396 0.00686
253 8D+1 -0.00101 -0.01240 0.00683 0.00904 0.01632
254 8D-1 -0.00175 0.00683 -0.00451 -0.00589 -0.00904
255 8D+2 -0.00338 -0.00062 -0.00079 0.00332 0.00114
256 8D-2 -0.00195 -0.00007 -0.00062 -0.00114 -0.00464
257 9D 0 0.00000 0.00019 -0.00011 -0.00197 -0.00341
258 9D+1 -0.00481 -0.02928 0.02252 0.02297 0.04124
259 9D-1 -0.00833 0.02252 -0.00328 -0.01471 -0.02297
260 9D+2 -0.01435 -0.00010 0.00616 -0.00446 0.02231
261 9D-2 -0.00829 0.00628 -0.00010 -0.02231 -0.02131
262 10F 0 0.00000 -0.07812 0.04510 -0.07548 -0.13073
263 10F+1 -0.13261 -0.22752 -0.15259 -0.06835 0.27606
264 10F-1 -0.22968 -0.15259 -0.40371 -0.35498 0.06835
265 10F+2 0.20872 0.06045 0.09372 0.02358 -0.11615
266 10F-2 0.12050 0.02392 0.06045 0.11615 0.11054
267 10F+3 -0.19633 -0.07391 -0.12802 -0.03723 0.02150
268 10F-3 0.00000 0.14421 -0.08326 -0.12078 -0.20919
269 8 H 1S 0.00000 0.00003 0.00002 -0.00808 0.01400
270 2S 0.00000 -0.02286 -0.01320 -0.03777 0.06541
271 3S 0.00000 0.15058 0.08694 0.31819 -0.55113
272 4S 0.00000 0.04344 0.02508 0.12589 -0.21805
273 5PX 0.00101 -0.00712 -0.00444 -0.00785 0.01894
274 5PY -0.00176 -0.00444 -0.00200 -0.00987 0.00785
275 5PZ 0.00000 0.00535 0.00309 0.00523 -0.00906
276 6PX -0.00042 0.00451 0.00055 0.00731 -0.01018
277 6PY 0.00073 0.00055 0.00388 0.00174 -0.00731
278 6PZ 0.00000 -0.00602 -0.00348 -0.01197 0.02073
279 7PX -0.02644 -0.03293 -0.02959 -0.08386 0.19002
280 7PY 0.04580 -0.02959 0.00123 -0.09319 0.08386
281 7PZ 0.00000 0.09960 0.05750 0.09325 -0.16151
282 8D 0 0.00000 0.00222 0.00128 0.00396 -0.00686
283 8D+1 -0.00101 -0.01240 -0.00683 -0.00904 0.01632
284 8D-1 0.00175 -0.00683 -0.00451 -0.00589 0.00904
285 8D+2 0.00338 0.00062 -0.00079 0.00332 -0.00114
286 8D-2 -0.00195 -0.00007 0.00062 0.00114 -0.00464
287 9D 0 0.00000 -0.00019 -0.00011 -0.00197 0.00341
288 9D+1 -0.00481 -0.02928 -0.02252 -0.02297 0.04124
289 9D-1 0.00833 -0.02252 -0.00328 -0.01471 0.02297
290 9D+2 0.01435 0.00010 0.00616 -0.00446 -0.02231
291 9D-2 -0.00829 0.00628 0.00010 0.02231 -0.02131
292 10F 0 0.00000 0.07812 0.04510 -0.07548 0.13073
293 10F+1 -0.13261 -0.22752 0.15259 0.06835 0.27606
294 10F-1 0.22968 0.15259 -0.40371 -0.35498 -0.06835
295 10F+2 -0.20872 -0.06045 0.09372 0.02358 0.11615
296 10F-2 0.12050 0.02392 -0.06045 -0.11615 0.11054
297 10F+3 -0.19633 -0.07391 0.12802 0.03723 0.02150
298 10F-3 0.00000 -0.14421 -0.08326 -0.12078 0.20919
201 202 203 204 205
(EG)--V (EG)--V (EU)--V (EU)--V (A1G)--V
Eigenvalues -- 6.13956 6.13956 6.16360 6.16360 6.21297
1 1 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00204
2 2S 0.00000 0.00000 0.00000 0.00000 -0.00948
3 3S 0.00000 0.00000 0.00000 0.00000 0.02314
4 4S 0.00000 0.00000 0.00000 0.00000 -0.13696
5 5S 0.00000 0.00000 0.00000 0.00000 0.83236
6 6S 0.00000 0.00000 0.00000 0.00000 0.37560
7 7PX -0.08440 0.00000 0.00199 0.00000 0.00000
8 7PY 0.00000 0.08440 0.00000 -0.00199 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.05689
10 8PX -0.07262 0.00000 0.01070 0.00000 0.00000
11 8PY 0.00000 0.07262 0.00000 -0.01070 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.07273
13 9PX 0.33148 0.00000 -0.00032 0.00000 0.00000
14 9PY 0.00000 -0.33148 0.00000 0.00032 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 -0.08251
16 10PX 0.68402 0.00000 0.67255 0.00000 0.00000
17 10PY 0.00000 -0.68402 0.00000 -0.67255 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.35792
19 11PX 0.19084 0.00000 0.13258 0.00000 0.00000
20 11PY 0.00000 -0.19084 0.00000 -0.13258 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.04580
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.14177
23 12D+1 0.21994 0.00000 0.28922 0.00000 0.00000
24 12D-1 0.00000 -0.21994 0.00000 -0.28922 0.00000
25 12D+2 0.00000 0.30408 0.00000 0.32616 0.00000
26 12D-2 -0.30408 0.00000 -0.32616 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.05119
28 13D+1 0.31286 0.00000 0.16432 0.00000 0.00000
29 13D-1 0.00000 -0.31286 0.00000 -0.16432 0.00000
30 13D+2 0.00000 0.39906 0.00000 0.22936 0.00000
31 13D-2 -0.39906 0.00000 -0.22936 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00135
33 14D+1 -0.01754 0.00000 -0.01201 0.00000 0.00000
34 14D-1 0.00000 0.01754 0.00000 0.01201 0.00000
35 14D+2 0.00000 -0.03405 0.00000 -0.04848 0.00000
36 14D-2 0.03405 0.00000 0.04848 0.00000 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 -0.05562
38 15F+1 -0.09332 0.00000 0.04560 0.00000 0.00000
39 15F-1 0.00000 0.09332 0.00000 -0.04560 0.00000
40 15F+2 0.00000 0.22175 0.00000 0.44507 0.00000
41 15F-2 -0.22175 0.00000 -0.44507 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 -0.12026
44 16F 0 0.00000 0.00000 0.00000 0.00000 -0.01900
45 16F+1 -0.03640 0.00000 0.00487 0.00000 0.00000
46 16F-1 0.00000 0.03640 0.00000 -0.00487 0.00000
47 16F+2 0.00000 0.02228 0.00000 -0.00068 0.00000
48 16F-2 -0.02228 0.00000 0.00068 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 -0.03463
51 17G 0 0.00000 0.00000 0.00000 0.00000 -0.09618
52 17G+1 0.05961 0.00000 0.00514 0.00000 0.00000
53 17G-1 0.00000 -0.05961 0.00000 -0.00514 0.00000
54 17G+2 0.00000 0.00968 0.00000 -0.01965 0.00000
55 17G-2 -0.00968 0.00000 0.01965 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.08750
58 17G+4 0.00000 0.04697 0.00000 0.03957 0.00000
59 17G-4 0.04697 0.00000 0.03957 0.00000 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00204
61 2S 0.00000 0.00000 0.00000 0.00000 -0.00948
62 3S 0.00000 0.00000 0.00000 0.00000 0.02314
63 4S 0.00000 0.00000 0.00000 0.00000 -0.13696
64 5S 0.00000 0.00000 0.00000 0.00000 0.83236
65 6S 0.00000 0.00000 0.00000 0.00000 0.37560
66 7PX 0.08440 0.00000 0.00199 0.00000 0.00000
67 7PY 0.00000 -0.08440 0.00000 -0.00199 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 -0.05689
69 8PX 0.07262 0.00000 0.01070 0.00000 0.00000
70 8PY 0.00000 -0.07262 0.00000 -0.01070 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 -0.07273
72 9PX -0.33148 0.00000 -0.00032 0.00000 0.00000
73 9PY 0.00000 0.33148 0.00000 0.00032 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.08251
75 10PX -0.68402 0.00000 0.67255 0.00000 0.00000
76 10PY 0.00000 0.68402 0.00000 -0.67255 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 -0.35792
78 11PX -0.19084 0.00000 0.13258 0.00000 0.00000
79 11PY 0.00000 0.19084 0.00000 -0.13258 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 -0.04580
81 12D 0 0.00000 0.00000 0.00000 0.00000 -0.14177
82 12D+1 0.21994 0.00000 -0.28922 0.00000 0.00000
83 12D-1 0.00000 -0.21994 0.00000 0.28922 0.00000
84 12D+2 0.00000 0.30408 0.00000 -0.32616 0.00000
85 12D-2 -0.30408 0.00000 0.32616 0.00000 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 -0.05119
87 13D+1 0.31286 0.00000 -0.16432 0.00000 0.00000
88 13D-1 0.00000 -0.31286 0.00000 0.16432 0.00000
89 13D+2 0.00000 0.39906 0.00000 -0.22936 0.00000
90 13D-2 -0.39906 0.00000 0.22936 0.00000 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00135
92 14D+1 -0.01754 0.00000 0.01201 0.00000 0.00000
93 14D-1 0.00000 0.01754 0.00000 -0.01201 0.00000
94 14D+2 0.00000 -0.03405 0.00000 0.04848 0.00000
95 14D-2 0.03405 0.00000 -0.04848 0.00000 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.05562
97 15F+1 0.09332 0.00000 0.04560 0.00000 0.00000
98 15F-1 0.00000 -0.09332 0.00000 -0.04560 0.00000
99 15F+2 0.00000 -0.22175 0.00000 0.44507 0.00000
100 15F-2 0.22175 0.00000 -0.44507 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.12026
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.01900
104 16F+1 0.03640 0.00000 0.00487 0.00000 0.00000
105 16F-1 0.00000 -0.03640 0.00000 -0.00487 0.00000
106 16F+2 0.00000 -0.02228 0.00000 -0.00068 0.00000
107 16F-2 0.02228 0.00000 0.00068 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.03463
110 17G 0 0.00000 0.00000 0.00000 0.00000 -0.09618
111 17G+1 0.05961 0.00000 -0.00514 0.00000 0.00000
112 17G-1 0.00000 -0.05961 0.00000 0.00514 0.00000
113 17G+2 0.00000 0.00968 0.00000 0.01965 0.00000
114 17G-2 -0.00968 0.00000 -0.01965 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.08750
117 17G+4 0.00000 0.04697 0.00000 -0.03957 0.00000
118 17G-4 0.04697 0.00000 -0.03957 0.00000 0.00000
119 3 H 1S 0.00000 0.00659 0.00000 0.00652 0.01083
120 2S 0.00000 -0.11243 0.00000 -0.03370 0.05853
121 3S 0.00000 1.03524 0.00000 0.79448 -0.39904
122 4S 0.00000 0.30645 0.00000 0.24774 -0.13765
123 5PX 0.01089 0.00000 0.00916 0.00000 0.00000
124 5PY 0.00000 -0.03600 0.00000 -0.01315 0.02090
125 5PZ 0.00000 -0.00757 0.00000 -0.00409 0.00369
126 6PX 0.01216 0.00000 0.00270 0.00000 0.00000
127 6PY 0.00000 -0.00591 0.00000 -0.00917 -0.02805
128 6PZ 0.00000 0.00201 0.00000 -0.02569 -0.01579
129 7PX 0.09953 0.00000 0.16375 0.00000 0.00000
130 7PY 0.00000 -0.42696 0.00000 -0.25908 0.18209
131 7PZ 0.00000 -0.13799 0.00000 0.11561 0.06484
132 8D 0 0.00000 -0.00682 0.00000 -0.00839 -0.00008
133 8D+1 0.00446 0.00000 0.01543 0.00000 0.00000
134 8D-1 0.00000 0.01080 0.00000 -0.00876 -0.00450
135 8D+2 0.00000 -0.01342 0.00000 -0.00680 0.00702
136 8D-2 0.00481 0.00000 -0.00570 0.00000 0.00000
137 9D 0 0.00000 -0.03584 0.00000 -0.03432 0.01138
138 9D+1 -0.00900 0.00000 0.00338 0.00000 0.00000
139 9D-1 0.00000 0.04671 0.00000 -0.02388 -0.00904
140 9D+2 0.00000 -0.07728 0.00000 -0.02524 0.02503
141 9D-2 -0.04168 0.00000 -0.05592 0.00000 0.00000
142 10F 0 0.00000 0.41060 0.00000 0.34957 0.28042
143 10F+1 -0.01199 0.00000 -0.32613 0.00000 0.00000
144 10F-1 0.00000 -0.16446 0.00000 -0.08411 -0.09029
145 10F+2 0.00000 -0.29456 0.00000 -0.25907 -0.28600
146 10F-2 -0.00989 0.00000 0.04153 0.00000 0.00000
147 10F+3 0.11676 0.00000 0.16010 0.00000 0.00000
148 10F-3 0.00000 0.19462 0.00000 0.08438 0.04330
149 4 H 1S 0.00570 -0.00329 0.00565 -0.00326 0.01083
150 2S -0.09737 0.05622 -0.02919 0.01685 0.05853
151 3S 0.89655 -0.51762 0.68804 -0.39724 -0.39904
152 4S 0.26539 -0.15322 0.21455 -0.12387 -0.13765
153 5PX 0.02972 -0.01087 0.01215 -0.00173 -0.01810
154 5PY 0.01087 -0.01717 0.00173 -0.01016 -0.01045
155 5PZ -0.00656 0.00379 -0.00354 0.00204 0.00369
156 6PX 0.00747 0.00271 0.00755 -0.00280 0.02429
157 6PY -0.00271 -0.01060 0.00280 -0.00431 0.01402
158 6PZ 0.00174 -0.00100 -0.02225 0.01285 -0.01579
159 7PX 0.34511 -0.14178 0.23524 -0.04128 -0.15770
160 7PY 0.14178 -0.18139 0.04128 -0.18758 -0.09105
161 7PZ -0.11951 0.06900 0.10012 -0.05780 0.06484
162 8D 0 -0.00591 0.00341 -0.00727 0.00420 -0.00008
163 8D+1 -0.00698 0.00661 0.01043 0.00289 0.00390
164 8D-1 -0.00661 -0.00065 -0.00289 -0.01376 0.00225
165 8D+2 0.00373 -0.00696 0.00541 0.00258 -0.00351
166 8D-2 0.01127 -0.00373 0.00367 -0.00541 -0.00608
167 9D 0 -0.03104 0.01792 -0.02972 0.01716 0.01138
168 9D+1 -0.03728 0.01633 0.01875 -0.00888 0.00783
169 9D-1 -0.01633 0.01843 0.00888 -0.00851 0.00452
170 9D+2 0.05151 0.01194 0.03514 0.03563 -0.01252
171 9D-2 0.04754 -0.05151 0.00495 -0.03514 -0.02168
172 10F 0 0.35559 -0.20530 0.30274 -0.17478 0.28042
173 10F+1 0.12035 -0.07641 -0.01845 -0.17764 0.07820
174 10F-1 0.07641 -0.03213 0.17764 0.22357 0.04515
175 10F+2 0.13183 -0.06622 0.09420 -0.09592 0.14300
176 10F-2 0.21845 -0.13183 0.20468 -0.09420 0.24769
177 10F+3 -0.05838 -0.10111 -0.08005 -0.13865 0.00000
178 10F-3 0.16855 -0.09731 0.07307 -0.04219 0.04330
179 5 H 1S -0.00570 -0.00329 -0.00565 -0.00326 0.01083
180 2S 0.09737 0.05622 0.02919 0.01685 0.05853
181 3S -0.89655 -0.51762 -0.68804 -0.39724 -0.39904
182 4S -0.26539 -0.15322 -0.21455 -0.12387 -0.13765
183 5PX 0.02972 0.01087 0.01215 0.00173 0.01810
184 5PY -0.01087 -0.01717 -0.00173 -0.01016 -0.01045
185 5PZ 0.00656 0.00379 0.00354 0.00204 0.00369
186 6PX 0.00747 -0.00271 0.00755 0.00280 -0.02429
187 6PY 0.00271 -0.01060 -0.00280 -0.00431 0.01402
188 6PZ -0.00174 -0.00100 0.02225 0.01285 -0.01579
189 7PX 0.34511 0.14178 0.23524 0.04128 0.15770
190 7PY -0.14178 -0.18139 -0.04128 -0.18758 -0.09105
191 7PZ 0.11951 0.06900 -0.10012 -0.05780 0.06484
192 8D 0 0.00591 0.00341 0.00727 0.00420 -0.00008
193 8D+1 -0.00698 -0.00661 0.01043 -0.00289 -0.00390
194 8D-1 0.00661 -0.00065 0.00289 -0.01376 0.00225
195 8D+2 -0.00373 -0.00696 -0.00541 0.00258 -0.00351
196 8D-2 0.01127 0.00373 0.00367 0.00541 0.00608
197 9D 0 0.03104 0.01792 0.02972 0.01716 0.01138
198 9D+1 -0.03728 -0.01633 0.01875 0.00888 -0.00783
199 9D-1 0.01633 0.01843 -0.00888 -0.00851 0.00452
200 9D+2 -0.05151 0.01194 -0.03514 0.03563 -0.01252
201 9D-2 0.04754 0.05151 0.00495 0.03514 0.02168
202 10F 0 -0.35559 -0.20530 -0.30274 -0.17478 0.28042
203 10F+1 0.12035 0.07641 -0.01845 0.17764 -0.07820
204 10F-1 -0.07641 -0.03213 -0.17764 0.22357 0.04515
205 10F+2 -0.13183 -0.06622 -0.09420 -0.09592 0.14300
206 10F-2 0.21845 0.13183 0.20468 0.09420 -0.24769
207 10F+3 -0.05838 0.10111 -0.08005 0.13865 0.00000
208 10F-3 -0.16855 -0.09731 -0.07307 -0.04219 0.04330
209 6 H 1S 0.00000 0.00659 0.00000 -0.00652 0.01083
210 2S 0.00000 -0.11243 0.00000 0.03370 0.05853
211 3S 0.00000 1.03524 0.00000 -0.79448 -0.39904
212 4S 0.00000 0.30645 0.00000 -0.24774 -0.13765
213 5PX -0.01089 0.00000 0.00916 0.00000 0.00000
214 5PY 0.00000 0.03600 0.00000 -0.01315 -0.02090
215 5PZ 0.00000 0.00757 0.00000 -0.00409 -0.00369
216 6PX -0.01216 0.00000 0.00270 0.00000 0.00000
217 6PY 0.00000 0.00591 0.00000 -0.00917 0.02805
218 6PZ 0.00000 -0.00201 0.00000 -0.02569 0.01579
219 7PX -0.09953 0.00000 0.16375 0.00000 0.00000
220 7PY 0.00000 0.42696 0.00000 -0.25908 -0.18209
221 7PZ 0.00000 0.13799 0.00000 0.11561 -0.06484
222 8D 0 0.00000 -0.00682 0.00000 0.00839 -0.00008
223 8D+1 0.00446 0.00000 -0.01543 0.00000 0.00000
224 8D-1 0.00000 0.01080 0.00000 0.00876 -0.00450
225 8D+2 0.00000 -0.01342 0.00000 0.00680 0.00702
226 8D-2 0.00481 0.00000 0.00570 0.00000 0.00000
227 9D 0 0.00000 -0.03584 0.00000 0.03432 0.01138
228 9D+1 -0.00900 0.00000 -0.00338 0.00000 0.00000
229 9D-1 0.00000 0.04671 0.00000 0.02388 -0.00904
230 9D+2 0.00000 -0.07728 0.00000 0.02524 0.02503
231 9D-2 -0.04168 0.00000 0.05592 0.00000 0.00000
232 10F 0 0.00000 -0.41060 0.00000 0.34957 -0.28042
233 10F+1 0.01199 0.00000 -0.32613 0.00000 0.00000
234 10F-1 0.00000 0.16446 0.00000 -0.08411 0.09029
235 10F+2 0.00000 0.29456 0.00000 -0.25907 0.28600
236 10F-2 0.00989 0.00000 0.04153 0.00000 0.00000
237 10F+3 -0.11676 0.00000 0.16010 0.00000 0.00000
238 10F-3 0.00000 -0.19462 0.00000 0.08438 -0.04330
239 7 H 1S -0.00570 -0.00329 0.00565 0.00326 0.01083
240 2S 0.09737 0.05622 -0.02919 -0.01685 0.05853
241 3S -0.89655 -0.51762 0.68804 0.39724 -0.39904
242 4S -0.26539 -0.15322 0.21455 0.12387 -0.13765
243 5PX -0.02972 -0.01087 0.01215 0.00173 -0.01810
244 5PY 0.01087 0.01717 -0.00173 -0.01016 0.01045
245 5PZ -0.00656 -0.00379 0.00354 0.00204 -0.00369
246 6PX -0.00747 0.00271 0.00755 0.00280 0.02429
247 6PY -0.00271 0.01060 -0.00280 -0.00431 -0.01402
248 6PZ 0.00174 0.00100 0.02225 0.01285 0.01579
249 7PX -0.34511 -0.14178 0.23524 0.04128 -0.15770
250 7PY 0.14178 0.18139 -0.04128 -0.18758 0.09105
251 7PZ -0.11951 -0.06900 -0.10012 -0.05780 -0.06484
252 8D 0 0.00591 0.00341 -0.00727 -0.00420 -0.00008
253 8D+1 -0.00698 -0.00661 -0.01043 0.00289 -0.00390
254 8D-1 0.00661 -0.00065 -0.00289 0.01376 0.00225
255 8D+2 -0.00373 -0.00696 0.00541 -0.00258 -0.00351
256 8D-2 0.01127 0.00373 -0.00367 -0.00541 0.00608
257 9D 0 0.03104 0.01792 -0.02972 -0.01716 0.01138
258 9D+1 -0.03728 -0.01633 -0.01875 -0.00888 -0.00783
259 9D-1 0.01633 0.01843 0.00888 0.00851 0.00452
260 9D+2 -0.05151 0.01194 0.03514 -0.03563 -0.01252
261 9D-2 0.04754 0.05151 -0.00495 -0.03514 0.02168
262 10F 0 0.35559 0.20530 -0.30274 -0.17478 -0.28042
263 10F+1 -0.12035 -0.07641 -0.01845 0.17764 0.07820
264 10F-1 0.07641 0.03213 -0.17764 0.22357 -0.04515
265 10F+2 0.13183 0.06622 -0.09420 -0.09592 -0.14300
266 10F-2 -0.21845 -0.13183 0.20468 0.09420 0.24769
267 10F+3 0.05838 -0.10111 -0.08005 0.13865 0.00000
268 10F-3 0.16855 0.09731 -0.07307 -0.04219 -0.04330
269 8 H 1S 0.00570 -0.00329 -0.00565 0.00326 0.01083
270 2S -0.09737 0.05622 0.02919 -0.01685 0.05853
271 3S 0.89655 -0.51762 -0.68804 0.39724 -0.39904
272 4S 0.26539 -0.15322 -0.21455 0.12387 -0.13765
273 5PX -0.02972 0.01087 0.01215 -0.00173 0.01810
274 5PY -0.01087 0.01717 0.00173 -0.01016 0.01045
275 5PZ 0.00656 -0.00379 -0.00354 0.00204 -0.00369
276 6PX -0.00747 -0.00271 0.00755 -0.00280 -0.02429
277 6PY 0.00271 0.01060 0.00280 -0.00431 -0.01402
278 6PZ -0.00174 0.00100 -0.02225 0.01285 0.01579
279 7PX -0.34511 0.14178 0.23524 -0.04128 0.15770
280 7PY -0.14178 0.18139 0.04128 -0.18758 0.09105
281 7PZ 0.11951 -0.06900 0.10012 -0.05780 -0.06484
282 8D 0 -0.00591 0.00341 0.00727 -0.00420 -0.00008
283 8D+1 -0.00698 0.00661 -0.01043 -0.00289 0.00390
284 8D-1 -0.00661 -0.00065 0.00289 0.01376 0.00225
285 8D+2 0.00373 -0.00696 -0.00541 -0.00258 -0.00351
286 8D-2 0.01127 -0.00373 -0.00367 0.00541 -0.00608
287 9D 0 -0.03104 0.01792 0.02972 -0.01716 0.01138
288 9D+1 -0.03728 0.01633 -0.01875 0.00888 0.00783
289 9D-1 -0.01633 0.01843 -0.00888 0.00851 0.00452
290 9D+2 0.05151 0.01194 -0.03514 -0.03563 -0.01252
291 9D-2 0.04754 -0.05151 -0.00495 0.03514 -0.02168
292 10F 0 -0.35559 0.20530 0.30274 -0.17478 -0.28042
293 10F+1 -0.12035 0.07641 -0.01845 -0.17764 -0.07820
294 10F-1 -0.07641 0.03213 0.17764 0.22357 -0.04515
295 10F+2 -0.13183 0.06622 0.09420 -0.09592 -0.14300
296 10F-2 -0.21845 0.13183 0.20468 -0.09420 -0.24769
297 10F+3 0.05838 0.10111 -0.08005 -0.13865 0.00000
298 10F-3 -0.16855 0.09731 0.07307 -0.04219 -0.04330
206 207 208 209 210
(A2U)--V (A2U)--V (A1U)--V (A1G)--V (EG)--V
Eigenvalues -- 6.22791 6.26954 6.31677 6.34918 6.37303
1 1 Si 1S -0.00337 -0.00117 0.00000 -0.00602 0.00000
2 2S -0.07963 -0.14218 0.00000 -0.01312 0.00000
3 3S -0.06799 -0.06352 0.00000 -0.08774 0.00000
4 4S -0.12468 -1.30610 0.00000 -0.53690 0.00000
5 5S 0.46612 4.97395 0.00000 0.90374 0.00000
6 6S 0.24496 0.63634 0.00000 -0.17521 0.00000
7 7PX 0.00000 0.00000 0.00000 0.00000 -0.37572
8 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
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187 6PY -0.03564 -0.05075 0.03957 -0.03149 -0.02278
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234 10F-1 0.08174 0.00095 0.00000 -0.12307 0.00000
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236 10F-2 0.00000 0.00000 0.26375 0.00000 -0.46132
237 10F+3 0.00000 0.00000 0.10868 0.00000 -0.08670
238 10F-3 -0.05404 0.20814 0.00000 0.24599 0.00000
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240 2S 0.00890 -0.13822 0.00000 -0.03848 0.19518
241 3S 0.27861 1.88645 0.00000 -0.14961 -1.70081
242 4S -0.00659 0.10819 0.00000 0.02641 -0.24251
243 5PX -0.01214 0.01840 0.00091 0.01923 -0.05811
244 5PY 0.00701 -0.01062 0.00158 -0.01110 0.02906
245 5PZ 0.00479 0.02522 0.00000 0.01121 -0.01761
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247 6PY -0.03564 -0.05075 0.03957 0.03149 0.02278
248 6PZ 0.02682 0.02658 0.00000 -0.01847 -0.03990
249 7PX 0.04362 0.70566 0.06191 0.04644 -0.71578
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272 4S -0.00659 0.10819 0.00000 0.02641 0.24251
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274 5PY 0.00701 -0.01062 -0.00158 -0.01110 -0.02906
275 5PZ 0.00479 0.02522 0.00000 0.01121 0.01761
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284 8D-1 -0.00254 -0.02176 0.01486 -0.01830 0.01574
285 8D+2 -0.00211 -0.00674 0.00448 -0.00506 0.02534
286 8D-2 -0.00366 -0.01168 -0.00259 -0.00876 0.03892
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288 9D+1 -0.04149 -0.12664 -0.00500 -0.04455 -0.15573
289 9D-1 -0.02395 -0.07312 0.00866 -0.02572 -0.05974
290 9D+2 0.00905 0.06645 -0.06484 -0.00618 0.09649
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292 10F 0 -0.31721 -0.20271 0.00000 -0.26156 0.08951
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295 10F+2 -0.11756 0.13223 0.22841 0.08802 0.24245
296 10F-2 -0.20362 0.22902 -0.13187 0.15246 -0.04138
297 10F+3 0.00000 0.00000 0.10868 0.00000 0.04335
298 10F-3 -0.05404 0.20814 0.00000 0.24599 -0.27011
211 212 213 214 215
(EG)--V (A2G)--V (EU)--V (EU)--V (EU)--V
Eigenvalues -- 6.37303 6.39165 6.40547 6.40547 6.48979
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98 15F-1 -0.08162 0.00000 0.15771 0.00000 0.00000
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101 15F+3 0.00000 -0.20576 0.00000 0.00000 0.00000
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105 16F-1 0.01860 0.00000 -0.07315 0.00000 0.00000
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117 17G+4 -0.09059 0.00000 0.09120 0.00000 0.00000
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120 2S -0.22538 0.00000 -0.14614 0.00000 0.00000
121 3S 1.96393 0.00000 1.09103 0.00000 0.00000
122 4S 0.28003 0.00000 0.25995 0.00000 0.00000
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124 5PY -0.07489 0.00000 -0.04940 0.00000 0.00000
125 5PZ -0.02033 0.00000 -0.02811 0.00000 0.00000
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131 7PZ -0.46388 0.00000 -0.38347 0.00000 0.00000
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141 9D-2 0.00000 -0.07211 0.00000 0.00047 0.11965
142 10F 0 -0.10336 0.00000 -0.16947 0.00000 0.00000
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144 10F-1 -0.01678 0.00000 -0.12620 0.00000 0.00000
145 10F+2 0.09860 0.00000 0.07669 0.00000 0.00000
146 10F-2 0.00000 -0.27917 0.00000 0.44985 0.00096
147 10F+3 0.00000 -0.07145 0.00000 0.03668 0.40554
148 10F-3 0.31189 0.00000 0.30505 0.00000 0.00000
149 4 H 1S -0.00572 0.00000 0.00463 -0.00802 -0.00615
150 2S 0.11269 0.00000 0.07307 -0.12656 -0.07822
151 3S -0.98197 0.00000 -0.54551 0.94486 0.75711
152 4S -0.14002 0.00000 -0.12998 0.22513 0.23253
153 5PX -0.02906 -0.00227 -0.01726 0.03944 0.03706
154 5PY -0.02456 0.00392 -0.01950 0.01726 0.04786
155 5PZ 0.01017 0.00000 0.01406 -0.02435 0.01353
156 6PX -0.02278 -0.02674 -0.00704 -0.00958 -0.00135
157 6PY -0.00685 0.04632 0.01771 0.00704 -0.02306
158 6PZ 0.02304 0.00000 0.01438 -0.02490 -0.02927
159 7PX -0.43315 -0.05559 -0.22365 0.39572 0.31887
160 7PY -0.21562 0.09628 -0.13747 0.22365 0.28722
161 7PZ 0.23194 0.00000 0.19173 -0.33209 -0.11287
162 8D 0 0.00392 0.00000 -0.00422 0.00731 -0.05283
163 8D+1 -0.01574 -0.01350 -0.01443 -0.01933 0.01076
164 8D-1 0.03665 0.02338 0.03600 0.01443 0.00616
165 8D+2 -0.00966 0.01017 0.00446 0.02514 -0.01633
166 8D-2 -0.02534 -0.00587 -0.02514 0.02457 0.05435
167 9D 0 0.02643 0.00000 -0.00859 0.01489 -0.08624
168 9D+1 0.05974 -0.01108 0.04025 -0.12529 -0.03292
169 9D-1 0.08675 0.01920 0.07882 -0.04025 -0.02310
170 9D+2 -0.07179 -0.06245 -0.03492 0.05966 0.00226
171 9D-2 -0.09649 0.03605 -0.05966 0.10381 0.12357
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173 10F+1 0.00118 0.15607 -0.07808 0.08113 -0.23284
174 10F-1 -0.01882 -0.27033 0.00903 0.07808 -0.23357
175 10F+2 -0.32134 -0.24177 -0.31822 -0.22800 -0.00617
176 10F-2 0.24245 0.13959 0.22800 0.05495 -0.00972
177 10F+3 -0.07508 -0.07145 -0.03177 -0.01834 -0.20277
178 10F-3 -0.15595 0.00000 -0.15253 0.26419 0.11926
179 5 H 1S -0.00572 0.00000 0.00463 0.00802 0.00615
180 2S 0.11269 0.00000 0.07307 0.12656 0.07822
181 3S -0.98197 0.00000 -0.54551 -0.94486 -0.75711
182 4S -0.14002 0.00000 -0.12998 -0.22513 -0.23253
183 5PX 0.02906 -0.00227 0.01726 0.03944 0.03706
184 5PY -0.02456 -0.00392 -0.01950 -0.01726 -0.04786
185 5PZ 0.01017 0.00000 0.01406 0.02435 -0.01353
186 6PX 0.02278 -0.02674 0.00704 -0.00958 -0.00135
187 6PY -0.00685 -0.04632 0.01771 -0.00704 0.02306
188 6PZ 0.02304 0.00000 0.01438 0.02490 0.02927
189 7PX 0.43315 -0.05559 0.22365 0.39572 0.31887
190 7PY -0.21562 -0.09628 -0.13747 -0.22365 -0.28722
191 7PZ 0.23194 0.00000 0.19173 0.33209 0.11287
192 8D 0 0.00392 0.00000 -0.00422 -0.00731 0.05283
193 8D+1 0.01574 -0.01350 0.01443 -0.01933 0.01076
194 8D-1 0.03665 -0.02338 0.03600 -0.01443 -0.00616
195 8D+2 -0.00966 -0.01017 0.00446 -0.02514 0.01633
196 8D-2 0.02534 -0.00587 0.02514 0.02457 0.05435
197 9D 0 0.02643 0.00000 -0.00859 -0.01489 0.08624
198 9D+1 -0.05974 -0.01108 -0.04025 -0.12529 -0.03292
199 9D-1 0.08675 -0.01920 0.07882 0.04025 0.02310
200 9D+2 -0.07179 0.06245 -0.03492 -0.05966 -0.00226
201 9D-2 0.09649 0.03605 0.05966 0.10381 0.12357
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203 10F+1 -0.00118 0.15607 0.07808 0.08113 -0.23284
204 10F-1 -0.01882 0.27033 0.00903 -0.07808 0.23357
205 10F+2 -0.32134 0.24177 -0.31822 0.22800 0.00617
206 10F-2 -0.24245 0.13959 -0.22800 0.05495 -0.00972
207 10F+3 0.07508 -0.07145 0.03177 -0.01834 -0.20277
208 10F-3 -0.15595 0.00000 -0.15253 -0.26419 -0.11926
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211 3S 1.96393 0.00000 -1.09103 0.00000 0.00000
212 4S 0.28003 0.00000 -0.25995 0.00000 0.00000
213 5PX 0.00000 -0.00453 0.00000 0.00954 -0.04584
214 5PY 0.07489 0.00000 -0.04940 0.00000 0.00000
215 5PZ 0.02033 0.00000 -0.02811 0.00000 0.00000
216 6PX 0.00000 -0.05348 0.00000 -0.02178 0.03859
217 6PY 0.04630 0.00000 0.00551 0.00000 0.00000
218 6PZ 0.04607 0.00000 -0.02876 0.00000 0.00000
219 7PX 0.00000 -0.11118 0.00000 0.00834 -0.17861
220 7PY 0.96586 0.00000 -0.52484 0.00000 0.00000
221 7PZ 0.46388 0.00000 -0.38347 0.00000 0.00000
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224 8D-1 0.00938 0.00000 -0.01099 0.00000 0.00000
225 8D+2 -0.05355 0.00000 0.03909 0.00000 0.00000
226 8D-2 0.00000 0.01175 0.00000 0.01898 -0.08263
227 9D 0 -0.05286 0.00000 -0.01719 0.00000 0.00000
228 9D+1 0.00000 0.02217 0.00000 0.05558 -0.00709
229 9D-1 0.19023 0.00000 -0.14853 0.00000 0.00000
230 9D+2 -0.23891 0.00000 0.13826 0.00000 0.00000
231 9D-2 0.00000 -0.07211 0.00000 -0.00047 -0.11965
232 10F 0 0.10336 0.00000 -0.16947 0.00000 0.00000
233 10F+1 0.00000 0.31215 0.00000 -0.05410 0.17171
234 10F-1 0.01678 0.00000 -0.12620 0.00000 0.00000
235 10F+2 -0.09860 0.00000 0.07669 0.00000 0.00000
236 10F-2 0.00000 0.27917 0.00000 0.44985 0.00096
237 10F+3 0.00000 0.07145 0.00000 0.03668 0.40554
238 10F-3 -0.31189 0.00000 0.30505 0.00000 0.00000
239 7 H 1S -0.00572 0.00000 -0.00463 -0.00802 -0.00615
240 2S 0.11269 0.00000 -0.07307 -0.12656 -0.07822
241 3S -0.98197 0.00000 0.54551 0.94486 0.75711
242 4S -0.14002 0.00000 0.12998 0.22513 0.23253
243 5PX -0.02906 0.00227 0.01726 0.03944 0.03706
244 5PY 0.02456 0.00392 -0.01950 -0.01726 -0.04786
245 5PZ -0.01017 0.00000 0.01406 0.02435 -0.01353
246 6PX -0.02278 0.02674 0.00704 -0.00958 -0.00135
247 6PY 0.00685 0.04632 0.01771 -0.00704 0.02306
248 6PZ -0.02304 0.00000 0.01438 0.02490 0.02927
249 7PX -0.43315 0.05559 0.22365 0.39572 0.31887
250 7PY 0.21562 0.09628 -0.13747 -0.22365 -0.28722
251 7PZ -0.23194 0.00000 0.19173 0.33209 0.11287
252 8D 0 0.00392 0.00000 0.00422 0.00731 -0.05283
253 8D+1 0.01574 -0.01350 -0.01443 0.01933 -0.01076
254 8D-1 0.03665 -0.02338 -0.03600 0.01443 0.00616
255 8D+2 -0.00966 -0.01017 -0.00446 0.02514 -0.01633
256 8D-2 0.02534 -0.00587 -0.02514 -0.02457 -0.05435
257 9D 0 0.02643 0.00000 0.00859 0.01489 -0.08624
258 9D+1 -0.05974 -0.01108 0.04025 0.12529 0.03292
259 9D-1 0.08675 -0.01920 -0.07882 -0.04025 -0.02310
260 9D+2 -0.07179 0.06245 0.03492 0.05966 0.00226
261 9D-2 0.09649 0.03605 -0.05966 -0.10381 -0.12357
262 10F 0 -0.05168 0.00000 0.08473 0.14676 -0.03322
263 10F+1 0.00118 -0.15607 0.07808 0.08113 -0.23284
264 10F-1 0.01882 -0.27033 0.00903 -0.07808 0.23357
265 10F+2 0.32134 -0.24177 -0.31822 0.22800 0.00617
266 10F-2 0.24245 -0.13959 -0.22800 0.05495 -0.00972
267 10F+3 -0.07508 0.07145 0.03177 -0.01834 -0.20277
268 10F-3 0.15595 0.00000 -0.15253 -0.26419 -0.11926
269 8 H 1S -0.00572 0.00000 -0.00463 0.00802 0.00615
270 2S 0.11269 0.00000 -0.07307 0.12656 0.07822
271 3S -0.98197 0.00000 0.54551 -0.94486 -0.75711
272 4S -0.14002 0.00000 0.12998 -0.22513 -0.23253
273 5PX 0.02906 0.00227 -0.01726 0.03944 0.03706
274 5PY 0.02456 -0.00392 -0.01950 0.01726 0.04786
275 5PZ -0.01017 0.00000 0.01406 -0.02435 0.01353
276 6PX 0.02278 0.02674 -0.00704 -0.00958 -0.00135
277 6PY 0.00685 -0.04632 0.01771 0.00704 -0.02306
278 6PZ -0.02304 0.00000 0.01438 -0.02490 -0.02927
279 7PX 0.43315 0.05559 -0.22365 0.39572 0.31887
280 7PY 0.21562 -0.09628 -0.13747 0.22365 0.28722
281 7PZ -0.23194 0.00000 0.19173 -0.33209 -0.11287
282 8D 0 0.00392 0.00000 0.00422 -0.00731 0.05283
283 8D+1 -0.01574 -0.01350 0.01443 0.01933 -0.01076
284 8D-1 0.03665 0.02338 -0.03600 -0.01443 -0.00616
285 8D+2 -0.00966 0.01017 -0.00446 -0.02514 0.01633
286 8D-2 -0.02534 -0.00587 0.02514 -0.02457 -0.05435
287 9D 0 0.02643 0.00000 0.00859 -0.01489 0.08624
288 9D+1 0.05974 -0.01108 -0.04025 0.12529 0.03292
289 9D-1 0.08675 0.01920 -0.07882 0.04025 0.02310
290 9D+2 -0.07179 -0.06245 0.03492 -0.05966 -0.00226
291 9D-2 -0.09649 0.03605 0.05966 -0.10381 -0.12357
292 10F 0 -0.05168 0.00000 0.08473 -0.14676 0.03322
293 10F+1 -0.00118 -0.15607 -0.07808 0.08113 -0.23284
294 10F-1 0.01882 0.27033 0.00903 0.07808 -0.23357
295 10F+2 0.32134 0.24177 -0.31822 -0.22800 -0.00617
296 10F-2 -0.24245 -0.13959 0.22800 0.05495 -0.00972
297 10F+3 0.07508 0.07145 -0.03177 -0.01834 -0.20277
298 10F-3 0.15595 0.00000 -0.15253 0.26419 0.11926
216 217 218 219 220
(EU)--V (A2U)--V (EG)--V (EG)--V (A1G)--V
Eigenvalues -- 6.48979 6.52011 6.54290 6.54290 6.56495
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2 2S 0.00000 -0.08537 0.00000 0.00000 0.01094
3 3S 0.00000 -0.11211 0.00000 0.00000 -0.08356
4 4S 0.00000 -0.76907 0.00000 0.00000 -1.95947
5 5S 0.00000 2.36835 0.00000 0.00000 4.69833
6 6S 0.00000 -0.48553 0.00000 0.00000 0.55582
7 7PX 0.00000 0.00000 -0.04243 0.00000 0.00000
8 7PY 0.17039 0.00000 0.00000 0.04243 0.00000
9 7PZ 0.00000 -0.34125 0.00000 0.00000 -0.51548
10 8PX 0.00000 0.00000 -0.07665 0.00000 0.00000
11 8PY 0.15016 0.00000 0.00000 0.07665 0.00000
12 8PZ 0.00000 -0.45109 0.00000 0.00000 -0.64298
13 9PX 0.00000 0.00000 0.01493 0.00000 0.00000
14 9PY -0.59366 0.00000 0.00000 -0.01493 0.00000
15 9PZ 0.00000 0.40076 0.00000 0.00000 1.06799
16 10PX 0.00000 0.00000 0.58528 0.00000 0.00000
17 10PY -0.69503 0.00000 0.00000 -0.58528 0.00000
18 10PZ 0.00000 0.94449 0.00000 0.00000 0.71084
19 11PX 0.00000 0.00000 -0.12985 0.00000 0.00000
20 11PY -0.12418 0.00000 0.00000 0.12985 0.00000
21 11PZ 0.00000 0.06911 0.00000 0.00000 -0.20652
22 12D 0 0.00000 -0.28268 0.00000 0.00000 0.15005
23 12D+1 0.00000 0.00000 -0.03995 0.00000 0.00000
24 12D-1 -0.11143 0.00000 0.00000 0.03995 0.00000
25 12D+2 0.18935 0.00000 0.00000 0.09817 0.00000
26 12D-2 0.00000 0.00000 -0.09817 0.00000 0.00000
27 13D 0 0.00000 -0.79137 0.00000 0.00000 -0.98971
28 13D+1 0.00000 0.00000 0.12927 0.00000 0.00000
29 13D-1 -0.33850 0.00000 0.00000 -0.12927 0.00000
30 13D+2 0.09412 0.00000 0.00000 0.55667 0.00000
31 13D-2 0.00000 0.00000 -0.55667 0.00000 0.00000
32 14D 0 0.00000 0.07896 0.00000 0.00000 -0.04716
33 14D+1 0.00000 0.00000 -0.14882 0.00000 0.00000
34 14D-1 -0.15732 0.00000 0.00000 0.14882 0.00000
35 14D+2 -0.00822 0.00000 0.00000 0.04342 0.00000
36 14D-2 0.00000 0.00000 -0.04342 0.00000 0.00000
37 15F 0 0.00000 -0.04537 0.00000 0.00000 -0.65624
38 15F+1 0.00000 0.00000 0.01929 0.00000 0.00000
39 15F-1 0.07551 0.00000 0.00000 -0.01929 0.00000
40 15F+2 -0.00676 0.00000 0.00000 0.09858 0.00000
41 15F-2 0.00000 0.00000 -0.09858 0.00000 0.00000
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175 10F+2 0.00260 0.02395 -0.05051 -0.10903 0.04535
176 10F-2 0.00617 0.04148 0.05070 0.05051 0.07854
177 10F+3 -0.35121 0.00000 0.23943 0.41470 0.00000
178 10F-3 -0.06886 -0.03819 -0.05711 0.03297 0.14791
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180 2S 0.04516 0.05116 0.06534 0.03772 0.11245
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182 4S -0.13425 0.01555 0.05459 0.03152 -0.12282
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186 6PX -0.02306 0.08932 0.04410 0.04766 0.08314
187 6PY -0.02528 -0.05157 -0.04766 0.01094 -0.04800
188 6PZ 0.01690 0.01271 -0.00929 -0.00537 0.04781
189 7PX 0.28722 0.28125 0.22153 -0.01553 0.59696
190 7PY 0.01278 -0.16238 0.01553 -0.23946 -0.34466
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199 9D-1 0.00624 0.05426 0.00701 0.04803 0.09860
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212 4S -0.26851 -0.01555 0.00000 -0.06303 -0.12282
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218 6PZ -0.03380 0.01271 0.00000 -0.01073 -0.04781
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221 7PZ -0.13033 0.28597 0.00000 0.17931 -0.43548
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226 8D-2 0.00000 0.00000 -0.09859 0.00000 0.00000
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228 9D+1 0.00000 0.00000 -0.04399 0.00000 0.00000
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230 9D+2 0.12487 -0.04247 0.00000 -0.02578 0.04776
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235 10F+2 0.01328 -0.04790 0.00000 0.02154 0.09069
236 10F-2 0.00000 0.00000 -0.13819 0.00000 0.00000
237 10F+3 0.00000 0.00000 0.47886 0.00000 0.00000
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239 7 H 1S -0.00355 0.02226 -0.02265 -0.01308 -0.02384
240 2S -0.04516 -0.05116 0.06534 0.03772 0.11245
241 3S 0.43712 1.02335 -0.61105 -0.35279 -1.92124
242 4S 0.13425 -0.01555 0.05459 0.03152 -0.12282
243 5PX 0.04786 -0.02125 -0.01056 0.03278 0.01952
244 5PY 0.01821 0.01227 -0.03278 0.04842 -0.01127
245 5PZ -0.00781 0.03514 -0.01585 -0.00915 -0.05563
246 6PX -0.02306 0.08932 -0.04410 -0.04766 -0.08314
247 6PY -0.02528 -0.05157 0.04766 -0.01094 0.04800
248 6PZ 0.01690 0.01271 0.00929 0.00537 -0.04781
249 7PX 0.28722 0.28125 -0.22153 0.01553 -0.59696
250 7PY 0.01278 -0.16238 -0.01553 0.23946 0.34466
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267 10F+3 0.35121 0.00000 -0.23943 0.41470 0.00000
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272 4S 0.13425 -0.01555 -0.05459 0.03152 -0.12282
273 5PX -0.04786 0.02125 -0.01056 -0.03278 -0.01952
274 5PY 0.01821 0.01227 0.03278 0.04842 -0.01127
275 5PZ -0.00781 0.03514 0.01585 -0.00915 -0.05563
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279 7PX -0.28722 -0.28125 -0.22153 -0.01553 0.59696
280 7PY 0.01278 -0.16238 0.01553 0.23946 0.34466
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282 8D 0 -0.03050 0.05660 0.04022 -0.02322 -0.04102
283 8D+1 0.00616 -0.02018 -0.01667 -0.00064 0.02845
284 8D-1 0.00365 -0.01165 0.00064 0.01741 0.01643
285 8D+2 0.07320 -0.00932 0.03173 0.08027 0.01722
286 8D-2 -0.01633 -0.01614 -0.04363 -0.03173 0.02983
287 9D 0 -0.04979 0.05561 0.02613 -0.01508 -0.04574
288 9D+1 -0.02310 -0.09397 -0.05612 0.00701 0.17079
289 9D-1 -0.00624 -0.05426 -0.00701 0.04803 0.09860
290 9D+2 0.12096 0.02123 0.08287 0.11775 -0.02388
291 9D-2 0.00226 0.03678 -0.02206 -0.08287 -0.04136
292 10F 0 -0.01918 0.10239 -0.03207 0.01852 -0.01217
293 10F+1 0.23357 -0.33755 -0.16424 0.18659 0.31574
294 10F-1 -0.03686 -0.19488 -0.18659 -0.05121 0.18229
295 10F+2 0.00260 0.02395 0.05051 0.10903 -0.04535
296 10F-2 0.00617 0.04148 -0.05070 -0.05051 -0.07854
297 10F+3 -0.35121 0.00000 -0.23943 -0.41470 0.00000
298 10F-3 -0.06886 -0.03819 0.05711 -0.03297 -0.14791
221 222 223 224 225
(EU)--V (EU)--V (A2U)--V (EG)--V (EG)--V
Eigenvalues -- 6.66185 6.66185 6.66773 6.68643 6.68643
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33 14D+1 0.06538 0.00000 0.00000 0.15922 0.00000
34 14D-1 0.00000 -0.06538 0.00000 0.00000 -0.15922
35 14D+2 0.00000 0.19978 0.00000 0.00000 0.15494
36 14D-2 -0.19978 0.00000 0.00000 -0.15494 0.00000
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43 15F-3 0.00000 0.00000 -0.52412 0.00000 0.00000
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47 16F+2 0.00000 0.45636 0.00000 0.00000 0.25240
48 16F-2 -0.45636 0.00000 0.00000 -0.25240 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 -0.49642 0.00000 0.00000
51 17G 0 0.00000 0.00000 -0.02927 0.00000 0.00000
52 17G+1 -0.22703 0.00000 0.00000 -0.42251 0.00000
53 17G-1 0.00000 0.22703 0.00000 0.00000 0.42251
54 17G+2 0.00000 -0.07862 0.00000 0.00000 -0.07625
55 17G-2 0.07862 0.00000 0.00000 0.07625 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 -0.32408 0.00000 0.00000
58 17G+4 0.00000 0.09797 0.00000 0.00000 0.13753
59 17G-4 0.09797 0.00000 0.00000 0.13753 0.00000
60 2 Si 1S 0.00000 0.00000 -0.00583 0.00000 0.00000
61 2S 0.00000 0.00000 0.18324 0.00000 0.00000
62 3S 0.00000 0.00000 -0.01017 0.00000 0.00000
63 4S 0.00000 0.00000 1.61853 0.00000 0.00000
64 5S 0.00000 0.00000 -6.59390 0.00000 0.00000
65 6S 0.00000 0.00000 -1.66144 0.00000 0.00000
66 7PX -0.52678 0.00000 0.00000 0.37113 0.00000
67 7PY 0.00000 0.52678 0.00000 0.00000 -0.37113
68 7PZ 0.00000 0.00000 -0.28769 0.00000 0.00000
69 8PX -0.55223 0.00000 0.00000 0.38170 0.00000
70 8PY 0.00000 0.55223 0.00000 0.00000 -0.38170
71 8PZ 0.00000 0.00000 -0.27208 0.00000 0.00000
72 9PX 1.53261 0.00000 0.00000 -1.04058 0.00000
73 9PY 0.00000 -1.53261 0.00000 0.00000 1.04058
74 9PZ 0.00000 0.00000 1.05192 0.00000 0.00000
75 10PX 2.68944 0.00000 0.00000 -1.99159 0.00000
76 10PY 0.00000 -2.68944 0.00000 0.00000 1.99159
77 10PZ 0.00000 0.00000 0.16485 0.00000 0.00000
78 11PX 0.32040 0.00000 0.00000 -0.20585 0.00000
79 11PY 0.00000 -0.32040 0.00000 0.00000 0.20585
80 11PZ 0.00000 0.00000 -0.15712 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.03262 0.00000 0.00000
82 12D+1 -0.47596 0.00000 0.00000 -0.14489 0.00000
83 12D-1 0.00000 0.47596 0.00000 0.00000 0.14489
84 12D+2 0.00000 -0.93601 0.00000 0.00000 0.33540
85 12D-2 0.93601 0.00000 0.00000 -0.33540 0.00000
86 13D 0 0.00000 0.00000 0.18327 0.00000 0.00000
87 13D+1 -0.89007 0.00000 0.00000 0.34259 0.00000
88 13D-1 0.00000 0.89007 0.00000 0.00000 -0.34259
89 13D+2 0.00000 -1.30708 0.00000 0.00000 0.82152
90 13D-2 1.30708 0.00000 0.00000 -0.82152 0.00000
91 14D 0 0.00000 0.00000 0.21881 0.00000 0.00000
92 14D+1 -0.06538 0.00000 0.00000 0.15922 0.00000
93 14D-1 0.00000 0.06538 0.00000 0.00000 -0.15922
94 14D+2 0.00000 -0.19978 0.00000 0.00000 0.15494
95 14D-2 0.19978 0.00000 0.00000 -0.15494 0.00000
96 15F 0 0.00000 0.00000 -0.49667 0.00000 0.00000
97 15F+1 -0.17047 0.00000 0.00000 -0.27264 0.00000
98 15F-1 0.00000 0.17047 0.00000 0.00000 0.27264
99 15F+2 0.00000 0.26206 0.00000 0.00000 -0.14165
100 15F-2 -0.26206 0.00000 0.00000 0.14165 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 -0.52412 0.00000 0.00000
103 16F 0 0.00000 0.00000 -0.33413 0.00000 0.00000
104 16F+1 -0.12018 0.00000 0.00000 0.10531 0.00000
105 16F-1 0.00000 0.12018 0.00000 0.00000 -0.10531
106 16F+2 0.00000 0.45636 0.00000 0.00000 -0.25240
107 16F-2 -0.45636 0.00000 0.00000 0.25240 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 -0.49642 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.02927 0.00000 0.00000
111 17G+1 0.22703 0.00000 0.00000 -0.42251 0.00000
112 17G-1 0.00000 -0.22703 0.00000 0.00000 0.42251
113 17G+2 0.00000 0.07862 0.00000 0.00000 -0.07625
114 17G-2 -0.07862 0.00000 0.00000 0.07625 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.32408 0.00000 0.00000
117 17G+4 0.00000 -0.09797 0.00000 0.00000 0.13753
118 17G-4 -0.09797 0.00000 0.00000 0.13753 0.00000
119 3 H 1S 0.00000 0.09409 -0.11106 0.00000 0.07990
120 2S 0.00000 -0.38682 0.22557 0.00000 -0.24839
121 3S 0.00000 3.61009 -2.42893 0.00000 2.16447
122 4S 0.00000 0.79367 -0.29619 0.00000 0.35314
123 5PX 0.05075 0.00000 0.00000 0.03122 0.00000
124 5PY 0.00000 -0.13922 0.07609 0.00000 -0.09462
125 5PZ 0.00000 -0.03021 0.02338 0.00000 -0.01376
126 6PX -0.01821 0.00000 0.00000 0.00905 0.00000
127 6PY 0.00000 -0.14951 0.13910 0.00000 -0.10881
128 6PZ 0.00000 -0.04637 0.02567 0.00000 -0.02415
129 7PX 0.22140 0.00000 0.00000 0.06885 0.00000
130 7PY 0.00000 -1.55336 1.06060 0.00000 -1.03341
131 7PZ 0.00000 -0.65556 0.38089 0.00000 -0.42578
132 8D 0 0.00000 -0.04544 0.00171 0.00000 -0.04188
133 8D+1 -0.03556 0.00000 0.00000 -0.03618 0.00000
134 8D-1 0.00000 0.05152 -0.02760 0.00000 0.05213
135 8D+2 0.00000 -0.02698 0.06108 0.00000 -0.01737
136 8D-2 -0.04623 0.00000 0.00000 -0.00339 0.00000
137 9D 0 0.00000 -0.20882 0.10583 0.00000 -0.17635
138 9D+1 -0.07430 0.00000 0.00000 -0.06845 0.00000
139 9D-1 0.00000 0.29137 -0.14423 0.00000 0.22908
140 9D+2 0.00000 -0.32440 0.27068 0.00000 -0.20430
141 9D-2 -0.11476 0.00000 0.00000 -0.04615 0.00000
142 10F 0 0.00000 0.35505 -0.08750 0.00000 0.38998
143 10F+1 0.05635 0.00000 0.00000 0.17546 0.00000
144 10F-1 0.00000 0.24942 -0.05630 0.00000 0.27449
145 10F+2 0.00000 0.17428 -0.19639 0.00000 0.25102
146 10F-2 0.14643 0.00000 0.00000 0.11611 0.00000
147 10F+3 -0.30990 0.00000 0.00000 -0.13568 0.00000
148 10F-3 0.00000 0.03203 -0.36626 0.00000 -0.13172
149 4 H 1S 0.08149 -0.04705 -0.11106 0.06920 -0.03995
150 2S -0.33500 0.19341 0.22557 -0.21511 0.12420
151 3S 3.12643 -1.80504 -2.42893 1.87448 -1.08223
152 4S 0.68733 -0.39683 -0.29619 0.30583 -0.17657
153 5PX 0.11710 -0.03831 -0.06590 0.07877 -0.02745
154 5PY 0.03831 -0.07287 -0.03805 0.02745 -0.04707
155 5PZ -0.02616 0.01510 0.02338 -0.01192 0.00688
156 6PX 0.10758 -0.07262 -0.12047 0.08387 -0.04320
157 6PY 0.07262 -0.02372 -0.06955 0.04320 -0.03399
158 6PZ -0.04016 0.02319 0.02567 -0.02091 0.01207
159 7PX 1.22037 -0.57675 -0.91851 0.79227 -0.41766
160 7PY 0.57675 -0.55439 -0.53030 0.41766 -0.30999
161 7PZ -0.56773 0.32778 0.38089 -0.36874 0.21289
162 8D 0 -0.03935 0.02272 0.00171 -0.03627 0.02094
163 8D+1 -0.04753 0.00691 0.02391 -0.04815 0.00691
164 8D-1 -0.00691 0.03955 0.01380 -0.00691 0.04017
165 8D+2 0.03170 0.02793 -0.03054 0.00899 -0.00180
166 8D-2 0.00868 -0.03170 -0.05290 0.01218 -0.00899
167 9D 0 -0.18084 0.10441 0.10583 -0.15272 0.08817
168 9D+1 -0.23711 0.09399 0.12491 -0.18892 0.06955
169 9D-1 -0.09399 0.12857 0.07212 -0.06955 0.10861
170 9D+2 0.19016 0.00497 -0.13534 0.10845 -0.01646
171 9D-2 0.21461 -0.19016 -0.23441 0.14169 -0.10845
172 10F 0 0.30748 -0.17752 -0.08750 0.33773 -0.19499
173 10F+1 -0.17298 0.13240 0.04876 -0.16200 0.19483
174 10F-1 -0.13240 0.02009 0.02815 -0.19483 -0.06297
175 10F+2 -0.13887 -0.06625 0.09820 -0.15897 -0.02432
176 10F-2 -0.09410 0.13887 0.17008 -0.15924 0.15897
177 10F+3 0.15495 0.26839 0.00000 0.06784 0.11750
178 10F-3 0.02774 -0.01602 -0.36626 -0.11408 0.06586
179 5 H 1S -0.08149 -0.04705 -0.11106 -0.06920 -0.03995
180 2S 0.33500 0.19341 0.22557 0.21511 0.12420
181 3S -3.12643 -1.80504 -2.42893 -1.87448 -1.08223
182 4S -0.68733 -0.39683 -0.29619 -0.30583 -0.17657
183 5PX 0.11710 0.03831 0.06590 0.07877 0.02745
184 5PY -0.03831 -0.07287 -0.03805 -0.02745 -0.04707
185 5PZ 0.02616 0.01510 0.02338 0.01192 0.00688
186 6PX 0.10758 0.07262 0.12047 0.08387 0.04320
187 6PY -0.07262 -0.02372 -0.06955 -0.04320 -0.03399
188 6PZ 0.04016 0.02319 0.02567 0.02091 0.01207
189 7PX 1.22037 0.57675 0.91851 0.79227 0.41766
190 7PY -0.57675 -0.55439 -0.53030 -0.41766 -0.30999
191 7PZ 0.56773 0.32778 0.38089 0.36874 0.21289
192 8D 0 0.03935 0.02272 0.00171 0.03627 0.02094
193 8D+1 -0.04753 -0.00691 -0.02391 -0.04815 -0.00691
194 8D-1 0.00691 0.03955 0.01380 0.00691 0.04017
195 8D+2 -0.03170 0.02793 -0.03054 -0.00899 -0.00180
196 8D-2 0.00868 0.03170 0.05290 0.01218 0.00899
197 9D 0 0.18084 0.10441 0.10583 0.15272 0.08817
198 9D+1 -0.23711 -0.09399 -0.12491 -0.18892 -0.06955
199 9D-1 0.09399 0.12857 0.07212 0.06955 0.10861
200 9D+2 -0.19016 0.00497 -0.13534 -0.10845 -0.01646
201 9D-2 0.21461 0.19016 0.23441 0.14169 0.10845
202 10F 0 -0.30748 -0.17752 -0.08750 -0.33773 -0.19499
203 10F+1 -0.17298 -0.13240 -0.04876 -0.16200 -0.19483
204 10F-1 0.13240 0.02009 0.02815 0.19483 -0.06297
205 10F+2 0.13887 -0.06625 0.09820 0.15897 -0.02432
206 10F-2 -0.09410 -0.13887 -0.17008 -0.15924 -0.15897
207 10F+3 0.15495 -0.26839 0.00000 0.06784 -0.11750
208 10F-3 -0.02774 -0.01602 -0.36626 0.11408 0.06586
209 6 H 1S 0.00000 -0.09409 0.11106 0.00000 0.07990
210 2S 0.00000 0.38682 -0.22557 0.00000 -0.24839
211 3S 0.00000 -3.61009 2.42893 0.00000 2.16447
212 4S 0.00000 -0.79367 0.29619 0.00000 0.35314
213 5PX 0.05075 0.00000 0.00000 -0.03122 0.00000
214 5PY 0.00000 -0.13922 0.07609 0.00000 0.09462
215 5PZ 0.00000 -0.03021 0.02338 0.00000 0.01376
216 6PX -0.01821 0.00000 0.00000 -0.00905 0.00000
217 6PY 0.00000 -0.14951 0.13910 0.00000 0.10881
218 6PZ 0.00000 -0.04637 0.02567 0.00000 0.02415
219 7PX 0.22140 0.00000 0.00000 -0.06885 0.00000
220 7PY 0.00000 -1.55336 1.06060 0.00000 1.03341
221 7PZ 0.00000 -0.65556 0.38089 0.00000 0.42578
222 8D 0 0.00000 0.04544 -0.00171 0.00000 -0.04188
223 8D+1 0.03556 0.00000 0.00000 -0.03618 0.00000
224 8D-1 0.00000 -0.05152 0.02760 0.00000 0.05213
225 8D+2 0.00000 0.02698 -0.06108 0.00000 -0.01737
226 8D-2 0.04623 0.00000 0.00000 -0.00339 0.00000
227 9D 0 0.00000 0.20882 -0.10583 0.00000 -0.17635
228 9D+1 0.07430 0.00000 0.00000 -0.06845 0.00000
229 9D-1 0.00000 -0.29137 0.14423 0.00000 0.22908
230 9D+2 0.00000 0.32440 -0.27068 0.00000 -0.20430
231 9D-2 0.11476 0.00000 0.00000 -0.04615 0.00000
232 10F 0 0.00000 0.35505 -0.08750 0.00000 -0.38998
233 10F+1 0.05635 0.00000 0.00000 -0.17546 0.00000
234 10F-1 0.00000 0.24942 -0.05630 0.00000 -0.27449
235 10F+2 0.00000 0.17428 -0.19639 0.00000 -0.25102
236 10F-2 0.14643 0.00000 0.00000 -0.11611 0.00000
237 10F+3 -0.30990 0.00000 0.00000 0.13568 0.00000
238 10F-3 0.00000 0.03203 -0.36626 0.00000 0.13172
239 7 H 1S 0.08149 0.04705 0.11106 -0.06920 -0.03995
240 2S -0.33500 -0.19341 -0.22557 0.21511 0.12420
241 3S 3.12643 1.80504 2.42893 -1.87448 -1.08223
242 4S 0.68733 0.39683 0.29619 -0.30583 -0.17657
243 5PX 0.11710 0.03831 0.06590 -0.07877 -0.02745
244 5PY -0.03831 -0.07287 -0.03805 0.02745 0.04707
245 5PZ 0.02616 0.01510 0.02338 -0.01192 -0.00688
246 6PX 0.10758 0.07262 0.12047 -0.08387 -0.04320
247 6PY -0.07262 -0.02372 -0.06955 0.04320 0.03399
248 6PZ 0.04016 0.02319 0.02567 -0.02091 -0.01207
249 7PX 1.22037 0.57675 0.91851 -0.79227 -0.41766
250 7PY -0.57675 -0.55439 -0.53030 0.41766 0.30999
251 7PZ 0.56773 0.32778 0.38089 -0.36874 -0.21289
252 8D 0 -0.03935 -0.02272 -0.00171 0.03627 0.02094
253 8D+1 0.04753 0.00691 0.02391 -0.04815 -0.00691
254 8D-1 -0.00691 -0.03955 -0.01380 0.00691 0.04017
255 8D+2 0.03170 -0.02793 0.03054 -0.00899 -0.00180
256 8D-2 -0.00868 -0.03170 -0.05290 0.01218 0.00899
257 9D 0 -0.18084 -0.10441 -0.10583 0.15272 0.08817
258 9D+1 0.23711 0.09399 0.12491 -0.18892 -0.06955
259 9D-1 -0.09399 -0.12857 -0.07212 0.06955 0.10861
260 9D+2 0.19016 -0.00497 0.13534 -0.10845 -0.01646
261 9D-2 -0.21461 -0.19016 -0.23441 0.14169 0.10845
262 10F 0 -0.30748 -0.17752 -0.08750 0.33773 0.19499
263 10F+1 -0.17298 -0.13240 -0.04876 0.16200 0.19483
264 10F-1 0.13240 0.02009 0.02815 -0.19483 0.06297
265 10F+2 0.13887 -0.06625 0.09820 -0.15897 0.02432
266 10F-2 -0.09410 -0.13887 -0.17008 0.15924 0.15897
267 10F+3 0.15495 -0.26839 0.00000 -0.06784 0.11750
268 10F-3 -0.02774 -0.01602 -0.36626 -0.11408 -0.06586
269 8 H 1S -0.08149 0.04705 0.11106 0.06920 -0.03995
270 2S 0.33500 -0.19341 -0.22557 -0.21511 0.12420
271 3S -3.12643 1.80504 2.42893 1.87448 -1.08223
272 4S -0.68733 0.39683 0.29619 0.30583 -0.17657
273 5PX 0.11710 -0.03831 -0.06590 -0.07877 0.02745
274 5PY 0.03831 -0.07287 -0.03805 -0.02745 0.04707
275 5PZ -0.02616 0.01510 0.02338 0.01192 -0.00688
276 6PX 0.10758 -0.07262 -0.12047 -0.08387 0.04320
277 6PY 0.07262 -0.02372 -0.06955 -0.04320 0.03399
278 6PZ -0.04016 0.02319 0.02567 0.02091 -0.01207
279 7PX 1.22037 -0.57675 -0.91851 -0.79227 0.41766
280 7PY 0.57675 -0.55439 -0.53030 -0.41766 0.30999
281 7PZ -0.56773 0.32778 0.38089 0.36874 -0.21289
282 8D 0 0.03935 -0.02272 -0.00171 -0.03627 0.02094
283 8D+1 0.04753 -0.00691 -0.02391 -0.04815 0.00691
284 8D-1 0.00691 -0.03955 -0.01380 -0.00691 0.04017
285 8D+2 -0.03170 -0.02793 0.03054 0.00899 -0.00180
286 8D-2 -0.00868 0.03170 0.05290 0.01218 -0.00899
287 9D 0 0.18084 -0.10441 -0.10583 -0.15272 0.08817
288 9D+1 0.23711 -0.09399 -0.12491 -0.18892 0.06955
289 9D-1 0.09399 -0.12857 -0.07212 -0.06955 0.10861
290 9D+2 -0.19016 -0.00497 0.13534 0.10845 -0.01646
291 9D-2 -0.21461 0.19016 0.23441 0.14169 -0.10845
292 10F 0 0.30748 -0.17752 -0.08750 -0.33773 0.19499
293 10F+1 -0.17298 0.13240 0.04876 0.16200 -0.19483
294 10F-1 -0.13240 0.02009 0.02815 0.19483 0.06297
295 10F+2 -0.13887 -0.06625 0.09820 0.15897 0.02432
296 10F-2 -0.09410 0.13887 0.17008 0.15924 -0.15897
297 10F+3 0.15495 0.26839 0.00000 -0.06784 -0.11750
298 10F-3 0.02774 -0.01602 -0.36626 0.11408 -0.06586
226 227 228 229 230
(A1G)--V (EG)--V (EG)--V (EU)--V (EU)--V
Eigenvalues -- 6.70956 6.79415 6.79415 6.80156 6.80156
1 1 Si 1S 0.00706 0.00000 0.00000 0.00000 0.00000
2 2S -0.18776 0.00000 0.00000 0.00000 0.00000
3 3S 0.04076 0.00000 0.00000 0.00000 0.00000
4 4S -0.27922 0.00000 0.00000 0.00000 0.00000
5 5S 3.18638 0.00000 0.00000 0.00000 0.00000
6 6S 0.67253 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 -0.34056 0.00000 0.00000 -0.13617
8 7PY 0.00000 0.00000 0.34056 0.13617 0.00000
9 7PZ -0.28841 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.30693 0.00000 0.00000 -0.07121
11 8PY 0.00000 0.00000 0.30693 0.07121 0.00000
12 8PZ -0.28639 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 1.16137 0.00000 0.00000 0.70052
14 9PY 0.00000 0.00000 -1.16137 -0.70052 0.00000
15 9PZ 0.94154 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 1.70574 0.00000 0.00000 0.68745
17 10PY 0.00000 0.00000 -1.70574 -0.68745 0.00000
18 10PZ 0.70782 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.25830 0.00000 0.00000 0.22642
20 11PY 0.00000 0.00000 -0.25830 -0.22642 0.00000
21 11PZ -0.02378 0.00000 0.00000 0.00000 0.00000
22 12D 0 0.00438 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.18453 0.00000 0.00000 0.15698
24 12D-1 0.00000 0.00000 -0.18453 -0.15698 0.00000
25 12D+2 0.00000 0.00000 0.34578 0.22898 0.00000
26 12D-2 0.00000 -0.34578 0.00000 0.00000 -0.22898
27 13D 0 -0.42363 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.37885 0.00000 0.00000 -0.00950
29 13D-1 0.00000 0.00000 -0.37885 0.00950 0.00000
30 13D+2 0.00000 0.00000 0.41488 -0.07312 0.00000
31 13D-2 0.00000 -0.41488 0.00000 0.00000 0.07312
32 14D 0 -0.22097 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.19090 0.00000 0.00000 0.15305
34 14D-1 0.00000 0.00000 -0.19090 -0.15305 0.00000
35 14D+2 0.00000 0.00000 0.23801 0.23218 0.00000
36 14D-2 0.00000 -0.23801 0.00000 0.00000 -0.23218
37 15F 0 -0.31235 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.00978 0.00000 0.00000 -0.08010
39 15F-1 0.00000 0.00000 -0.00978 0.08010 0.00000
40 15F+2 0.00000 0.00000 0.08086 -0.11551 0.00000
41 15F-2 0.00000 -0.08086 0.00000 0.00000 0.11551
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.16221 0.00000 0.00000 0.00000 0.00000
44 16F 0 -0.16169 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 -0.17066 0.00000 0.00000 -0.25880
46 16F-1 0.00000 0.00000 0.17066 0.25880 0.00000
47 16F+2 0.00000 0.00000 0.22664 -0.02544 0.00000
48 16F-2 0.00000 -0.22664 0.00000 0.00000 0.02544
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 -0.48973 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.05086 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 -0.09036 0.00000 0.00000 -0.05198
53 17G-1 0.00000 0.00000 0.09036 0.05198 0.00000
54 17G+2 0.00000 0.00000 0.09678 -0.01176 0.00000
55 17G-2 0.00000 -0.09678 0.00000 0.00000 0.01176
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.24509 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 -0.38702 -0.40701 0.00000
59 17G-4 0.00000 -0.38702 0.00000 0.00000 -0.40701
60 2 Si 1S 0.00706 0.00000 0.00000 0.00000 0.00000
61 2S -0.18776 0.00000 0.00000 0.00000 0.00000
62 3S 0.04076 0.00000 0.00000 0.00000 0.00000
63 4S -0.27922 0.00000 0.00000 0.00000 0.00000
64 5S 3.18638 0.00000 0.00000 0.00000 0.00000
65 6S 0.67253 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 0.34056 0.00000 0.00000 -0.13617
67 7PY 0.00000 0.00000 -0.34056 0.13617 0.00000
68 7PZ 0.28841 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 0.30693 0.00000 0.00000 -0.07121
70 8PY 0.00000 0.00000 -0.30693 0.07121 0.00000
71 8PZ 0.28639 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 -1.16137 0.00000 0.00000 0.70052
73 9PY 0.00000 0.00000 1.16137 -0.70052 0.00000
74 9PZ -0.94154 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 -1.70574 0.00000 0.00000 0.68745
76 10PY 0.00000 0.00000 1.70574 -0.68745 0.00000
77 10PZ -0.70782 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 -0.25830 0.00000 0.00000 0.22642
79 11PY 0.00000 0.00000 0.25830 -0.22642 0.00000
80 11PZ 0.02378 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00438 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.18453 0.00000 0.00000 -0.15698
83 12D-1 0.00000 0.00000 -0.18453 0.15698 0.00000
84 12D+2 0.00000 0.00000 0.34578 -0.22898 0.00000
85 12D-2 0.00000 -0.34578 0.00000 0.00000 0.22898
86 13D 0 -0.42363 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.37885 0.00000 0.00000 0.00950
88 13D-1 0.00000 0.00000 -0.37885 -0.00950 0.00000
89 13D+2 0.00000 0.00000 0.41488 0.07312 0.00000
90 13D-2 0.00000 -0.41488 0.00000 0.00000 -0.07312
91 14D 0 -0.22097 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.19090 0.00000 0.00000 -0.15305
93 14D-1 0.00000 0.00000 -0.19090 0.15305 0.00000
94 14D+2 0.00000 0.00000 0.23801 -0.23218 0.00000
95 14D-2 0.00000 -0.23801 0.00000 0.00000 0.23218
96 15F 0 0.31235 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 -0.00978 0.00000 0.00000 -0.08010
98 15F-1 0.00000 0.00000 0.00978 0.08010 0.00000
99 15F+2 0.00000 0.00000 -0.08086 -0.11551 0.00000
100 15F-2 0.00000 0.08086 0.00000 0.00000 0.11551
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.16221 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.16169 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.17066 0.00000 0.00000 -0.25880
105 16F-1 0.00000 0.00000 -0.17066 0.25880 0.00000
106 16F+2 0.00000 0.00000 -0.22664 -0.02544 0.00000
107 16F-2 0.00000 0.22664 0.00000 0.00000 0.02544
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.48973 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.05086 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 -0.09036 0.00000 0.00000 0.05198
112 17G-1 0.00000 0.00000 0.09036 -0.05198 0.00000
113 17G+2 0.00000 0.00000 0.09678 0.01176 0.00000
114 17G-2 0.00000 -0.09678 0.00000 0.00000 -0.01176
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 -0.24509 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 -0.38702 0.40701 0.00000
118 17G-4 0.00000 -0.38702 0.00000 0.00000 0.40701
119 3 H 1S -0.13493 0.00000 0.12040 0.07891 0.00000
120 2S 0.21381 0.00000 -0.26035 -0.12772 0.00000
121 3S -1.56824 0.00000 2.04320 0.79414 0.00000
122 4S -0.21095 0.00000 0.45731 0.38519 0.00000
123 5PX 0.00000 -0.04269 0.00000 0.00000 -0.08419
124 5PY 0.05589 0.00000 -0.10613 -0.04950 0.00000
125 5PZ 0.02740 0.00000 -0.04805 -0.09872 0.00000
126 6PX 0.00000 -0.03689 0.00000 0.00000 -0.02661
127 6PY 0.10835 0.00000 -0.09887 -0.03205 0.00000
128 6PZ 0.03229 0.00000 -0.02698 0.00326 0.00000
129 7PX 0.00000 -0.19527 0.00000 0.00000 -0.26553
130 7PY 0.76638 0.00000 -0.95965 -0.37223 0.00000
131 7PZ 0.25006 0.00000 -0.42791 -0.37240 0.00000
132 8D 0 0.00865 0.00000 0.01044 0.02091 0.00000
133 8D+1 0.00000 0.05499 0.00000 0.00000 0.05152
134 8D-1 -0.04586 0.00000 0.05014 0.07832 0.00000
135 8D+2 0.04871 0.00000 -0.07724 -0.05347 0.00000
136 8D-2 0.00000 -0.00522 0.00000 0.00000 0.02264
137 9D 0 0.08165 0.00000 -0.05425 0.05430 0.00000
138 9D+1 0.00000 0.12088 0.00000 0.00000 0.11925
139 9D-1 -0.16064 0.00000 0.21440 0.22740 0.00000
140 9D+2 0.21201 0.00000 -0.30133 -0.14497 0.00000
141 9D-2 0.00000 0.10913 0.00000 0.00000 0.17316
142 10F 0 -0.16649 0.00000 0.04751 0.07542 0.00000
143 10F+1 0.00000 -0.20900 0.00000 0.00000 -0.14460
144 10F-1 0.05104 0.00000 0.00202 -0.15000 0.00000
145 10F+2 -0.23039 0.00000 0.30834 0.41608 0.00000
146 10F-2 0.00000 -0.31055 0.00000 0.00000 -0.29034
147 10F+3 0.00000 -0.06040 0.00000 0.00000 0.08949
148 10F-3 -0.31149 0.00000 0.36721 0.26375 0.00000
149 4 H 1S -0.13493 0.10427 -0.06020 -0.03946 0.06834
150 2S 0.21381 -0.22547 0.13018 0.06386 -0.11061
151 3S -1.56824 1.76946 -1.02160 -0.39707 0.68774
152 4S -0.21095 0.39604 -0.22865 -0.19259 0.33358
153 5PX -0.04840 0.06893 -0.06444 -0.05789 0.01608
154 5PY -0.02794 0.06444 0.00548 0.05077 0.05789
155 5PZ 0.02740 -0.04161 0.02402 0.04936 -0.08549
156 6PX -0.09383 0.06493 -0.05878 -0.02540 0.01738
157 6PY -0.05418 0.05878 0.00295 0.01195 0.02540
158 6PZ 0.03229 -0.02337 0.01349 -0.00163 0.00282
159 7PX -0.66371 0.67092 -0.50010 -0.27616 0.21279
160 7PY -0.38319 0.50010 -0.09346 0.10609 0.27616
161 7PZ 0.25006 -0.37058 0.21395 0.18620 -0.32251
162 8D 0 0.00865 0.00905 -0.00522 -0.01045 0.01811
163 8D+1 0.03972 -0.02386 0.04552 0.05622 -0.04586
164 8D-1 0.02293 -0.04552 -0.02871 -0.01906 -0.05622
165 8D+2 -0.02436 0.03571 -0.01540 -0.03035 0.01335
166 8D-2 -0.04218 0.05663 -0.03571 -0.01335 0.04576
167 9D 0 0.08165 -0.04698 0.02713 -0.02715 0.04702
168 9D+1 0.13912 -0.13058 0.14518 0.15010 -0.14073
169 9D-1 0.08032 -0.14518 -0.03706 -0.03259 -0.15010
170 9D+2 -0.10600 0.08323 -0.15718 -0.16611 -0.01221
171 9D-2 -0.18360 0.25328 -0.08323 0.01221 0.15201
172 10F 0 -0.16649 0.04114 -0.02375 -0.03771 0.06532
173 10F+1 -0.04420 -0.05377 -0.08962 -0.12757 0.07635
174 10F-1 -0.02552 0.08962 0.15726 0.07095 0.12757
175 10F+2 0.11519 0.00096 0.31000 0.32178 -0.05445
176 10F-2 0.19952 -0.30889 -0.00096 0.05445 -0.38465
177 10F+3 0.00000 0.03020 0.05231 -0.07750 -0.04475
178 10F-3 -0.31149 0.31801 -0.18360 -0.13188 0.22841
179 5 H 1S -0.13493 -0.10427 -0.06020 -0.03946 -0.06834
180 2S 0.21381 0.22547 0.13018 0.06386 0.11061
181 3S -1.56824 -1.76946 -1.02160 -0.39707 -0.68774
182 4S -0.21095 -0.39604 -0.22865 -0.19259 -0.33358
183 5PX 0.04840 0.06893 0.06444 0.05789 0.01608
184 5PY -0.02794 -0.06444 0.00548 0.05077 -0.05789
185 5PZ 0.02740 0.04161 0.02402 0.04936 0.08549
186 6PX 0.09383 0.06493 0.05878 0.02540 0.01738
187 6PY -0.05418 -0.05878 0.00295 0.01195 -0.02540
188 6PZ 0.03229 0.02337 0.01349 -0.00163 -0.00282
189 7PX 0.66371 0.67092 0.50010 0.27616 0.21279
190 7PY -0.38319 -0.50010 -0.09346 0.10609 -0.27616
191 7PZ 0.25006 0.37058 0.21395 0.18620 0.32251
192 8D 0 0.00865 -0.00905 -0.00522 -0.01045 -0.01811
193 8D+1 -0.03972 -0.02386 -0.04552 -0.05622 -0.04586
194 8D-1 0.02293 0.04552 -0.02871 -0.01906 0.05622
195 8D+2 -0.02436 -0.03571 -0.01540 -0.03035 -0.01335
196 8D-2 0.04218 0.05663 0.03571 0.01335 0.04576
197 9D 0 0.08165 0.04698 0.02713 -0.02715 -0.04702
198 9D+1 -0.13912 -0.13058 -0.14518 -0.15010 -0.14073
199 9D-1 0.08032 0.14518 -0.03706 -0.03259 0.15010
200 9D+2 -0.10600 -0.08323 -0.15718 -0.16611 0.01221
201 9D-2 0.18360 0.25328 0.08323 -0.01221 0.15201
202 10F 0 -0.16649 -0.04114 -0.02375 -0.03771 -0.06532
203 10F+1 0.04420 -0.05377 0.08962 0.12757 0.07635
204 10F-1 -0.02552 -0.08962 0.15726 0.07095 -0.12757
205 10F+2 0.11519 -0.00096 0.31000 0.32178 0.05445
206 10F-2 -0.19952 -0.30889 0.00096 -0.05445 -0.38465
207 10F+3 0.00000 0.03020 -0.05231 0.07750 -0.04475
208 10F-3 -0.31149 -0.31801 -0.18360 -0.13188 -0.22841
209 6 H 1S -0.13493 0.00000 0.12040 -0.07891 0.00000
210 2S 0.21381 0.00000 -0.26035 0.12772 0.00000
211 3S -1.56824 0.00000 2.04320 -0.79414 0.00000
212 4S -0.21095 0.00000 0.45731 -0.38519 0.00000
213 5PX 0.00000 0.04269 0.00000 0.00000 -0.08419
214 5PY -0.05589 0.00000 0.10613 -0.04950 0.00000
215 5PZ -0.02740 0.00000 0.04805 -0.09872 0.00000
216 6PX 0.00000 0.03689 0.00000 0.00000 -0.02661
217 6PY -0.10835 0.00000 0.09887 -0.03205 0.00000
218 6PZ -0.03229 0.00000 0.02698 0.00326 0.00000
219 7PX 0.00000 0.19527 0.00000 0.00000 -0.26553
220 7PY -0.76638 0.00000 0.95965 -0.37223 0.00000
221 7PZ -0.25006 0.00000 0.42791 -0.37240 0.00000
222 8D 0 0.00865 0.00000 0.01044 -0.02091 0.00000
223 8D+1 0.00000 0.05499 0.00000 0.00000 -0.05152
224 8D-1 -0.04586 0.00000 0.05014 -0.07832 0.00000
225 8D+2 0.04871 0.00000 -0.07724 0.05347 0.00000
226 8D-2 0.00000 -0.00522 0.00000 0.00000 -0.02264
227 9D 0 0.08165 0.00000 -0.05425 -0.05430 0.00000
228 9D+1 0.00000 0.12088 0.00000 0.00000 -0.11925
229 9D-1 -0.16064 0.00000 0.21440 -0.22740 0.00000
230 9D+2 0.21201 0.00000 -0.30133 0.14497 0.00000
231 9D-2 0.00000 0.10913 0.00000 0.00000 -0.17316
232 10F 0 0.16649 0.00000 -0.04751 0.07542 0.00000
233 10F+1 0.00000 0.20900 0.00000 0.00000 -0.14460
234 10F-1 -0.05104 0.00000 -0.00202 -0.15000 0.00000
235 10F+2 0.23039 0.00000 -0.30834 0.41608 0.00000
236 10F-2 0.00000 0.31055 0.00000 0.00000 -0.29034
237 10F+3 0.00000 0.06040 0.00000 0.00000 0.08949
238 10F-3 0.31149 0.00000 -0.36721 0.26375 0.00000
239 7 H 1S -0.13493 -0.10427 -0.06020 0.03946 0.06834
240 2S 0.21381 0.22547 0.13018 -0.06386 -0.11061
241 3S -1.56824 -1.76946 -1.02160 0.39707 0.68774
242 4S -0.21095 -0.39604 -0.22865 0.19259 0.33358
243 5PX -0.04840 -0.06893 -0.06444 0.05789 0.01608
244 5PY 0.02794 0.06444 -0.00548 0.05077 -0.05789
245 5PZ -0.02740 -0.04161 -0.02402 0.04936 0.08549
246 6PX -0.09383 -0.06493 -0.05878 0.02540 0.01738
247 6PY 0.05418 0.05878 -0.00295 0.01195 -0.02540
248 6PZ -0.03229 -0.02337 -0.01349 -0.00163 -0.00282
249 7PX -0.66371 -0.67092 -0.50010 0.27616 0.21279
250 7PY 0.38319 0.50010 0.09346 0.10609 -0.27616
251 7PZ -0.25006 -0.37058 -0.21395 0.18620 0.32251
252 8D 0 0.00865 -0.00905 -0.00522 0.01045 0.01811
253 8D+1 -0.03972 -0.02386 -0.04552 0.05622 0.04586
254 8D-1 0.02293 0.04552 -0.02871 0.01906 -0.05622
255 8D+2 -0.02436 -0.03571 -0.01540 0.03035 0.01335
256 8D-2 0.04218 0.05663 0.03571 -0.01335 -0.04576
257 9D 0 0.08165 0.04698 0.02713 0.02715 0.04702
258 9D+1 -0.13912 -0.13058 -0.14518 0.15010 0.14073
259 9D-1 0.08032 0.14518 -0.03706 0.03259 -0.15010
260 9D+2 -0.10600 -0.08323 -0.15718 0.16611 -0.01221
261 9D-2 0.18360 0.25328 0.08323 0.01221 -0.15201
262 10F 0 0.16649 0.04114 0.02375 -0.03771 -0.06532
263 10F+1 -0.04420 0.05377 -0.08962 0.12757 0.07635
264 10F-1 0.02552 0.08962 -0.15726 0.07095 -0.12757
265 10F+2 -0.11519 0.00096 -0.31000 0.32178 0.05445
266 10F-2 0.19952 0.30889 -0.00096 -0.05445 -0.38465
267 10F+3 0.00000 -0.03020 0.05231 0.07750 -0.04475
268 10F-3 0.31149 0.31801 0.18360 -0.13188 -0.22841
269 8 H 1S -0.13493 0.10427 -0.06020 0.03946 -0.06834
270 2S 0.21381 -0.22547 0.13018 -0.06386 0.11061
271 3S -1.56824 1.76946 -1.02160 0.39707 -0.68774
272 4S -0.21095 0.39604 -0.22865 0.19259 -0.33358
273 5PX 0.04840 -0.06893 0.06444 -0.05789 0.01608
274 5PY 0.02794 -0.06444 -0.00548 0.05077 0.05789
275 5PZ -0.02740 0.04161 -0.02402 0.04936 -0.08549
276 6PX 0.09383 -0.06493 0.05878 -0.02540 0.01738
277 6PY 0.05418 -0.05878 -0.00295 0.01195 0.02540
278 6PZ -0.03229 0.02337 -0.01349 -0.00163 0.00282
279 7PX 0.66371 -0.67092 0.50010 -0.27616 0.21279
280 7PY 0.38319 -0.50010 0.09346 0.10609 0.27616
281 7PZ -0.25006 0.37058 -0.21395 0.18620 -0.32251
282 8D 0 0.00865 0.00905 -0.00522 0.01045 -0.01811
283 8D+1 0.03972 -0.02386 0.04552 -0.05622 0.04586
284 8D-1 0.02293 -0.04552 -0.02871 0.01906 0.05622
285 8D+2 -0.02436 0.03571 -0.01540 0.03035 -0.01335
286 8D-2 -0.04218 0.05663 -0.03571 0.01335 -0.04576
287 9D 0 0.08165 -0.04698 0.02713 0.02715 -0.04702
288 9D+1 0.13912 -0.13058 0.14518 -0.15010 0.14073
289 9D-1 0.08032 -0.14518 -0.03706 0.03259 0.15010
290 9D+2 -0.10600 0.08323 -0.15718 0.16611 0.01221
291 9D-2 -0.18360 0.25328 -0.08323 -0.01221 -0.15201
292 10F 0 0.16649 -0.04114 0.02375 -0.03771 0.06532
293 10F+1 0.04420 0.05377 0.08962 -0.12757 0.07635
294 10F-1 0.02552 -0.08962 -0.15726 0.07095 0.12757
295 10F+2 -0.11519 -0.00096 -0.31000 0.32178 -0.05445
296 10F-2 -0.19952 0.30889 0.00096 0.05445 -0.38465
297 10F+3 0.00000 -0.03020 -0.05231 -0.07750 -0.04475
298 10F-3 0.31149 -0.31801 0.18360 -0.13188 0.22841
231 232 233 234 235
(EG)--V (EG)--V (EU)--V (EU)--V (A1U)--V
Eigenvalues -- 6.87361 6.87361 6.98264 6.98264 7.04840
1 1 Si 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 -0.27186 0.00000 -0.16919 0.00000 0.00000
8 7PY 0.00000 0.27186 0.00000 0.16919 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX -0.33711 0.00000 -0.19348 0.00000 0.00000
11 8PY 0.00000 0.33711 0.00000 0.19348 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.56186 0.00000 0.41835 0.00000 0.00000
14 9PY 0.00000 -0.56186 0.00000 -0.41835 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.53303 0.00000 0.91957 0.00000 0.00000
17 10PY 0.00000 -0.53303 0.00000 -0.91957 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX -0.14063 0.00000 0.04963 0.00000 0.00000
20 11PY 0.00000 0.14063 0.00000 -0.04963 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 0.57967 0.00000 0.21819 0.00000 0.00000
24 12D-1 0.00000 -0.57967 0.00000 -0.21819 0.00000
25 12D+2 0.00000 0.19824 0.00000 0.29935 0.00000
26 12D-2 -0.19824 0.00000 -0.29935 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.62961 0.00000 0.42347 0.00000 0.00000
29 13D-1 0.00000 -0.62961 0.00000 -0.42347 0.00000
30 13D+2 0.00000 0.51466 0.00000 0.34817 0.00000
31 13D-2 -0.51466 0.00000 -0.34817 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.01403 0.00000 0.07196 0.00000 0.00000
34 14D-1 0.00000 -0.01403 0.00000 -0.07196 0.00000
35 14D+2 0.00000 -0.06494 0.00000 -0.01262 0.00000
36 14D-2 0.06494 0.00000 0.01262 0.00000 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15F+1 -0.16637 0.00000 -0.08190 0.00000 0.00000
39 15F-1 0.00000 0.16637 0.00000 0.08190 0.00000
40 15F+2 0.00000 0.24976 0.00000 -0.03167 0.00000
41 15F-2 -0.24976 0.00000 0.03167 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.21240
43 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.38970 0.00000 0.30573 0.00000 0.00000
46 16F-1 0.00000 -0.38970 0.00000 -0.30573 0.00000
47 16F+2 0.00000 0.40062 0.00000 0.38542 0.00000
48 16F-2 -0.40062 0.00000 -0.38542 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.63752
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
52 17G+1 -0.03328 0.00000 0.07594 0.00000 0.00000
53 17G-1 0.00000 0.03328 0.00000 -0.07594 0.00000
54 17G+2 0.00000 0.28294 0.00000 0.44433 0.00000
55 17G-2 -0.28294 0.00000 -0.44433 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.40016
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.11172 0.00000 -0.11330 0.00000
59 17G-4 0.11172 0.00000 -0.11330 0.00000 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00000
61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
62 3S 0.00000 0.00000 0.00000 0.00000 0.00000
63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
64 5S 0.00000 0.00000 0.00000 0.00000 0.00000
65 6S 0.00000 0.00000 0.00000 0.00000 0.00000
66 7PX 0.27186 0.00000 -0.16919 0.00000 0.00000
67 7PY 0.00000 -0.27186 0.00000 0.16919 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
69 8PX 0.33711 0.00000 -0.19348 0.00000 0.00000
70 8PY 0.00000 -0.33711 0.00000 0.19348 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
72 9PX -0.56186 0.00000 0.41835 0.00000 0.00000
73 9PY 0.00000 0.56186 0.00000 -0.41835 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
75 10PX -0.53303 0.00000 0.91957 0.00000 0.00000
76 10PY 0.00000 0.53303 0.00000 -0.91957 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
78 11PX 0.14063 0.00000 0.04963 0.00000 0.00000
79 11PY 0.00000 -0.14063 0.00000 -0.04963 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.57967 0.00000 -0.21819 0.00000 0.00000
83 12D-1 0.00000 -0.57967 0.00000 0.21819 0.00000
84 12D+2 0.00000 0.19824 0.00000 -0.29935 0.00000
85 12D-2 -0.19824 0.00000 0.29935 0.00000 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.62961 0.00000 -0.42347 0.00000 0.00000
88 13D-1 0.00000 -0.62961 0.00000 0.42347 0.00000
89 13D+2 0.00000 0.51466 0.00000 -0.34817 0.00000
90 13D-2 -0.51466 0.00000 0.34817 0.00000 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.01403 0.00000 -0.07196 0.00000 0.00000
93 14D-1 0.00000 -0.01403 0.00000 0.07196 0.00000
94 14D+2 0.00000 -0.06494 0.00000 0.01262 0.00000
95 14D-2 0.06494 0.00000 -0.01262 0.00000 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.16637 0.00000 -0.08190 0.00000 0.00000
98 15F-1 0.00000 -0.16637 0.00000 0.08190 0.00000
99 15F+2 0.00000 -0.24976 0.00000 -0.03167 0.00000
100 15F-2 0.24976 0.00000 0.03167 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.21240
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 -0.38970 0.00000 0.30573 0.00000 0.00000
105 16F-1 0.00000 0.38970 0.00000 -0.30573 0.00000
106 16F+2 0.00000 -0.40062 0.00000 0.38542 0.00000
107 16F-2 0.40062 0.00000 -0.38542 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.63752
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
111 17G+1 -0.03328 0.00000 -0.07594 0.00000 0.00000
112 17G-1 0.00000 0.03328 0.00000 0.07594 0.00000
113 17G+2 0.00000 0.28294 0.00000 -0.44433 0.00000
114 17G-2 -0.28294 0.00000 0.44433 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 -0.40016
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.11172 0.00000 0.11330 0.00000
118 17G-4 0.11172 0.00000 0.11330 0.00000 0.00000
119 3 H 1S 0.00000 0.13280 0.00000 0.04738 0.00000
120 2S 0.00000 -0.21300 0.00000 -0.15341 0.00000
121 3S 0.00000 1.35389 0.00000 1.18640 0.00000
122 4S 0.00000 0.08181 0.00000 0.19419 0.00000
123 5PX 0.07925 0.00000 0.01866 0.00000 0.23611
124 5PY 0.00000 -0.07316 0.00000 -0.11304 0.00000
125 5PZ 0.00000 0.15402 0.00000 0.14711 0.00000
126 6PX -0.01263 0.00000 -0.02777 0.00000 -0.07891
127 6PY 0.00000 -0.08688 0.00000 -0.04019 0.00000
128 6PZ 0.00000 -0.08653 0.00000 -0.04196 0.00000
129 7PX 0.12761 0.00000 0.00876 0.00000 0.37826
130 7PY 0.00000 -0.61374 0.00000 -0.56726 0.00000
131 7PZ 0.00000 0.22951 0.00000 0.03969 0.00000
132 8D 0 0.00000 -0.06834 0.00000 -0.00016 0.00000
133 8D+1 0.00436 0.00000 0.03221 0.00000 -0.04342
134 8D-1 0.00000 -0.08617 0.00000 -0.06423 0.00000
135 8D+2 0.00000 -0.02007 0.00000 -0.05012 0.00000
136 8D-2 -0.03715 0.00000 -0.04130 0.00000 -0.08310
137 9D 0 0.00000 -0.22980 0.00000 -0.14678 0.00000
138 9D+1 -0.00166 0.00000 0.07490 0.00000 -0.08351
139 9D-1 0.00000 -0.16647 0.00000 -0.15051 0.00000
140 9D+2 0.00000 -0.19532 0.00000 -0.23354 0.00000
141 9D-2 -0.11882 0.00000 -0.04763 0.00000 -0.28513
142 10F 0 0.00000 -0.10939 0.00000 -0.21808 0.00000
143 10F+1 -0.04740 0.00000 -0.15674 0.00000 -0.06799
144 10F-1 0.00000 0.39664 0.00000 0.23940 0.00000
145 10F+2 0.00000 -0.33117 0.00000 -0.22935 0.00000
146 10F-2 -0.03854 0.00000 -0.21396 0.00000 0.20921
147 10F+3 -0.22411 0.00000 -0.23044 0.00000 -0.35468
148 10F-3 0.00000 0.16292 0.00000 0.32879 0.00000
149 4 H 1S 0.11500 -0.06640 0.04103 -0.02369 0.00000
150 2S -0.18447 0.10650 -0.13285 0.07670 0.00000
151 3S 1.17250 -0.67694 1.02746 -0.59320 0.00000
152 4S 0.07085 -0.04090 0.16817 -0.09710 0.00000
153 5PX 0.07468 0.00264 0.08944 -0.04086 -0.11806
154 5PY -0.00264 -0.07773 0.04086 -0.04226 0.20448
155 5PZ 0.13339 -0.07701 0.12740 -0.07355 0.00000
156 6PX 0.06200 -0.04309 0.02320 -0.02943 0.03946
157 6PY 0.04309 -0.01224 0.02943 0.01078 -0.06834
158 6PZ -0.07494 0.04326 -0.03634 0.02098 0.00000
159 7PX 0.49221 -0.21050 0.42764 -0.24184 -0.18913
160 7PY 0.21050 -0.24914 0.24184 -0.14838 0.32758
161 7PZ 0.19877 -0.11476 0.03437 -0.01984 0.00000
162 8D 0 -0.05918 0.03417 -0.00014 0.00008 0.00000
163 8D+1 0.06572 -0.03542 0.05623 -0.01387 0.02171
164 8D-1 0.03542 -0.02481 0.01387 -0.04022 -0.03760
165 8D+2 0.02478 0.02284 0.03959 0.01845 -0.07197
166 8D-2 0.00576 -0.02478 0.02727 -0.03959 0.04155
167 9D 0 -0.19901 0.11490 -0.12711 0.07339 0.00000
168 9D+1 0.12444 -0.07280 0.13161 -0.03274 0.04176
169 9D-1 0.07280 -0.04037 0.03274 -0.09380 -0.07232
170 9D+2 0.13602 0.04028 0.12175 -0.02266 -0.24693
171 9D-2 0.11678 -0.13602 0.16325 -0.12175 0.14256
172 10F 0 -0.09473 0.05469 -0.18886 0.10904 0.00000
173 10F+1 -0.30933 0.15123 -0.21874 0.03579 0.03399
174 10F-1 -0.15123 0.13471 -0.03579 0.17741 -0.05888
175 10F+2 0.16009 -0.05389 0.19196 0.10313 0.18118
176 10F-2 0.23875 -0.16009 0.11852 -0.19196 -0.10460
177 10F+3 0.11206 0.19409 0.11522 0.19957 -0.35468
178 10F-3 0.14109 -0.08146 0.28474 -0.16440 0.00000
179 5 H 1S -0.11500 -0.06640 -0.04103 -0.02369 0.00000
180 2S 0.18447 0.10650 0.13285 0.07670 0.00000
181 3S -1.17250 -0.67694 -1.02746 -0.59320 0.00000
182 4S -0.07085 -0.04090 -0.16817 -0.09710 0.00000
183 5PX 0.07468 -0.00264 0.08944 0.04086 -0.11806
184 5PY 0.00264 -0.07773 -0.04086 -0.04226 -0.20448
185 5PZ -0.13339 -0.07701 -0.12740 -0.07355 0.00000
186 6PX 0.06200 0.04309 0.02320 0.02943 0.03946
187 6PY -0.04309 -0.01224 -0.02943 0.01078 0.06834
188 6PZ 0.07494 0.04326 0.03634 0.02098 0.00000
189 7PX 0.49221 0.21050 0.42764 0.24184 -0.18913
190 7PY -0.21050 -0.24914 -0.24184 -0.14838 -0.32758
191 7PZ -0.19877 -0.11476 -0.03437 -0.01984 0.00000
192 8D 0 0.05918 0.03417 0.00014 0.00008 0.00000
193 8D+1 0.06572 0.03542 0.05623 0.01387 0.02171
194 8D-1 -0.03542 -0.02481 -0.01387 -0.04022 0.03760
195 8D+2 -0.02478 0.02284 -0.03959 0.01845 0.07197
196 8D-2 0.00576 0.02478 0.02727 0.03959 0.04155
197 9D 0 0.19901 0.11490 0.12711 0.07339 0.00000
198 9D+1 0.12444 0.07280 0.13161 0.03274 0.04176
199 9D-1 -0.07280 -0.04037 -0.03274 -0.09380 0.07232
200 9D+2 -0.13602 0.04028 -0.12175 -0.02266 0.24693
201 9D-2 0.11678 0.13602 0.16325 0.12175 0.14256
202 10F 0 0.09473 0.05469 0.18886 0.10904 0.00000
203 10F+1 -0.30933 -0.15123 -0.21874 -0.03579 0.03399
204 10F-1 0.15123 0.13471 0.03579 0.17741 0.05888
205 10F+2 -0.16009 -0.05389 -0.19196 0.10313 -0.18118
206 10F-2 0.23875 0.16009 0.11852 0.19196 -0.10460
207 10F+3 0.11206 -0.19409 0.11522 -0.19957 -0.35468
208 10F-3 -0.14109 -0.08146 -0.28474 -0.16440 0.00000
209 6 H 1S 0.00000 0.13280 0.00000 -0.04738 0.00000
210 2S 0.00000 -0.21300 0.00000 0.15341 0.00000
211 3S 0.00000 1.35389 0.00000 -1.18640 0.00000
212 4S 0.00000 0.08181 0.00000 -0.19419 0.00000
213 5PX -0.07925 0.00000 0.01866 0.00000 0.23611
214 5PY 0.00000 0.07316 0.00000 -0.11304 0.00000
215 5PZ 0.00000 -0.15402 0.00000 0.14711 0.00000
216 6PX 0.01263 0.00000 -0.02777 0.00000 -0.07891
217 6PY 0.00000 0.08688 0.00000 -0.04019 0.00000
218 6PZ 0.00000 0.08653 0.00000 -0.04196 0.00000
219 7PX -0.12761 0.00000 0.00876 0.00000 0.37826
220 7PY 0.00000 0.61374 0.00000 -0.56726 0.00000
221 7PZ 0.00000 -0.22951 0.00000 0.03969 0.00000
222 8D 0 0.00000 -0.06834 0.00000 0.00016 0.00000
223 8D+1 0.00436 0.00000 -0.03221 0.00000 0.04342
224 8D-1 0.00000 -0.08617 0.00000 0.06423 0.00000
225 8D+2 0.00000 -0.02007 0.00000 0.05012 0.00000
226 8D-2 -0.03715 0.00000 0.04130 0.00000 0.08310
227 9D 0 0.00000 -0.22980 0.00000 0.14678 0.00000
228 9D+1 -0.00166 0.00000 -0.07490 0.00000 0.08351
229 9D-1 0.00000 -0.16647 0.00000 0.15051 0.00000
230 9D+2 0.00000 -0.19532 0.00000 0.23354 0.00000
231 9D-2 -0.11882 0.00000 0.04763 0.00000 0.28513
232 10F 0 0.00000 0.10939 0.00000 -0.21808 0.00000
233 10F+1 0.04740 0.00000 -0.15674 0.00000 -0.06799
234 10F-1 0.00000 -0.39664 0.00000 0.23940 0.00000
235 10F+2 0.00000 0.33117 0.00000 -0.22935 0.00000
236 10F-2 0.03854 0.00000 -0.21396 0.00000 0.20921
237 10F+3 0.22411 0.00000 -0.23044 0.00000 -0.35468
238 10F-3 0.00000 -0.16292 0.00000 0.32879 0.00000
239 7 H 1S -0.11500 -0.06640 0.04103 0.02369 0.00000
240 2S 0.18447 0.10650 -0.13285 -0.07670 0.00000
241 3S -1.17250 -0.67694 1.02746 0.59320 0.00000
242 4S -0.07085 -0.04090 0.16817 0.09710 0.00000
243 5PX -0.07468 0.00264 0.08944 0.04086 -0.11806
244 5PY -0.00264 0.07773 -0.04086 -0.04226 -0.20448
245 5PZ 0.13339 0.07701 -0.12740 -0.07355 0.00000
246 6PX -0.06200 -0.04309 0.02320 0.02943 0.03946
247 6PY 0.04309 0.01224 -0.02943 0.01078 0.06834
248 6PZ -0.07494 -0.04326 0.03634 0.02098 0.00000
249 7PX -0.49221 -0.21050 0.42764 0.24184 -0.18913
250 7PY 0.21050 0.24914 -0.24184 -0.14838 -0.32758
251 7PZ 0.19877 0.11476 -0.03437 -0.01984 0.00000
252 8D 0 0.05918 0.03417 -0.00014 -0.00008 0.00000
253 8D+1 0.06572 0.03542 -0.05623 -0.01387 -0.02171
254 8D-1 -0.03542 -0.02481 0.01387 0.04022 -0.03760
255 8D+2 -0.02478 0.02284 0.03959 -0.01845 -0.07197
256 8D-2 0.00576 0.02478 -0.02727 -0.03959 -0.04155
257 9D 0 0.19901 0.11490 -0.12711 -0.07339 0.00000
258 9D+1 0.12444 0.07280 -0.13161 -0.03274 -0.04176
259 9D-1 -0.07280 -0.04037 0.03274 0.09380 -0.07232
260 9D+2 -0.13602 0.04028 0.12175 0.02266 -0.24693
261 9D-2 0.11678 0.13602 -0.16325 -0.12175 -0.14256
262 10F 0 -0.09473 -0.05469 0.18886 0.10904 0.00000
263 10F+1 0.30933 0.15123 -0.21874 -0.03579 0.03399
264 10F-1 -0.15123 -0.13471 0.03579 0.17741 0.05888
265 10F+2 0.16009 0.05389 -0.19196 0.10313 -0.18118
266 10F-2 -0.23875 -0.16009 0.11852 0.19196 -0.10460
267 10F+3 -0.11206 0.19409 0.11522 -0.19957 -0.35468
268 10F-3 0.14109 0.08146 -0.28474 -0.16440 0.00000
269 8 H 1S 0.11500 -0.06640 -0.04103 0.02369 0.00000
270 2S -0.18447 0.10650 0.13285 -0.07670 0.00000
271 3S 1.17250 -0.67694 -1.02746 0.59320 0.00000
272 4S 0.07085 -0.04090 -0.16817 0.09710 0.00000
273 5PX -0.07468 -0.00264 0.08944 -0.04086 -0.11806
274 5PY 0.00264 0.07773 0.04086 -0.04226 0.20448
275 5PZ -0.13339 0.07701 0.12740 -0.07355 0.00000
276 6PX -0.06200 0.04309 0.02320 -0.02943 0.03946
277 6PY -0.04309 0.01224 0.02943 0.01078 -0.06834
278 6PZ 0.07494 -0.04326 -0.03634 0.02098 0.00000
279 7PX -0.49221 0.21050 0.42764 -0.24184 -0.18913
280 7PY -0.21050 0.24914 0.24184 -0.14838 0.32758
281 7PZ -0.19877 0.11476 0.03437 -0.01984 0.00000
282 8D 0 -0.05918 0.03417 0.00014 -0.00008 0.00000
283 8D+1 0.06572 -0.03542 -0.05623 0.01387 -0.02171
284 8D-1 0.03542 -0.02481 -0.01387 0.04022 0.03760
285 8D+2 0.02478 0.02284 -0.03959 -0.01845 0.07197
286 8D-2 0.00576 -0.02478 -0.02727 0.03959 -0.04155
287 9D 0 -0.19901 0.11490 0.12711 -0.07339 0.00000
288 9D+1 0.12444 -0.07280 -0.13161 0.03274 -0.04176
289 9D-1 0.07280 -0.04037 -0.03274 0.09380 0.07232
290 9D+2 0.13602 0.04028 -0.12175 0.02266 0.24693
291 9D-2 0.11678 -0.13602 -0.16325 0.12175 -0.14256
292 10F 0 0.09473 -0.05469 -0.18886 0.10904 0.00000
293 10F+1 0.30933 -0.15123 -0.21874 0.03579 0.03399
294 10F-1 0.15123 -0.13471 -0.03579 0.17741 -0.05888
295 10F+2 -0.16009 0.05389 0.19196 0.10313 0.18118
296 10F-2 -0.23875 0.16009 0.11852 -0.19196 -0.10460
297 10F+3 -0.11206 -0.19409 0.11522 0.19957 -0.35468
298 10F-3 -0.14109 0.08146 0.28474 -0.16440 0.00000
236 237 238 239 240
(A2G)--V (A1G)--V (A2U)--V (EG)--V (EG)--V
Eigenvalues -- 7.08982 7.25812 7.59351 7.60045 7.60045
1 1 Si 1S 0.00000 -0.00454 -0.01462 0.00000 0.00000
2 2S 0.00000 -0.03582 -0.15616 0.00000 0.00000
3 3S 0.00000 -0.09061 -0.23750 0.00000 0.00000
4 4S 0.00000 -3.51620 -2.93033 0.00000 0.00000
5 5S 0.00000 9.70474 8.52369 0.00000 0.00000
6 6S 0.00000 1.35658 2.05323 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00000 -1.04670 0.00000
8 7PY 0.00000 0.00000 0.00000 0.00000 1.04670
9 7PZ 0.00000 -1.56518 -1.48712 0.00000 0.00000
10 8PX 0.00000 0.00000 0.00000 -1.22489 0.00000
11 8PY 0.00000 0.00000 0.00000 0.00000 1.22489
12 8PZ 0.00000 -1.81772 -1.75321 0.00000 0.00000
13 9PX 0.00000 0.00000 0.00000 1.99309 0.00000
14 9PY 0.00000 0.00000 0.00000 0.00000 -1.99309
15 9PZ 0.00000 3.26613 2.70426 0.00000 0.00000
16 10PX 0.00000 0.00000 0.00000 3.95451 0.00000
17 10PY 0.00000 0.00000 0.00000 0.00000 -3.95451
18 10PZ 0.00000 1.70995 0.55842 0.00000 0.00000
19 11PX 0.00000 0.00000 0.00000 0.38584 0.00000
20 11PY 0.00000 0.00000 0.00000 0.00000 -0.38584
21 11PZ 0.00000 -0.08261 -0.22922 0.00000 0.00000
22 12D 0 0.00000 0.18543 0.11177 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.00000 0.40984 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 -0.40984
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.88183
26 12D-2 0.00000 0.00000 0.00000 -0.88183 0.00000
27 13D 0 0.00000 -1.30336 -1.21769 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.00000 1.25075 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 -1.25075
30 13D+2 0.00000 0.00000 0.00000 0.00000 1.71782
31 13D-2 0.00000 0.00000 0.00000 -1.71782 0.00000
32 14D 0 0.00000 0.02377 0.25754 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.00000 -0.14795 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.14795
35 14D+2 0.00000 0.00000 0.00000 0.00000 -0.23609
36 14D-2 0.00000 0.00000 0.00000 0.23609 0.00000
37 15F 0 0.00000 -1.25696 -0.50569 0.00000 0.00000
38 15F+1 0.00000 0.00000 0.00000 -0.14299 0.00000
39 15F-1 0.00000 0.00000 0.00000 0.00000 0.14299
40 15F+2 0.00000 0.00000 0.00000 0.00000 0.50391
41 15F-2 0.00000 0.00000 0.00000 -0.50391 0.00000
42 15F+3 0.14878 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 -0.98785 -0.76278 0.00000 0.00000
44 16F 0 0.00000 -0.26328 -0.13897 0.00000 0.00000
45 16F+1 0.00000 0.00000 0.00000 -0.16706 0.00000
46 16F-1 0.00000 0.00000 0.00000 0.00000 0.16706
47 16F+2 0.00000 0.00000 0.00000 0.00000 0.10377
48 16F-2 0.00000 0.00000 0.00000 -0.10377 0.00000
49 16F+3 0.63329 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 -0.39380 -0.31879 0.00000 0.00000
51 17G 0 0.00000 0.07259 -0.36973 0.00000 0.00000
52 17G+1 0.00000 0.00000 0.00000 -0.14417 0.00000
53 17G-1 0.00000 0.00000 0.00000 0.00000 0.14417
54 17G+2 0.00000 0.00000 0.00000 0.00000 -0.08383
55 17G-2 0.00000 0.00000 0.00000 0.08383 0.00000
56 17G+3 0.44032 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 -0.38983 -0.31575 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.00000 0.00000 -0.20325
59 17G-4 0.00000 0.00000 0.00000 -0.20325 0.00000
60 2 Si 1S 0.00000 -0.00454 0.01462 0.00000 0.00000
61 2S 0.00000 -0.03582 0.15616 0.00000 0.00000
62 3S 0.00000 -0.09061 0.23750 0.00000 0.00000
63 4S 0.00000 -3.51620 2.93033 0.00000 0.00000
64 5S 0.00000 9.70474 -8.52369 0.00000 0.00000
65 6S 0.00000 1.35658 -2.05323 0.00000 0.00000
66 7PX 0.00000 0.00000 0.00000 1.04670 0.00000
67 7PY 0.00000 0.00000 0.00000 0.00000 -1.04670
68 7PZ 0.00000 1.56518 -1.48712 0.00000 0.00000
69 8PX 0.00000 0.00000 0.00000 1.22489 0.00000
70 8PY 0.00000 0.00000 0.00000 0.00000 -1.22489
71 8PZ 0.00000 1.81772 -1.75321 0.00000 0.00000
72 9PX 0.00000 0.00000 0.00000 -1.99309 0.00000
73 9PY 0.00000 0.00000 0.00000 0.00000 1.99309
74 9PZ 0.00000 -3.26613 2.70426 0.00000 0.00000
75 10PX 0.00000 0.00000 0.00000 -3.95451 0.00000
76 10PY 0.00000 0.00000 0.00000 0.00000 3.95451
77 10PZ 0.00000 -1.70995 0.55842 0.00000 0.00000
78 11PX 0.00000 0.00000 0.00000 -0.38584 0.00000
79 11PY 0.00000 0.00000 0.00000 0.00000 0.38584
80 11PZ 0.00000 0.08261 -0.22922 0.00000 0.00000
81 12D 0 0.00000 0.18543 -0.11177 0.00000 0.00000
82 12D+1 0.00000 0.00000 0.00000 0.40984 0.00000
83 12D-1 0.00000 0.00000 0.00000 0.00000 -0.40984
84 12D+2 0.00000 0.00000 0.00000 0.00000 0.88183
85 12D-2 0.00000 0.00000 0.00000 -0.88183 0.00000
86 13D 0 0.00000 -1.30336 1.21769 0.00000 0.00000
87 13D+1 0.00000 0.00000 0.00000 1.25075 0.00000
88 13D-1 0.00000 0.00000 0.00000 0.00000 -1.25075
89 13D+2 0.00000 0.00000 0.00000 0.00000 1.71782
90 13D-2 0.00000 0.00000 0.00000 -1.71782 0.00000
91 14D 0 0.00000 0.02377 -0.25754 0.00000 0.00000
92 14D+1 0.00000 0.00000 0.00000 -0.14795 0.00000
93 14D-1 0.00000 0.00000 0.00000 0.00000 0.14795
94 14D+2 0.00000 0.00000 0.00000 0.00000 -0.23609
95 14D-2 0.00000 0.00000 0.00000 0.23609 0.00000
96 15F 0 0.00000 1.25696 -0.50569 0.00000 0.00000
97 15F+1 0.00000 0.00000 0.00000 0.14299 0.00000
98 15F-1 0.00000 0.00000 0.00000 0.00000 -0.14299
99 15F+2 0.00000 0.00000 0.00000 0.00000 -0.50391
100 15F-2 0.00000 0.00000 0.00000 0.50391 0.00000
101 15F+3 -0.14878 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.98785 -0.76278 0.00000 0.00000
103 16F 0 0.00000 0.26328 -0.13897 0.00000 0.00000
104 16F+1 0.00000 0.00000 0.00000 0.16706 0.00000
105 16F-1 0.00000 0.00000 0.00000 0.00000 -0.16706
106 16F+2 0.00000 0.00000 0.00000 0.00000 -0.10377
107 16F-2 0.00000 0.00000 0.00000 0.10377 0.00000
108 16F+3 -0.63329 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.39380 -0.31879 0.00000 0.00000
110 17G 0 0.00000 0.07259 0.36973 0.00000 0.00000
111 17G+1 0.00000 0.00000 0.00000 -0.14417 0.00000
112 17G-1 0.00000 0.00000 0.00000 0.00000 0.14417
113 17G+2 0.00000 0.00000 0.00000 0.00000 -0.08383
114 17G-2 0.00000 0.00000 0.00000 0.08383 0.00000
115 17G+3 0.44032 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 -0.38983 0.31575 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.00000 0.00000 -0.20325
118 17G-4 0.00000 0.00000 0.00000 -0.20325 0.00000
119 3 H 1S 0.00000 -0.25503 -0.04313 0.00000 0.68644
120 2S 0.00000 0.46023 0.19170 0.00000 -1.15679
121 3S 0.00000 -4.10449 -3.10145 0.00000 5.03956
122 4S 0.00000 -0.34617 -0.37449 0.00000 0.63272
123 5PX 0.26022 0.00000 0.00000 -0.19459 0.00000
124 5PY 0.00000 0.06864 0.20532 0.00000 0.06821
125 5PZ 0.00000 -0.08249 -0.22297 0.00000 -0.09797
126 6PX -0.08754 0.00000 0.00000 0.16319 0.00000
127 6PY 0.00000 0.16207 0.01466 0.00000 -0.30993
128 6PZ 0.00000 0.16741 0.21082 0.00000 -0.01141
129 7PX 0.34624 0.00000 0.00000 -0.13027 0.00000
130 7PY 0.00000 1.72636 1.39714 0.00000 -1.73646
131 7PZ 0.00000 0.36849 0.33747 0.00000 -0.84571
132 8D 0 0.00000 0.11129 -0.00832 0.00000 0.02898
133 8D+1 -0.01864 0.00000 0.00000 -0.03193 0.00000
134 8D-1 0.00000 0.04332 0.04725 0.00000 0.07315
135 8D+2 0.00000 0.03415 0.05074 0.00000 -0.05379
136 8D-2 -0.07901 0.00000 0.00000 0.09397 0.00000
137 9D 0 0.00000 0.17628 0.14980 0.00000 -0.05912
138 9D+1 -0.07385 0.00000 0.00000 0.02862 0.00000
139 9D-1 0.00000 -0.11982 -0.03395 0.00000 0.23225
140 9D+2 0.00000 0.26848 0.22434 0.00000 -0.21957
141 9D-2 -0.28742 0.00000 0.00000 0.05730 0.00000
142 10F 0 0.00000 0.02951 0.11748 0.00000 -0.05640
143 10F+1 -0.09482 0.00000 0.00000 0.01343 0.00000
144 10F-1 0.00000 -0.13453 -0.11921 0.00000 -0.10524
145 10F+2 0.00000 0.05322 0.10043 0.00000 -0.06566
146 10F-2 0.18864 0.00000 0.00000 -0.02450 0.00000
147 10F+3 -0.35637 0.00000 0.00000 0.08681 0.00000
148 10F-3 0.00000 0.03283 0.00584 0.00000 -0.13519
149 4 H 1S 0.00000 -0.25503 -0.04313 0.59447 -0.34322
150 2S 0.00000 0.46023 0.19170 -1.00181 0.57839
151 3S 0.00000 -4.10449 -3.10145 4.36438 -2.51978
152 4S 0.00000 -0.34617 -0.37449 0.54795 -0.31636
153 5PX -0.13011 -0.05945 -0.17782 -0.09980 -0.05473
154 5PY 0.22535 -0.03432 -0.10266 0.05473 0.16300
155 5PZ 0.00000 -0.08249 -0.22297 -0.08484 0.04899
156 6PX 0.04377 -0.14035 -0.01269 0.27325 -0.06354
157 6PY -0.07581 -0.08103 -0.00733 0.06354 -0.19988
158 6PZ 0.00000 0.16741 0.21082 -0.00988 0.00570
159 7PX -0.17312 -1.49507 -1.20996 1.26978 -0.80832
160 7PY 0.29986 -0.86318 -0.69857 0.80832 -0.33641
161 7PZ 0.00000 0.36849 0.33747 -0.73240 0.42285
162 8D 0 0.00000 0.11129 -0.00832 0.02510 -0.01449
163 8D+1 0.00932 -0.03752 -0.04092 -0.06284 0.01785
164 8D-1 -0.01615 -0.02166 -0.02363 -0.01785 0.04224
165 8D+2 -0.06842 -0.01707 -0.02537 -0.01740 -0.08392
166 8D-2 0.03950 -0.02957 -0.04395 0.06383 0.01740
167 9D 0 0.00000 0.17628 0.14980 -0.05120 0.02956
168 9D+1 0.03693 0.10377 0.02940 -0.16703 0.11296
169 9D-1 -0.06396 0.05991 0.01697 -0.11296 0.03660
170 9D+2 -0.24891 -0.13424 -0.11217 0.07027 -0.09787
171 9D-2 0.14371 -0.23251 -0.19429 0.17900 -0.07027
172 10F 0 0.00000 0.02951 0.11748 -0.04885 0.02820
173 10F+1 0.04741 0.11651 0.10324 0.08229 -0.03976
174 10F-1 -0.08211 0.06727 0.05960 0.03976 -0.03638
175 10F+2 0.16337 -0.02661 -0.05022 0.03904 0.00196
176 10F-2 -0.09432 -0.04609 -0.08698 0.04312 -0.03904
177 10F+3 -0.35637 0.00000 0.00000 -0.04340 -0.07518
178 10F-3 0.00000 0.03283 0.00584 -0.11707 0.06759
179 5 H 1S 0.00000 -0.25503 -0.04313 -0.59447 -0.34322
180 2S 0.00000 0.46023 0.19170 1.00181 0.57839
181 3S 0.00000 -4.10449 -3.10145 -4.36438 -2.51978
182 4S 0.00000 -0.34617 -0.37449 -0.54795 -0.31636
183 5PX -0.13011 0.05945 0.17782 -0.09980 0.05473
184 5PY -0.22535 -0.03432 -0.10266 -0.05473 0.16300
185 5PZ 0.00000 -0.08249 -0.22297 0.08484 0.04899
186 6PX 0.04377 0.14035 0.01269 0.27325 0.06354
187 6PY 0.07581 -0.08103 -0.00733 -0.06354 -0.19988
188 6PZ 0.00000 0.16741 0.21082 0.00988 0.00570
189 7PX -0.17312 1.49507 1.20996 1.26978 0.80832
190 7PY -0.29986 -0.86318 -0.69857 -0.80832 -0.33641
191 7PZ 0.00000 0.36849 0.33747 0.73240 0.42285
192 8D 0 0.00000 0.11129 -0.00832 -0.02510 -0.01449
193 8D+1 0.00932 0.03752 0.04092 -0.06284 -0.01785
194 8D-1 0.01615 -0.02166 -0.02363 0.01785 0.04224
195 8D+2 0.06842 -0.01707 -0.02537 0.01740 -0.08392
196 8D-2 0.03950 0.02957 0.04395 0.06383 -0.01740
197 9D 0 0.00000 0.17628 0.14980 0.05120 0.02956
198 9D+1 0.03693 -0.10377 -0.02940 -0.16703 -0.11296
199 9D-1 0.06396 0.05991 0.01697 0.11296 0.03660
200 9D+2 0.24891 -0.13424 -0.11217 -0.07027 -0.09787
201 9D-2 0.14371 0.23251 0.19429 0.17900 0.07027
202 10F 0 0.00000 0.02951 0.11748 0.04885 0.02820
203 10F+1 0.04741 -0.11651 -0.10324 0.08229 0.03976
204 10F-1 0.08211 0.06727 0.05960 -0.03976 -0.03638
205 10F+2 -0.16337 -0.02661 -0.05022 -0.03904 0.00196
206 10F-2 -0.09432 0.04609 0.08698 0.04312 0.03904
207 10F+3 -0.35637 0.00000 0.00000 -0.04340 0.07518
208 10F-3 0.00000 0.03283 0.00584 0.11707 0.06759
209 6 H 1S 0.00000 -0.25503 0.04313 0.00000 0.68644
210 2S 0.00000 0.46023 -0.19170 0.00000 -1.15679
211 3S 0.00000 -4.10449 3.10145 0.00000 5.03956
212 4S 0.00000 -0.34617 0.37449 0.00000 0.63272
213 5PX -0.26022 0.00000 0.00000 0.19459 0.00000
214 5PY 0.00000 -0.06864 0.20532 0.00000 -0.06821
215 5PZ 0.00000 0.08249 -0.22297 0.00000 0.09797
216 6PX 0.08754 0.00000 0.00000 -0.16319 0.00000
217 6PY 0.00000 -0.16207 0.01466 0.00000 0.30993
218 6PZ 0.00000 -0.16741 0.21082 0.00000 0.01141
219 7PX -0.34624 0.00000 0.00000 0.13027 0.00000
220 7PY 0.00000 -1.72636 1.39714 0.00000 1.73646
221 7PZ 0.00000 -0.36849 0.33747 0.00000 0.84571
222 8D 0 0.00000 0.11129 0.00832 0.00000 0.02898
223 8D+1 -0.01864 0.00000 0.00000 -0.03193 0.00000
224 8D-1 0.00000 0.04332 -0.04725 0.00000 0.07315
225 8D+2 0.00000 0.03415 -0.05074 0.00000 -0.05379
226 8D-2 -0.07901 0.00000 0.00000 0.09397 0.00000
227 9D 0 0.00000 0.17628 -0.14980 0.00000 -0.05912
228 9D+1 -0.07385 0.00000 0.00000 0.02862 0.00000
229 9D-1 0.00000 -0.11982 0.03395 0.00000 0.23225
230 9D+2 0.00000 0.26848 -0.22434 0.00000 -0.21957
231 9D-2 -0.28742 0.00000 0.00000 0.05730 0.00000
232 10F 0 0.00000 -0.02951 0.11748 0.00000 0.05640
233 10F+1 0.09482 0.00000 0.00000 -0.01343 0.00000
234 10F-1 0.00000 0.13453 -0.11921 0.00000 0.10524
235 10F+2 0.00000 -0.05322 0.10043 0.00000 0.06566
236 10F-2 -0.18864 0.00000 0.00000 0.02450 0.00000
237 10F+3 0.35637 0.00000 0.00000 -0.08681 0.00000
238 10F-3 0.00000 -0.03283 0.00584 0.00000 0.13519
239 7 H 1S 0.00000 -0.25503 0.04313 -0.59447 -0.34322
240 2S 0.00000 0.46023 -0.19170 1.00181 0.57839
241 3S 0.00000 -4.10449 3.10145 -4.36438 -2.51978
242 4S 0.00000 -0.34617 0.37449 -0.54795 -0.31636
243 5PX 0.13011 -0.05945 0.17782 0.09980 -0.05473
244 5PY 0.22535 0.03432 -0.10266 0.05473 -0.16300
245 5PZ 0.00000 0.08249 -0.22297 -0.08484 -0.04899
246 6PX -0.04377 -0.14035 0.01269 -0.27325 -0.06354
247 6PY -0.07581 0.08103 -0.00733 0.06354 0.19988
248 6PZ 0.00000 -0.16741 0.21082 -0.00988 -0.00570
249 7PX 0.17312 -1.49507 1.20996 -1.26978 -0.80832
250 7PY 0.29986 0.86318 -0.69857 0.80832 0.33641
251 7PZ 0.00000 -0.36849 0.33747 -0.73240 -0.42285
252 8D 0 0.00000 0.11129 0.00832 -0.02510 -0.01449
253 8D+1 0.00932 0.03752 -0.04092 -0.06284 -0.01785
254 8D-1 0.01615 -0.02166 0.02363 0.01785 0.04224
255 8D+2 0.06842 -0.01707 0.02537 0.01740 -0.08392
256 8D-2 0.03950 0.02957 -0.04395 0.06383 -0.01740
257 9D 0 0.00000 0.17628 -0.14980 0.05120 0.02956
258 9D+1 0.03693 -0.10377 0.02940 -0.16703 -0.11296
259 9D-1 0.06396 0.05991 -0.01697 0.11296 0.03660
260 9D+2 0.24891 -0.13424 0.11217 -0.07027 -0.09787
261 9D-2 0.14371 0.23251 -0.19429 0.17900 0.07027
262 10F 0 0.00000 -0.02951 0.11748 -0.04885 -0.02820
263 10F+1 -0.04741 0.11651 -0.10324 -0.08229 -0.03976
264 10F-1 -0.08211 -0.06727 0.05960 0.03976 0.03638
265 10F+2 0.16337 0.02661 -0.05022 0.03904 -0.00196
266 10F-2 0.09432 -0.04609 0.08698 -0.04312 -0.03904
267 10F+3 0.35637 0.00000 0.00000 0.04340 -0.07518
268 10F-3 0.00000 -0.03283 0.00584 -0.11707 -0.06759
269 8 H 1S 0.00000 -0.25503 0.04313 0.59447 -0.34322
270 2S 0.00000 0.46023 -0.19170 -1.00181 0.57839
271 3S 0.00000 -4.10449 3.10145 4.36438 -2.51978
272 4S 0.00000 -0.34617 0.37449 0.54795 -0.31636
273 5PX 0.13011 0.05945 -0.17782 0.09980 0.05473
274 5PY -0.22535 0.03432 -0.10266 -0.05473 -0.16300
275 5PZ 0.00000 0.08249 -0.22297 0.08484 -0.04899
276 6PX -0.04377 0.14035 -0.01269 -0.27325 0.06354
277 6PY 0.07581 0.08103 -0.00733 -0.06354 0.19988
278 6PZ 0.00000 -0.16741 0.21082 0.00988 -0.00570
279 7PX 0.17312 1.49507 -1.20996 -1.26978 0.80832
280 7PY -0.29986 0.86318 -0.69857 -0.80832 0.33641
281 7PZ 0.00000 -0.36849 0.33747 0.73240 -0.42285
282 8D 0 0.00000 0.11129 0.00832 0.02510 -0.01449
283 8D+1 0.00932 -0.03752 0.04092 -0.06284 0.01785
284 8D-1 -0.01615 -0.02166 0.02363 -0.01785 0.04224
285 8D+2 -0.06842 -0.01707 0.02537 -0.01740 -0.08392
286 8D-2 0.03950 -0.02957 0.04395 0.06383 0.01740
287 9D 0 0.00000 0.17628 -0.14980 -0.05120 0.02956
288 9D+1 0.03693 0.10377 -0.02940 -0.16703 0.11296
289 9D-1 -0.06396 0.05991 -0.01697 -0.11296 0.03660
290 9D+2 -0.24891 -0.13424 0.11217 0.07027 -0.09787
291 9D-2 0.14371 -0.23251 0.19429 0.17900 -0.07027
292 10F 0 0.00000 -0.02951 0.11748 0.04885 -0.02820
293 10F+1 -0.04741 -0.11651 0.10324 -0.08229 0.03976
294 10F-1 0.08211 -0.06727 0.05960 -0.03976 0.03638
295 10F+2 -0.16337 0.02661 -0.05022 -0.03904 -0.00196
296 10F-2 0.09432 0.04609 -0.08698 -0.04312 0.03904
297 10F+3 0.35637 0.00000 0.00000 0.04340 0.07518
298 10F-3 0.00000 -0.03283 0.00584 0.11707 -0.06759
241 242 243 244 245
(EU)--V (EU)--V (A2U)--V (A1G)--V (EG)--V
Eigenvalues -- 7.68878 7.68878 7.90891 7.96262 8.01176
1 1 Si 1S 0.00000 0.00000 -0.03353 -0.01706 0.00000
2 2S 0.00000 0.00000 -0.38171 -0.16550 0.00000
3 3S 0.00000 0.00000 -0.52439 -0.26324 0.00000
4 4S 0.00000 0.00000 -0.07512 -0.72951 0.00000
5 5S 0.00000 0.00000 -0.96789 1.01151 0.00000
6 6S 0.00000 0.00000 -0.21251 0.60001 0.00000
7 7PX -1.05797 0.00000 0.00000 0.00000 -0.64213
8 7PY 0.00000 1.05797 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 -0.02776 -0.48476 0.00000
10 8PX -1.23737 0.00000 0.00000 0.00000 -0.77565
11 8PY 0.00000 1.23737 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 -0.03218 -0.56041 0.00000
13 9PX 2.04647 0.00000 0.00000 0.00000 1.13305
14 9PY 0.00000 -2.04647 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.06982 1.03527 0.00000
16 10PX 4.10064 0.00000 0.00000 0.00000 1.02901
17 10PY 0.00000 -4.10064 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 -1.25101 0.01610 0.00000
19 11PX 0.43280 0.00000 0.00000 0.00000 0.24979
20 11PY 0.00000 -0.43280 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.13028 -0.06668 0.00000
22 12D 0 0.00000 0.00000 0.37882 0.36610 0.00000
23 12D+1 0.84396 0.00000 0.00000 0.00000 0.16829
24 12D-1 0.00000 -0.84396 0.00000 0.00000 0.00000
25 12D+2 0.00000 1.29916 0.00000 0.00000 0.00000
26 12D-2 -1.29916 0.00000 0.00000 0.00000 -0.13696
27 13D 0 0.00000 0.00000 0.33495 -0.31181 0.00000
28 13D+1 1.23754 0.00000 0.00000 0.00000 0.58742
29 13D-1 0.00000 -1.23754 0.00000 0.00000 0.00000
30 13D+2 0.00000 1.69378 0.00000 0.00000 0.00000
31 13D-2 -1.69378 0.00000 0.00000 0.00000 -0.72391
32 14D 0 0.00000 0.00000 -0.06398 -0.02214 0.00000
33 14D+1 -0.16225 0.00000 0.00000 0.00000 -0.11897
34 14D-1 0.00000 0.16225 0.00000 0.00000 0.00000
35 14D+2 0.00000 -0.22814 0.00000 0.00000 0.00000
36 14D-2 0.22814 0.00000 0.00000 0.00000 0.15702
37 15F 0 0.00000 0.00000 -0.06766 -0.45227 0.00000
38 15F+1 -0.33506 0.00000 0.00000 0.00000 -0.04979
39 15F-1 0.00000 0.33506 0.00000 0.00000 0.00000
40 15F+2 0.00000 0.52730 0.00000 0.00000 0.00000
41 15F-2 -0.52730 0.00000 0.00000 0.00000 -0.15384
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.15398 -0.20824 0.00000
44 16F 0 0.00000 0.00000 -0.05567 -0.04182 0.00000
45 16F+1 -0.03748 0.00000 0.00000 0.00000 -0.02395
46 16F-1 0.00000 0.03748 0.00000 0.00000 0.00000
47 16F+2 0.00000 0.16004 0.00000 0.00000 0.00000
48 16F-2 -0.16004 0.00000 0.00000 0.00000 -0.15666
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 -0.11032 -0.19913 0.00000
51 17G 0 0.00000 0.00000 0.03657 0.06293 0.00000
52 17G+1 -0.10359 0.00000 0.00000 0.00000 -0.13904
53 17G-1 0.00000 0.10359 0.00000 0.00000 0.00000
54 17G+2 0.00000 -0.03422 0.00000 0.00000 0.00000
55 17G-2 0.03422 0.00000 0.00000 0.00000 -0.01787
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 -0.14471 -0.27360 0.00000
58 17G+4 0.00000 -0.16077 0.00000 0.00000 0.00000
59 17G-4 -0.16077 0.00000 0.00000 0.00000 -0.10576
60 2 Si 1S 0.00000 0.00000 0.03353 -0.01706 0.00000
61 2S 0.00000 0.00000 0.38171 -0.16550 0.00000
62 3S 0.00000 0.00000 0.52439 -0.26324 0.00000
63 4S 0.00000 0.00000 0.07512 -0.72951 0.00000
64 5S 0.00000 0.00000 0.96789 1.01151 0.00000
65 6S 0.00000 0.00000 0.21251 0.60001 0.00000
66 7PX -1.05797 0.00000 0.00000 0.00000 0.64213
67 7PY 0.00000 1.05797 0.00000 0.00000 0.00000
68 7PZ 0.00000 0.00000 -0.02776 0.48476 0.00000
69 8PX -1.23737 0.00000 0.00000 0.00000 0.77565
70 8PY 0.00000 1.23737 0.00000 0.00000 0.00000
71 8PZ 0.00000 0.00000 -0.03218 0.56041 0.00000
72 9PX 2.04647 0.00000 0.00000 0.00000 -1.13305
73 9PY 0.00000 -2.04647 0.00000 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.06982 -1.03527 0.00000
75 10PX 4.10064 0.00000 0.00000 0.00000 -1.02901
76 10PY 0.00000 -4.10064 0.00000 0.00000 0.00000
77 10PZ 0.00000 0.00000 -1.25101 -0.01610 0.00000
78 11PX 0.43280 0.00000 0.00000 0.00000 -0.24979
79 11PY 0.00000 -0.43280 0.00000 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.13028 0.06668 0.00000
81 12D 0 0.00000 0.00000 -0.37882 0.36610 0.00000
82 12D+1 -0.84396 0.00000 0.00000 0.00000 0.16829
83 12D-1 0.00000 0.84396 0.00000 0.00000 0.00000
84 12D+2 0.00000 -1.29916 0.00000 0.00000 0.00000
85 12D-2 1.29916 0.00000 0.00000 0.00000 -0.13696
86 13D 0 0.00000 0.00000 -0.33495 -0.31181 0.00000
87 13D+1 -1.23754 0.00000 0.00000 0.00000 0.58742
88 13D-1 0.00000 1.23754 0.00000 0.00000 0.00000
89 13D+2 0.00000 -1.69378 0.00000 0.00000 0.00000
90 13D-2 1.69378 0.00000 0.00000 0.00000 -0.72391
91 14D 0 0.00000 0.00000 0.06398 -0.02214 0.00000
92 14D+1 0.16225 0.00000 0.00000 0.00000 -0.11897
93 14D-1 0.00000 -0.16225 0.00000 0.00000 0.00000
94 14D+2 0.00000 0.22814 0.00000 0.00000 0.00000
95 14D-2 -0.22814 0.00000 0.00000 0.00000 0.15702
96 15F 0 0.00000 0.00000 -0.06766 0.45227 0.00000
97 15F+1 -0.33506 0.00000 0.00000 0.00000 0.04979
98 15F-1 0.00000 0.33506 0.00000 0.00000 0.00000
99 15F+2 0.00000 0.52730 0.00000 0.00000 0.00000
100 15F-2 -0.52730 0.00000 0.00000 0.00000 0.15384
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.15398 0.20824 0.00000
103 16F 0 0.00000 0.00000 -0.05567 0.04182 0.00000
104 16F+1 -0.03748 0.00000 0.00000 0.00000 0.02395
105 16F-1 0.00000 0.03748 0.00000 0.00000 0.00000
106 16F+2 0.00000 0.16004 0.00000 0.00000 0.00000
107 16F-2 -0.16004 0.00000 0.00000 0.00000 0.15666
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 -0.11032 0.19913 0.00000
110 17G 0 0.00000 0.00000 -0.03657 0.06293 0.00000
111 17G+1 0.10359 0.00000 0.00000 0.00000 -0.13904
112 17G-1 0.00000 -0.10359 0.00000 0.00000 0.00000
113 17G+2 0.00000 0.03422 0.00000 0.00000 0.00000
114 17G-2 -0.03422 0.00000 0.00000 0.00000 -0.01787
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.14471 -0.27360 0.00000
117 17G+4 0.00000 0.16077 0.00000 0.00000 0.00000
118 17G-4 0.16077 0.00000 0.00000 0.00000 -0.10576
119 3 H 1S 0.00000 0.68820 0.59494 0.45611 0.00000
120 2S 0.00000 -1.22115 -1.03410 -0.78341 0.00000
121 3S 0.00000 5.37733 1.42833 -0.02301 0.00000
122 4S 0.00000 0.90586 -0.13315 -0.26148 0.00000
123 5PX -0.23598 0.00000 0.00000 0.00000 -0.39103
124 5PY 0.00000 0.03024 0.20024 0.41482 0.00000
125 5PZ 0.00000 -0.10956 0.07466 0.00143 0.00000
126 6PX 0.20289 0.00000 0.00000 0.00000 0.37885
127 6PY 0.00000 -0.25790 -0.09975 -0.25808 0.00000
128 6PZ 0.00000 0.01215 -0.04669 0.05077 0.00000
129 7PX -0.06618 0.00000 0.00000 0.00000 -0.19953
130 7PY 0.00000 -1.82448 -0.31386 0.32262 0.00000
131 7PZ 0.00000 -0.81101 -0.12795 -0.01058 0.00000
132 8D 0 0.00000 0.01884 -0.09576 -0.04412 0.00000
133 8D+1 -0.02838 0.00000 0.00000 0.00000 0.04763
134 8D-1 0.00000 0.09825 0.08136 0.11391 0.00000
135 8D+2 0.00000 -0.05953 -0.11081 -0.10039 0.00000
136 8D-2 0.08903 0.00000 0.00000 0.00000 -0.02047
137 9D 0 0.00000 -0.08695 0.03397 0.05801 0.00000
138 9D+1 0.02320 0.00000 0.00000 0.00000 -0.00065
139 9D-1 0.00000 0.18534 -0.01735 -0.07370 0.00000
140 9D+2 0.00000 -0.22813 0.03932 0.11049 0.00000
141 9D-2 0.02762 0.00000 0.00000 0.00000 0.03491
142 10F 0 0.00000 -0.07496 -0.02802 -0.02142 0.00000
143 10F+1 0.00438 0.00000 0.00000 0.00000 -0.00561
144 10F-1 0.00000 -0.06371 -0.00827 -0.01391 0.00000
145 10F+2 0.00000 -0.10598 -0.02386 -0.01139 0.00000
146 10F-2 -0.02298 0.00000 0.00000 0.00000 -0.03622
147 10F+3 0.05637 0.00000 0.00000 0.00000 0.00863
148 10F-3 0.00000 -0.09760 -0.06041 -0.04852 0.00000
149 4 H 1S 0.59600 -0.34410 0.59494 0.45611 -0.34398
150 2S -1.05754 0.61057 -1.03410 -0.78341 0.53204
151 3S 4.65690 -2.68866 1.42833 -0.02301 0.80520
152 4S 0.78450 -0.45293 -0.13315 -0.26148 0.50544
153 5PX -0.08167 -0.08909 -0.17341 -0.35924 0.30690
154 5PY 0.08909 0.18454 -0.10012 -0.20741 0.40295
155 5PZ -0.09488 0.05478 0.07466 0.00143 -0.29017
156 6PX 0.24415 -0.02382 0.08639 0.22350 -0.16302
157 6PY 0.02382 -0.21664 0.04988 0.12904 -0.31285
158 6PZ 0.01053 -0.00608 -0.04669 0.05077 0.22302
159 7PX 1.35181 -0.81868 0.27181 -0.27940 0.57782
160 7PY 0.81868 -0.40649 0.15693 -0.16131 0.44880
161 7PZ -0.70235 0.40550 -0.12795 -0.01058 -0.27280
162 8D 0 0.01632 -0.00942 -0.09576 -0.04412 -0.01146
163 8D+1 -0.08078 0.03026 -0.07046 -0.09865 0.08018
164 8D-1 -0.03026 0.04585 -0.04068 -0.05696 0.01879
165 8D+2 -0.01277 -0.08165 0.05540 0.05020 -0.05486
166 8D-2 0.06690 0.01277 0.09596 0.08694 -0.11549
167 9D 0 -0.07530 0.04348 0.03397 0.05801 -0.04680
168 9D+1 -0.13320 0.09030 0.01503 0.06383 -0.08348
169 9D-1 -0.09030 0.02894 0.00868 0.03685 -0.04782
170 9D+2 0.08682 -0.07775 -0.01966 -0.05524 0.05954
171 9D-2 0.17800 -0.08682 -0.03405 -0.09568 0.13803
172 10F 0 -0.06491 0.03748 -0.02802 -0.02142 -0.03312
173 10F+1 0.04888 -0.02569 0.00716 0.01205 0.00653
174 10F-1 0.02569 -0.01921 0.00413 0.00695 0.00701
175 10F+2 0.05584 -0.00926 0.01193 0.00570 0.04142
176 10F-2 0.07374 -0.05584 0.02067 0.00987 0.03552
177 10F+3 -0.02819 -0.04882 0.00000 0.00000 -0.00431
178 10F-3 -0.08453 0.04880 -0.06041 -0.04852 -0.06084
179 5 H 1S -0.59600 -0.34410 0.59494 0.45611 0.34398
180 2S 1.05754 0.61057 -1.03410 -0.78341 -0.53204
181 3S -4.65690 -2.68866 1.42833 -0.02301 -0.80520
182 4S -0.78450 -0.45293 -0.13315 -0.26148 -0.50544
183 5PX -0.08167 0.08909 0.17341 0.35924 0.30690
184 5PY -0.08909 0.18454 -0.10012 -0.20741 -0.40295
185 5PZ 0.09488 0.05478 0.07466 0.00143 0.29017
186 6PX 0.24415 0.02382 -0.08639 -0.22350 -0.16302
187 6PY -0.02382 -0.21664 0.04988 0.12904 0.31285
188 6PZ -0.01053 -0.00608 -0.04669 0.05077 -0.22302
189 7PX 1.35181 0.81868 -0.27181 0.27940 0.57782
190 7PY -0.81868 -0.40649 0.15693 -0.16131 -0.44880
191 7PZ 0.70235 0.40550 -0.12795 -0.01058 0.27280
192 8D 0 -0.01632 -0.00942 -0.09576 -0.04412 0.01146
193 8D+1 -0.08078 -0.03026 0.07046 0.09865 0.08018
194 8D-1 0.03026 0.04585 -0.04068 -0.05696 -0.01879
195 8D+2 0.01277 -0.08165 0.05540 0.05020 0.05486
196 8D-2 0.06690 -0.01277 -0.09596 -0.08694 -0.11549
197 9D 0 0.07530 0.04348 0.03397 0.05801 0.04680
198 9D+1 -0.13320 -0.09030 -0.01503 -0.06383 -0.08348
199 9D-1 0.09030 0.02894 0.00868 0.03685 0.04782
200 9D+2 -0.08682 -0.07775 -0.01966 -0.05524 -0.05954
201 9D-2 0.17800 0.08682 0.03405 0.09568 0.13803
202 10F 0 0.06491 0.03748 -0.02802 -0.02142 0.03312
203 10F+1 0.04888 0.02569 -0.00716 -0.01205 0.00653
204 10F-1 -0.02569 -0.01921 0.00413 0.00695 -0.00701
205 10F+2 -0.05584 -0.00926 0.01193 0.00570 -0.04142
206 10F-2 0.07374 0.05584 -0.02067 -0.00987 0.03552
207 10F+3 -0.02819 0.04882 0.00000 0.00000 -0.00431
208 10F-3 0.08453 0.04880 -0.06041 -0.04852 0.06084
209 6 H 1S 0.00000 -0.68820 -0.59494 0.45611 0.00000
210 2S 0.00000 1.22115 1.03410 -0.78341 0.00000
211 3S 0.00000 -5.37733 -1.42833 -0.02301 0.00000
212 4S 0.00000 -0.90586 0.13315 -0.26148 0.00000
213 5PX -0.23598 0.00000 0.00000 0.00000 0.39103
214 5PY 0.00000 0.03024 0.20024 -0.41482 0.00000
215 5PZ 0.00000 -0.10956 0.07466 -0.00143 0.00000
216 6PX 0.20289 0.00000 0.00000 0.00000 -0.37885
217 6PY 0.00000 -0.25790 -0.09975 0.25808 0.00000
218 6PZ 0.00000 0.01215 -0.04669 -0.05077 0.00000
219 7PX -0.06618 0.00000 0.00000 0.00000 0.19953
220 7PY 0.00000 -1.82448 -0.31386 -0.32262 0.00000
221 7PZ 0.00000 -0.81101 -0.12795 0.01058 0.00000
222 8D 0 0.00000 -0.01884 0.09576 -0.04412 0.00000
223 8D+1 0.02838 0.00000 0.00000 0.00000 0.04763
224 8D-1 0.00000 -0.09825 -0.08136 0.11391 0.00000
225 8D+2 0.00000 0.05953 0.11081 -0.10039 0.00000
226 8D-2 -0.08903 0.00000 0.00000 0.00000 -0.02047
227 9D 0 0.00000 0.08695 -0.03397 0.05801 0.00000
228 9D+1 -0.02320 0.00000 0.00000 0.00000 -0.00065
229 9D-1 0.00000 -0.18534 0.01735 -0.07370 0.00000
230 9D+2 0.00000 0.22813 -0.03932 0.11049 0.00000
231 9D-2 -0.02762 0.00000 0.00000 0.00000 0.03491
232 10F 0 0.00000 -0.07496 -0.02802 0.02142 0.00000
233 10F+1 0.00438 0.00000 0.00000 0.00000 0.00561
234 10F-1 0.00000 -0.06371 -0.00827 0.01391 0.00000
235 10F+2 0.00000 -0.10598 -0.02386 0.01139 0.00000
236 10F-2 -0.02298 0.00000 0.00000 0.00000 0.03622
237 10F+3 0.05637 0.00000 0.00000 0.00000 -0.00863
238 10F-3 0.00000 -0.09760 -0.06041 0.04852 0.00000
239 7 H 1S 0.59600 0.34410 -0.59494 0.45611 0.34398
240 2S -1.05754 -0.61057 1.03410 -0.78341 -0.53204
241 3S 4.65690 2.68866 -1.42833 -0.02301 -0.80520
242 4S 0.78450 0.45293 0.13315 -0.26148 -0.50544
243 5PX -0.08167 0.08909 0.17341 -0.35924 -0.30690
244 5PY -0.08909 0.18454 -0.10012 0.20741 0.40295
245 5PZ 0.09488 0.05478 0.07466 -0.00143 -0.29017
246 6PX 0.24415 0.02382 -0.08639 0.22350 0.16302
247 6PY -0.02382 -0.21664 0.04988 -0.12904 -0.31285
248 6PZ -0.01053 -0.00608 -0.04669 -0.05077 0.22302
249 7PX 1.35181 0.81868 -0.27181 -0.27940 -0.57782
250 7PY -0.81868 -0.40649 0.15693 0.16131 0.44880
251 7PZ 0.70235 0.40550 -0.12795 0.01058 -0.27280
252 8D 0 0.01632 0.00942 0.09576 -0.04412 0.01146
253 8D+1 0.08078 0.03026 -0.07046 0.09865 0.08018
254 8D-1 -0.03026 -0.04585 0.04068 -0.05696 -0.01879
255 8D+2 -0.01277 0.08165 -0.05540 0.05020 0.05486
256 8D-2 -0.06690 0.01277 0.09596 -0.08694 -0.11549
257 9D 0 -0.07530 -0.04348 -0.03397 0.05801 0.04680
258 9D+1 0.13320 0.09030 0.01503 -0.06383 -0.08348
259 9D-1 -0.09030 -0.02894 -0.00868 0.03685 0.04782
260 9D+2 0.08682 0.07775 0.01966 -0.05524 -0.05954
261 9D-2 -0.17800 -0.08682 -0.03405 0.09568 0.13803
262 10F 0 0.06491 0.03748 -0.02802 0.02142 -0.03312
263 10F+1 0.04888 0.02569 -0.00716 0.01205 -0.00653
264 10F-1 -0.02569 -0.01921 0.00413 -0.00695 0.00701
265 10F+2 -0.05584 -0.00926 0.01193 -0.00570 0.04142
266 10F-2 0.07374 0.05584 -0.02067 0.00987 -0.03552
267 10F+3 -0.02819 0.04882 0.00000 0.00000 0.00431
268 10F-3 0.08453 0.04880 -0.06041 0.04852 -0.06084
269 8 H 1S -0.59600 0.34410 -0.59494 0.45611 -0.34398
270 2S 1.05754 -0.61057 1.03410 -0.78341 0.53204
271 3S -4.65690 2.68866 -1.42833 -0.02301 0.80520
272 4S -0.78450 0.45293 0.13315 -0.26148 0.50544
273 5PX -0.08167 -0.08909 -0.17341 0.35924 -0.30690
274 5PY 0.08909 0.18454 -0.10012 0.20741 -0.40295
275 5PZ -0.09488 0.05478 0.07466 -0.00143 0.29017
276 6PX 0.24415 -0.02382 0.08639 -0.22350 0.16302
277 6PY 0.02382 -0.21664 0.04988 -0.12904 0.31285
278 6PZ 0.01053 -0.00608 -0.04669 -0.05077 -0.22302
279 7PX 1.35181 -0.81868 0.27181 0.27940 -0.57782
280 7PY 0.81868 -0.40649 0.15693 0.16131 -0.44880
281 7PZ -0.70235 0.40550 -0.12795 0.01058 0.27280
282 8D 0 -0.01632 0.00942 0.09576 -0.04412 -0.01146
283 8D+1 0.08078 -0.03026 0.07046 -0.09865 0.08018
284 8D-1 0.03026 -0.04585 0.04068 -0.05696 0.01879
285 8D+2 0.01277 0.08165 -0.05540 0.05020 -0.05486
286 8D-2 -0.06690 -0.01277 -0.09596 0.08694 -0.11549
287 9D 0 0.07530 -0.04348 -0.03397 0.05801 -0.04680
288 9D+1 0.13320 -0.09030 -0.01503 0.06383 -0.08348
289 9D-1 0.09030 -0.02894 -0.00868 0.03685 -0.04782
290 9D+2 -0.08682 0.07775 0.01966 -0.05524 0.05954
291 9D-2 -0.17800 0.08682 0.03405 -0.09568 0.13803
292 10F 0 -0.06491 0.03748 -0.02802 0.02142 0.03312
293 10F+1 0.04888 -0.02569 0.00716 -0.01205 -0.00653
294 10F-1 0.02569 -0.01921 0.00413 -0.00695 -0.00701
295 10F+2 0.05584 -0.00926 0.01193 -0.00570 -0.04142
296 10F-2 0.07374 -0.05584 0.02067 -0.00987 -0.03552
297 10F+3 -0.02819 -0.04882 0.00000 0.00000 0.00431
298 10F-3 -0.08453 0.04880 -0.06041 0.04852 0.06084
246 247 248 249 250
(EG)--V (EU)--V (EU)--V (EG)--V (EG)--V
Eigenvalues -- 8.01176 8.04404 8.04404 8.21340 8.21340
1 1 Si 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 -0.67938 0.00000 0.30467 0.00000
8 7PY -0.64213 0.00000 -0.67938 0.00000 0.30467
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.81892 0.00000 0.36354 0.00000
11 8PY -0.77565 0.00000 -0.81892 0.00000 0.36354
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 1.21297 0.00000 -0.50328 0.00000
14 9PY 1.13305 0.00000 1.21297 0.00000 -0.50328
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.72805 0.00000 -0.75715 0.00000
17 10PY 1.02901 0.00000 0.72805 0.00000 -0.75715
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.13725 0.00000 -0.32310 0.00000
20 11PY 0.24979 0.00000 0.13725 0.00000 -0.32310
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 -0.00467 0.00000 0.17832 0.00000
24 12D-1 0.16829 0.00000 -0.00467 0.00000 0.17832
25 12D+2 -0.13696 0.00000 0.10612 0.00000 0.42923
26 12D-2 0.00000 0.10612 0.00000 0.42923 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.60559 0.00000 -0.36119 0.00000
29 13D-1 0.58742 0.00000 0.60559 0.00000 -0.36119
30 13D+2 -0.72391 0.00000 -0.68531 0.00000 0.26361
31 13D-2 0.00000 -0.68531 0.00000 0.26361 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 -0.13211 0.00000 0.07019 0.00000
34 14D-1 -0.11897 0.00000 -0.13211 0.00000 0.07019
35 14D+2 0.15702 0.00000 0.16053 0.00000 -0.05932
36 14D-2 0.00000 0.16053 0.00000 -0.05932 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.00013 0.00000 0.07316 0.00000
39 15F-1 -0.04979 0.00000 0.00013 0.00000 0.07316
40 15F+2 -0.15384 0.00000 -0.11419 0.00000 0.12924
41 15F-2 0.00000 -0.11419 0.00000 0.12924 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 -0.08176 0.00000 -0.02059 0.00000
46 16F-1 -0.02395 0.00000 -0.08176 0.00000 -0.02059
47 16F+2 -0.15666 0.00000 -0.11363 0.00000 -0.00414
48 16F-2 0.00000 -0.11363 0.00000 -0.00414 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 -0.11654 0.00000 0.10907 0.00000
53 17G-1 -0.13904 0.00000 -0.11654 0.00000 0.10907
54 17G+2 -0.01787 0.00000 0.00248 0.00000 0.00280
55 17G-2 0.00000 0.00248 0.00000 0.00280 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.10576 0.00000 0.14238 0.00000 -0.10632
59 17G-4 0.00000 -0.14238 0.00000 0.10632 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00000
61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
62 3S 0.00000 0.00000 0.00000 0.00000 0.00000
63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
64 5S 0.00000 0.00000 0.00000 0.00000 0.00000
65 6S 0.00000 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 -0.67938 0.00000 -0.30467 0.00000
67 7PY 0.64213 0.00000 -0.67938 0.00000 -0.30467
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 -0.81892 0.00000 -0.36354 0.00000
70 8PY 0.77565 0.00000 -0.81892 0.00000 -0.36354
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 1.21297 0.00000 0.50328 0.00000
73 9PY -1.13305 0.00000 1.21297 0.00000 0.50328
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 0.72805 0.00000 0.75715 0.00000
76 10PY -1.02901 0.00000 0.72805 0.00000 0.75715
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 0.13725 0.00000 0.32310 0.00000
79 11PY -0.24979 0.00000 0.13725 0.00000 0.32310
80 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.00467 0.00000 0.17832 0.00000
83 12D-1 0.16829 0.00000 0.00467 0.00000 0.17832
84 12D+2 -0.13696 0.00000 -0.10612 0.00000 0.42923
85 12D-2 0.00000 -0.10612 0.00000 0.42923 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 -0.60559 0.00000 -0.36119 0.00000
88 13D-1 0.58742 0.00000 -0.60559 0.00000 -0.36119
89 13D+2 -0.72391 0.00000 0.68531 0.00000 0.26361
90 13D-2 0.00000 0.68531 0.00000 0.26361 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.13211 0.00000 0.07019 0.00000
93 14D-1 -0.11897 0.00000 0.13211 0.00000 0.07019
94 14D+2 0.15702 0.00000 -0.16053 0.00000 -0.05932
95 14D-2 0.00000 -0.16053 0.00000 -0.05932 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.00013 0.00000 -0.07316 0.00000
98 15F-1 0.04979 0.00000 0.00013 0.00000 -0.07316
99 15F+2 0.15384 0.00000 -0.11419 0.00000 -0.12924
100 15F-2 0.00000 -0.11419 0.00000 -0.12924 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 -0.08176 0.00000 0.02059 0.00000
105 16F-1 0.02395 0.00000 -0.08176 0.00000 0.02059
106 16F+2 0.15666 0.00000 -0.11363 0.00000 0.00414
107 16F-2 0.00000 -0.11363 0.00000 0.00414 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.11654 0.00000 0.10907 0.00000
112 17G-1 -0.13904 0.00000 0.11654 0.00000 0.10907
113 17G+2 -0.01787 0.00000 -0.00248 0.00000 0.00280
114 17G-2 0.00000 -0.00248 0.00000 0.00280 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.10576 0.00000 -0.14238 0.00000 -0.10632
118 17G-4 0.00000 0.14238 0.00000 0.10632 0.00000
119 3 H 1S 0.39720 0.00000 0.42998 0.00000 -0.02316
120 2S -0.61435 0.00000 -0.68938 0.00000 0.04779
121 3S -0.92976 0.00000 -0.58608 0.00000 0.79927
122 4S -0.58363 0.00000 -0.49174 0.00000 0.40626
123 5PX 0.00000 -0.15514 0.00000 -0.71792 0.00000
124 5PY 0.53955 0.00000 0.51453 0.00000 -0.04276
125 5PZ 0.33505 0.00000 0.45574 0.00000 -0.51369
126 6PX 0.00000 0.15066 0.00000 0.78458 0.00000
127 6PY -0.34364 0.00000 -0.32726 0.00000 -0.03865
128 6PZ -0.25752 0.00000 -0.38379 0.00000 0.52378
129 7PX 0.00000 -0.16943 0.00000 -0.39884 0.00000
130 7PY 0.83693 0.00000 0.78300 0.00000 -0.32383
131 7PZ 0.31500 0.00000 0.39506 0.00000 -0.46893
132 8D 0 0.01323 0.00000 -0.10071 0.00000 0.14989
133 8D+1 0.00000 0.13039 0.00000 -0.20967 0.00000
134 8D-1 0.09103 0.00000 0.10838 0.00000 -0.10305
135 8D+2 -0.14716 0.00000 -0.08300 0.00000 -0.10266
136 8D-2 0.00000 0.01075 0.00000 -0.04453 0.00000
137 9D 0 0.05404 0.00000 0.08141 0.00000 -0.09466
138 9D+1 0.00000 -0.02874 0.00000 0.07711 0.00000
139 9D-1 -0.11109 0.00000 -0.13683 0.00000 0.08649
140 9D+2 0.17241 0.00000 0.14202 0.00000 0.00352
141 9D-2 0.00000 0.04547 0.00000 -0.02848 0.00000
142 10F 0 0.03824 0.00000 0.05109 0.00000 -0.02270
143 10F+1 0.00000 -0.00627 0.00000 -0.02001 0.00000
144 10F-1 0.01058 0.00000 0.03749 0.00000 0.01318
145 10F+2 0.05943 0.00000 0.04679 0.00000 -0.01852
146 10F-2 0.00000 -0.03694 0.00000 0.02305 0.00000
147 10F+3 0.00000 0.03220 0.00000 -0.05021 0.00000
148 10F-3 0.07025 0.00000 0.08346 0.00000 -0.04079
149 4 H 1S -0.19860 -0.37237 -0.21499 0.02005 0.01158
150 2S 0.30717 0.59702 0.34469 -0.04139 -0.02389
151 3S 0.46488 0.50756 0.29304 -0.69219 -0.39964
152 4S 0.29182 0.42586 0.24587 -0.35183 -0.20313
153 5PX 0.40295 0.34712 0.28998 -0.21155 0.29235
154 5PY -0.15839 0.28998 0.01228 0.29235 -0.54913
155 5PZ -0.16753 -0.39468 -0.22787 0.44487 0.25684
156 6PX -0.31285 -0.20778 -0.20695 0.16716 -0.35647
157 6PY 0.19823 -0.20695 0.03118 -0.35647 0.57877
158 6PZ 0.12876 0.33238 0.19190 -0.45361 -0.26189
159 7PX 0.44880 0.54489 0.41241 -0.34258 0.03248
160 7PY 0.05958 0.41241 0.06867 0.03248 -0.38009
161 7PZ -0.15750 -0.34213 -0.19753 0.40611 0.23447
162 8D 0 -0.00662 0.08722 0.05036 -0.12981 -0.07495
163 8D+1 0.01879 0.11388 -0.00953 -0.12971 0.04617
164 8D-1 0.05848 -0.00953 0.12489 0.04617 -0.18302
165 8D+2 -0.05214 -0.04059 -0.01269 -0.02517 -0.05907
166 8D-2 -0.05486 -0.05956 -0.04059 -0.08813 -0.02517
167 9D 0 -0.02702 -0.07051 -0.04071 0.08198 0.04733
168 9D+1 -0.04782 -0.10981 -0.04681 0.08415 0.00406
169 9D-1 -0.02826 -0.04681 -0.05576 0.00406 0.07946
170 9D+2 0.06928 0.04181 0.06960 0.01386 -0.02048
171 9D-2 0.05954 0.11788 0.04181 -0.00448 0.01386
172 10F 0 -0.01912 -0.04424 -0.02554 0.01966 0.01135
173 10F+1 0.00701 0.02655 0.01895 0.00488 0.01437
174 10F-1 -0.00156 0.01895 0.00467 0.01437 -0.01171
175 10F+2 -0.01230 0.03625 -0.01601 -0.01800 0.01266
176 10F-2 0.04142 0.02586 0.03625 -0.00812 -0.01800
177 10F+3 0.00747 -0.01610 0.02789 0.02510 -0.04348
178 10F-3 -0.03512 -0.07228 -0.04173 0.03532 0.02039
179 5 H 1S -0.19860 0.37237 -0.21499 -0.02005 0.01158
180 2S 0.30717 -0.59702 0.34469 0.04139 -0.02389
181 3S 0.46488 -0.50756 0.29304 0.69219 -0.39964
182 4S 0.29182 -0.42586 0.24587 0.35183 -0.20313
183 5PX -0.40295 0.34712 -0.28998 -0.21155 -0.29235
184 5PY -0.15839 -0.28998 0.01228 -0.29235 -0.54913
185 5PZ -0.16753 0.39468 -0.22787 -0.44487 0.25684
186 6PX 0.31285 -0.20778 0.20695 0.16716 0.35647
187 6PY 0.19823 0.20695 0.03118 0.35647 0.57877
188 6PZ 0.12876 -0.33238 0.19190 0.45361 -0.26189
189 7PX -0.44880 0.54489 -0.41241 -0.34258 -0.03248
190 7PY 0.05958 -0.41241 0.06867 -0.03248 -0.38009
191 7PZ -0.15750 0.34213 -0.19753 -0.40611 0.23447
192 8D 0 -0.00662 -0.08722 0.05036 0.12981 -0.07495
193 8D+1 -0.01879 0.11388 0.00953 -0.12971 -0.04617
194 8D-1 0.05848 0.00953 0.12489 -0.04617 -0.18302
195 8D+2 -0.05214 0.04059 -0.01269 0.02517 -0.05907
196 8D-2 0.05486 -0.05956 0.04059 -0.08813 0.02517
197 9D 0 -0.02702 0.07051 -0.04071 -0.08198 0.04733
198 9D+1 0.04782 -0.10981 0.04681 0.08415 -0.00406
199 9D-1 -0.02826 0.04681 -0.05576 -0.00406 0.07946
200 9D+2 0.06928 -0.04181 0.06960 -0.01386 -0.02048
201 9D-2 -0.05954 0.11788 -0.04181 -0.00448 -0.01386
202 10F 0 -0.01912 0.04424 -0.02554 -0.01966 0.01135
203 10F+1 -0.00701 0.02655 -0.01895 0.00488 -0.01437
204 10F-1 -0.00156 -0.01895 0.00467 -0.01437 -0.01171
205 10F+2 -0.01230 -0.03625 -0.01601 0.01800 0.01266
206 10F-2 -0.04142 0.02586 -0.03625 -0.00812 0.01800
207 10F+3 -0.00747 -0.01610 -0.02789 0.02510 0.04348
208 10F-3 -0.03512 0.07228 -0.04173 -0.03532 0.02039
209 6 H 1S 0.39720 0.00000 -0.42998 0.00000 -0.02316
210 2S -0.61435 0.00000 0.68938 0.00000 0.04779
211 3S -0.92976 0.00000 0.58608 0.00000 0.79927
212 4S -0.58363 0.00000 0.49174 0.00000 0.40626
213 5PX 0.00000 -0.15514 0.00000 0.71792 0.00000
214 5PY -0.53955 0.00000 0.51453 0.00000 0.04276
215 5PZ -0.33505 0.00000 0.45574 0.00000 0.51369
216 6PX 0.00000 0.15066 0.00000 -0.78458 0.00000
217 6PY 0.34364 0.00000 -0.32726 0.00000 0.03865
218 6PZ 0.25752 0.00000 -0.38379 0.00000 -0.52378
219 7PX 0.00000 -0.16943 0.00000 0.39884 0.00000
220 7PY -0.83693 0.00000 0.78300 0.00000 0.32383
221 7PZ -0.31500 0.00000 0.39506 0.00000 0.46893
222 8D 0 0.01323 0.00000 0.10071 0.00000 0.14989
223 8D+1 0.00000 -0.13039 0.00000 -0.20967 0.00000
224 8D-1 0.09103 0.00000 -0.10838 0.00000 -0.10305
225 8D+2 -0.14716 0.00000 0.08300 0.00000 -0.10266
226 8D-2 0.00000 -0.01075 0.00000 -0.04453 0.00000
227 9D 0 0.05404 0.00000 -0.08141 0.00000 -0.09466
228 9D+1 0.00000 0.02874 0.00000 0.07711 0.00000
229 9D-1 -0.11109 0.00000 0.13683 0.00000 0.08649
230 9D+2 0.17241 0.00000 -0.14202 0.00000 0.00352
231 9D-2 0.00000 -0.04547 0.00000 -0.02848 0.00000
232 10F 0 -0.03824 0.00000 0.05109 0.00000 0.02270
233 10F+1 0.00000 -0.00627 0.00000 0.02001 0.00000
234 10F-1 -0.01058 0.00000 0.03749 0.00000 -0.01318
235 10F+2 -0.05943 0.00000 0.04679 0.00000 0.01852
236 10F-2 0.00000 -0.03694 0.00000 -0.02305 0.00000
237 10F+3 0.00000 0.03220 0.00000 0.05021 0.00000
238 10F-3 -0.07025 0.00000 0.08346 0.00000 0.04079
239 7 H 1S -0.19860 -0.37237 0.21499 -0.02005 0.01158
240 2S 0.30717 0.59702 -0.34469 0.04139 -0.02389
241 3S 0.46488 0.50756 -0.29304 0.69219 -0.39964
242 4S 0.29182 0.42586 -0.24587 0.35183 -0.20313
243 5PX 0.40295 0.34712 -0.28998 0.21155 0.29235
244 5PY 0.15839 -0.28998 0.01228 0.29235 0.54913
245 5PZ 0.16753 0.39468 -0.22787 0.44487 -0.25684
246 6PX -0.31285 -0.20778 0.20695 -0.16716 -0.35647
247 6PY -0.19823 0.20695 0.03118 -0.35647 -0.57877
248 6PZ -0.12876 -0.33238 0.19190 -0.45361 0.26189
249 7PX 0.44880 0.54489 -0.41241 0.34258 0.03248
250 7PY -0.05958 -0.41241 0.06867 0.03248 0.38009
251 7PZ 0.15750 0.34213 -0.19753 0.40611 -0.23447
252 8D 0 -0.00662 0.08722 -0.05036 0.12981 -0.07495
253 8D+1 -0.01879 -0.11388 -0.00953 -0.12971 -0.04617
254 8D-1 0.05848 -0.00953 -0.12489 -0.04617 -0.18302
255 8D+2 -0.05214 -0.04059 0.01269 0.02517 -0.05907
256 8D-2 0.05486 0.05956 -0.04059 -0.08813 0.02517
257 9D 0 -0.02702 -0.07051 0.04071 -0.08198 0.04733
258 9D+1 0.04782 0.10981 -0.04681 0.08415 -0.00406
259 9D-1 -0.02826 -0.04681 0.05576 -0.00406 0.07946
260 9D+2 0.06928 0.04181 -0.06960 -0.01386 -0.02048
261 9D-2 -0.05954 -0.11788 0.04181 -0.00448 -0.01386
262 10F 0 0.01912 0.04424 -0.02554 0.01966 -0.01135
263 10F+1 0.00701 0.02655 -0.01895 -0.00488 0.01437
264 10F-1 0.00156 -0.01895 0.00467 0.01437 0.01171
265 10F+2 0.01230 -0.03625 -0.01601 -0.01800 -0.01266
266 10F-2 0.04142 0.02586 -0.03625 0.00812 -0.01800
267 10F+3 0.00747 -0.01610 -0.02789 -0.02510 -0.04348
268 10F-3 0.03512 0.07228 -0.04173 0.03532 -0.02039
269 8 H 1S -0.19860 0.37237 0.21499 0.02005 0.01158
270 2S 0.30717 -0.59702 -0.34469 -0.04139 -0.02389
271 3S 0.46488 -0.50756 -0.29304 -0.69219 -0.39964
272 4S 0.29182 -0.42586 -0.24587 -0.35183 -0.20313
273 5PX -0.40295 0.34712 0.28998 0.21155 -0.29235
274 5PY 0.15839 0.28998 0.01228 -0.29235 0.54913
275 5PZ 0.16753 -0.39468 -0.22787 -0.44487 -0.25684
276 6PX 0.31285 -0.20778 -0.20695 -0.16716 0.35647
277 6PY -0.19823 -0.20695 0.03118 0.35647 -0.57877
278 6PZ -0.12876 0.33238 0.19190 0.45361 0.26189
279 7PX -0.44880 0.54489 0.41241 0.34258 -0.03248
280 7PY -0.05958 0.41241 0.06867 -0.03248 0.38009
281 7PZ 0.15750 -0.34213 -0.19753 -0.40611 -0.23447
282 8D 0 -0.00662 -0.08722 -0.05036 -0.12981 -0.07495
283 8D+1 0.01879 -0.11388 0.00953 -0.12971 0.04617
284 8D-1 0.05848 0.00953 -0.12489 0.04617 -0.18302
285 8D+2 -0.05214 0.04059 0.01269 -0.02517 -0.05907
286 8D-2 -0.05486 0.05956 0.04059 -0.08813 -0.02517
287 9D 0 -0.02702 0.07051 0.04071 0.08198 0.04733
288 9D+1 -0.04782 0.10981 0.04681 0.08415 0.00406
289 9D-1 -0.02826 0.04681 0.05576 0.00406 0.07946
290 9D+2 0.06928 -0.04181 -0.06960 0.01386 -0.02048
291 9D-2 0.05954 -0.11788 -0.04181 -0.00448 0.01386
292 10F 0 0.01912 -0.04424 -0.02554 -0.01966 -0.01135
293 10F+1 -0.00701 0.02655 0.01895 -0.00488 -0.01437
294 10F-1 0.00156 0.01895 0.00467 -0.01437 0.01171
295 10F+2 0.01230 0.03625 -0.01601 0.01800 -0.01266
296 10F-2 -0.04142 0.02586 0.03625 0.00812 0.01800
297 10F+3 -0.00747 -0.01610 0.02789 -0.02510 0.04348
298 10F-3 0.03512 -0.07228 -0.04173 -0.03532 -0.02039
251 252 253 254 255
(EU)--V (EU)--V (A1G)--V (A2U)--V (A1U)--V
Eigenvalues -- 8.22174 8.22174 8.22647 8.23276 8.30680
1 1 Si 1S 0.00000 0.00000 -0.02505 0.02504 0.00000
2 2S 0.00000 0.00000 -0.29667 0.31742 0.00000
3 3S 0.00000 0.00000 -0.38928 0.39914 0.00000
4 4S 0.00000 0.00000 -0.39377 0.11076 0.00000
5 5S 0.00000 0.00000 0.41404 0.45127 0.00000
6 6S 0.00000 0.00000 0.04403 0.48686 0.00000
7 7PX 0.04210 0.00000 0.00000 0.00000 0.00000
8 7PY 0.00000 0.04210 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 -0.37959 -0.45873 0.00000
10 8PX 0.04268 0.00000 0.00000 0.00000 0.00000
11 8PY 0.00000 0.04268 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 -0.43021 -0.54476 0.00000
13 9PX -0.08558 0.00000 0.00000 0.00000 0.00000
14 9PY 0.00000 -0.08558 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.73637 0.67902 0.00000
16 10PX -0.43766 0.00000 0.00000 0.00000 0.00000
17 10PY 0.00000 -0.43766 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 -0.28374 0.76760 0.00000
19 11PX -0.15681 0.00000 0.00000 0.00000 0.00000
20 11PY 0.00000 -0.15681 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 -0.08672 0.12238 0.00000
22 12D 0 0.00000 0.00000 -0.00547 -0.50254 0.00000
23 12D+1 0.01115 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.01115 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.62897 0.00000 0.00000 0.00000
26 12D-2 0.62897 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00154 -0.34435 0.00000
28 13D+1 -0.15056 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 -0.15056 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.02547 0.00000 0.00000 0.00000
31 13D-2 0.02547 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 -0.04100 0.13731 0.00000
33 14D+1 -0.00975 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 -0.00975 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.01759 0.00000 0.00000 0.00000
36 14D-2 0.01759 0.00000 0.00000 0.00000 0.00000
37 15F 0 0.00000 0.00000 -0.14689 0.11239 0.00000
38 15F+1 0.14534 0.00000 0.00000 0.00000 0.00000
39 15F-1 0.00000 0.14534 0.00000 0.00000 0.00000
40 15F+2 0.00000 -0.01732 0.00000 0.00000 0.00000
41 15F-2 -0.01732 0.00000 0.00000 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.09462
43 15F-3 0.00000 0.00000 -0.12164 -0.22080 0.00000
44 16F 0 0.00000 0.00000 -0.11348 -0.01388 0.00000
45 16F+1 -0.11119 0.00000 0.00000 0.00000 0.00000
46 16F-1 0.00000 -0.11119 0.00000 0.00000 0.00000
47 16F+2 0.00000 0.06704 0.00000 0.00000 0.00000
48 16F-2 0.06704 0.00000 0.00000 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 -0.16782
50 16F-3 0.00000 0.00000 -0.01509 0.13731 0.00000
51 17G 0 0.00000 0.00000 -0.08904 -0.27599 0.00000
52 17G+1 0.04227 0.00000 0.00000 0.00000 0.00000
53 17G-1 0.00000 0.04227 0.00000 0.00000 0.00000
54 17G+2 0.00000 0.09583 0.00000 0.00000 0.00000
55 17G-2 0.09583 0.00000 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 -0.12908
57 17G-3 0.00000 0.00000 -0.19589 -0.08901 0.00000
58 17G+4 0.00000 -0.01150 0.00000 0.00000 0.00000
59 17G-4 0.01150 0.00000 0.00000 0.00000 0.00000
60 2 Si 1S 0.00000 0.00000 -0.02505 -0.02504 0.00000
61 2S 0.00000 0.00000 -0.29667 -0.31742 0.00000
62 3S 0.00000 0.00000 -0.38928 -0.39914 0.00000
63 4S 0.00000 0.00000 -0.39377 -0.11076 0.00000
64 5S 0.00000 0.00000 0.41404 -0.45127 0.00000
65 6S 0.00000 0.00000 0.04403 -0.48686 0.00000
66 7PX 0.04210 0.00000 0.00000 0.00000 0.00000
67 7PY 0.00000 0.04210 0.00000 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.37959 -0.45873 0.00000
69 8PX 0.04268 0.00000 0.00000 0.00000 0.00000
70 8PY 0.00000 0.04268 0.00000 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.43021 -0.54476 0.00000
72 9PX -0.08558 0.00000 0.00000 0.00000 0.00000
73 9PY 0.00000 -0.08558 0.00000 0.00000 0.00000
74 9PZ 0.00000 0.00000 -0.73637 0.67902 0.00000
75 10PX -0.43766 0.00000 0.00000 0.00000 0.00000
76 10PY 0.00000 -0.43766 0.00000 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.28374 0.76760 0.00000
78 11PX -0.15681 0.00000 0.00000 0.00000 0.00000
79 11PY 0.00000 -0.15681 0.00000 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.08672 0.12238 0.00000
81 12D 0 0.00000 0.00000 -0.00547 0.50254 0.00000
82 12D+1 -0.01115 0.00000 0.00000 0.00000 0.00000
83 12D-1 0.00000 -0.01115 0.00000 0.00000 0.00000
84 12D+2 0.00000 -0.62897 0.00000 0.00000 0.00000
85 12D-2 -0.62897 0.00000 0.00000 0.00000 0.00000
86 13D 0 0.00000 0.00000 0.00154 0.34435 0.00000
87 13D+1 0.15056 0.00000 0.00000 0.00000 0.00000
88 13D-1 0.00000 0.15056 0.00000 0.00000 0.00000
89 13D+2 0.00000 -0.02547 0.00000 0.00000 0.00000
90 13D-2 -0.02547 0.00000 0.00000 0.00000 0.00000
91 14D 0 0.00000 0.00000 -0.04100 -0.13731 0.00000
92 14D+1 0.00975 0.00000 0.00000 0.00000 0.00000
93 14D-1 0.00000 0.00975 0.00000 0.00000 0.00000
94 14D+2 0.00000 -0.01759 0.00000 0.00000 0.00000
95 14D-2 -0.01759 0.00000 0.00000 0.00000 0.00000
96 15F 0 0.00000 0.00000 0.14689 0.11239 0.00000
97 15F+1 0.14534 0.00000 0.00000 0.00000 0.00000
98 15F-1 0.00000 0.14534 0.00000 0.00000 0.00000
99 15F+2 0.00000 -0.01732 0.00000 0.00000 0.00000
100 15F-2 -0.01732 0.00000 0.00000 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.09462
102 15F-3 0.00000 0.00000 0.12164 -0.22080 0.00000
103 16F 0 0.00000 0.00000 0.11348 -0.01388 0.00000
104 16F+1 -0.11119 0.00000 0.00000 0.00000 0.00000
105 16F-1 0.00000 -0.11119 0.00000 0.00000 0.00000
106 16F+2 0.00000 0.06704 0.00000 0.00000 0.00000
107 16F-2 0.06704 0.00000 0.00000 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 -0.16782
109 16F-3 0.00000 0.00000 0.01509 0.13731 0.00000
110 17G 0 0.00000 0.00000 -0.08904 0.27599 0.00000
111 17G+1 -0.04227 0.00000 0.00000 0.00000 0.00000
112 17G-1 0.00000 -0.04227 0.00000 0.00000 0.00000
113 17G+2 0.00000 -0.09583 0.00000 0.00000 0.00000
114 17G-2 -0.09583 0.00000 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.12908
116 17G-3 0.00000 0.00000 -0.19589 0.08901 0.00000
117 17G+4 0.00000 0.01150 0.00000 0.00000 0.00000
118 17G-4 -0.01150 0.00000 0.00000 0.00000 0.00000
119 3 H 1S 0.00000 0.10073 0.11855 -0.07634 0.00000
120 2S 0.00000 -0.19906 -0.25252 0.14299 0.00000
121 3S 0.00000 0.67859 -0.04227 -0.61135 0.00000
122 4S 0.00000 0.25563 -0.01288 -0.24891 0.00000
123 5PX -0.64361 0.00000 0.00000 0.00000 0.17104
124 5PY 0.00000 0.26328 -0.24368 0.04226 0.00000
125 5PZ 0.00000 -0.49838 0.60685 0.64114 0.00000
126 6PX 0.70254 0.00000 0.00000 0.00000 -0.20793
127 6PY 0.00000 -0.29838 0.33924 -0.01732 0.00000
128 6PZ 0.00000 0.55274 -0.64008 -0.71151 0.00000
129 7PX -0.43802 0.00000 0.00000 0.00000 0.06935
130 7PY 0.00000 -0.01149 -0.08078 0.24551 0.00000
131 7PZ 0.00000 -0.38747 0.29122 0.39478 0.00000
132 8D 0 0.00000 0.24913 0.07812 -0.02858 0.00000
133 8D+1 -0.07540 0.00000 0.00000 0.00000 0.43359
134 8D-1 0.00000 -0.08123 0.09101 0.09158 0.00000
135 8D+2 0.00000 -0.22140 -0.03536 0.08452 0.00000
136 8D-2 -0.05723 0.00000 0.00000 0.00000 -0.22997
137 9D 0 0.00000 -0.16591 0.01561 0.07254 0.00000
138 9D+1 0.02321 0.00000 0.00000 0.00000 -0.21938
139 9D-1 0.00000 0.01283 -0.01566 0.01718 0.00000
140 9D+2 0.00000 0.06730 0.07246 0.00636 0.00000
141 9D-2 0.02719 0.00000 0.00000 0.00000 0.18636
142 10F 0 0.00000 -0.00707 -0.00057 0.05203 0.00000
143 10F+1 -0.00950 0.00000 0.00000 0.00000 0.03004
144 10F-1 0.00000 0.07343 -0.06628 -0.07337 0.00000
145 10F+2 0.00000 -0.02805 0.00452 0.05995 0.00000
146 10F-2 0.02073 0.00000 0.00000 0.00000 -0.02138
147 10F+3 0.00355 0.00000 0.00000 0.00000 0.06752
148 10F-3 0.00000 0.02303 -0.03611 0.02187 0.00000
149 4 H 1S -0.08723 -0.05036 0.11855 -0.07634 0.00000
150 2S 0.17239 0.09953 -0.25252 0.14299 0.00000
151 3S -0.58768 -0.33930 -0.04227 -0.61135 0.00000
152 4S -0.22138 -0.12782 -0.01288 -0.24891 0.00000
153 5PX 0.03656 0.39270 0.21103 -0.03660 -0.08552
154 5PY 0.39270 -0.41689 0.12184 -0.02113 0.14813
155 5PZ 0.43161 0.24919 0.60685 0.64114 0.00000
156 6PX -0.04815 -0.43341 -0.29379 0.01500 0.10396
157 6PY -0.43341 0.45231 -0.16962 0.00866 -0.18007
158 6PZ -0.47869 -0.27637 -0.64008 -0.71151 0.00000
159 7PX -0.11813 0.18469 0.06995 -0.21262 -0.03468
160 7PY 0.18469 -0.33139 0.04039 -0.12276 0.06006
161 7PZ 0.33556 0.19373 0.29122 0.39478 0.00000
162 8D 0 -0.21575 -0.12456 0.07812 -0.02858 0.00000
163 8D+1 -0.07977 -0.00252 -0.07882 -0.07931 -0.21679
164 8D-1 -0.00252 -0.07685 -0.04551 -0.04579 0.37550
165 8D+2 -0.07109 -0.09827 0.01768 -0.04226 -0.19916
166 8D-2 -0.18035 -0.07109 0.03062 -0.07319 0.11499
167 9D 0 0.14368 0.08295 0.01561 0.07254 0.00000
168 9D+1 0.01543 -0.00449 0.01356 -0.01488 0.10969
169 9D-1 -0.00449 0.02062 0.00783 -0.00859 -0.18999
170 9D+2 0.01737 0.03722 -0.03623 -0.00318 0.16139
171 9D-2 0.05728 0.01737 -0.06275 -0.00551 -0.09318
172 10F 0 0.00612 0.00353 -0.00057 0.05203 0.00000
173 10F+1 0.05270 0.03591 0.05740 0.06354 -0.01502
174 10F-1 0.03591 0.01124 0.03314 0.03669 0.02601
175 10F+2 -0.02112 0.00854 -0.00226 -0.02997 -0.01851
176 10F-2 -0.01585 -0.02112 -0.00392 -0.05192 0.01069
177 10F+3 -0.00177 0.00307 0.00000 0.00000 0.06752
178 10F-3 -0.01995 -0.01152 -0.03611 0.02187 0.00000
179 5 H 1S 0.08723 -0.05036 0.11855 -0.07634 0.00000
180 2S -0.17239 0.09953 -0.25252 0.14299 0.00000
181 3S 0.58768 -0.33930 -0.04227 -0.61135 0.00000
182 4S 0.22138 -0.12782 -0.01288 -0.24891 0.00000
183 5PX 0.03656 -0.39270 -0.21103 0.03660 -0.08552
184 5PY -0.39270 -0.41689 0.12184 -0.02113 -0.14813
185 5PZ -0.43161 0.24919 0.60685 0.64114 0.00000
186 6PX -0.04815 0.43341 0.29379 -0.01500 0.10396
187 6PY 0.43341 0.45231 -0.16962 0.00866 0.18007
188 6PZ 0.47869 -0.27637 -0.64008 -0.71151 0.00000
189 7PX -0.11813 -0.18469 -0.06995 0.21262 -0.03468
190 7PY -0.18469 -0.33139 0.04039 -0.12276 -0.06006
191 7PZ -0.33556 0.19373 0.29122 0.39478 0.00000
192 8D 0 0.21575 -0.12456 0.07812 -0.02858 0.00000
193 8D+1 -0.07977 0.00252 0.07882 0.07931 -0.21679
194 8D-1 0.00252 -0.07685 -0.04551 -0.04579 -0.37550
195 8D+2 0.07109 -0.09827 0.01768 -0.04226 0.19916
196 8D-2 -0.18035 0.07109 -0.03062 0.07319 0.11499
197 9D 0 -0.14368 0.08295 0.01561 0.07254 0.00000
198 9D+1 0.01543 0.00449 -0.01356 0.01488 0.10969
199 9D-1 0.00449 0.02062 0.00783 -0.00859 0.18999
200 9D+2 -0.01737 0.03722 -0.03623 -0.00318 -0.16139
201 9D-2 0.05728 -0.01737 0.06275 0.00551 -0.09318
202 10F 0 -0.00612 0.00353 -0.00057 0.05203 0.00000
203 10F+1 0.05270 -0.03591 -0.05740 -0.06354 -0.01502
204 10F-1 -0.03591 0.01124 0.03314 0.03669 -0.02601
205 10F+2 0.02112 0.00854 -0.00226 -0.02997 0.01851
206 10F-2 -0.01585 0.02112 0.00392 0.05192 0.01069
207 10F+3 -0.00177 -0.00307 0.00000 0.00000 0.06752
208 10F-3 0.01995 -0.01152 -0.03611 0.02187 0.00000
209 6 H 1S 0.00000 -0.10073 0.11855 0.07634 0.00000
210 2S 0.00000 0.19906 -0.25252 -0.14299 0.00000
211 3S 0.00000 -0.67859 -0.04227 0.61135 0.00000
212 4S 0.00000 -0.25563 -0.01288 0.24891 0.00000
213 5PX -0.64361 0.00000 0.00000 0.00000 0.17104
214 5PY 0.00000 0.26328 0.24368 0.04226 0.00000
215 5PZ 0.00000 -0.49838 -0.60685 0.64114 0.00000
216 6PX 0.70254 0.00000 0.00000 0.00000 -0.20793
217 6PY 0.00000 -0.29838 -0.33924 -0.01732 0.00000
218 6PZ 0.00000 0.55274 0.64008 -0.71151 0.00000
219 7PX -0.43802 0.00000 0.00000 0.00000 0.06935
220 7PY 0.00000 -0.01149 0.08078 0.24551 0.00000
221 7PZ 0.00000 -0.38747 -0.29122 0.39478 0.00000
222 8D 0 0.00000 -0.24913 0.07812 0.02858 0.00000
223 8D+1 0.07540 0.00000 0.00000 0.00000 -0.43359
224 8D-1 0.00000 0.08123 0.09101 -0.09158 0.00000
225 8D+2 0.00000 0.22140 -0.03536 -0.08452 0.00000
226 8D-2 0.05723 0.00000 0.00000 0.00000 0.22997
227 9D 0 0.00000 0.16591 0.01561 -0.07254 0.00000
228 9D+1 -0.02321 0.00000 0.00000 0.00000 0.21938
229 9D-1 0.00000 -0.01283 -0.01566 -0.01718 0.00000
230 9D+2 0.00000 -0.06730 0.07246 -0.00636 0.00000
231 9D-2 -0.02719 0.00000 0.00000 0.00000 -0.18636
232 10F 0 0.00000 -0.00707 0.00057 0.05203 0.00000
233 10F+1 -0.00950 0.00000 0.00000 0.00000 0.03004
234 10F-1 0.00000 0.07343 0.06628 -0.07337 0.00000
235 10F+2 0.00000 -0.02805 -0.00452 0.05995 0.00000
236 10F-2 0.02073 0.00000 0.00000 0.00000 -0.02138
237 10F+3 0.00355 0.00000 0.00000 0.00000 0.06752
238 10F-3 0.00000 0.02303 0.03611 0.02187 0.00000
239 7 H 1S -0.08723 0.05036 0.11855 0.07634 0.00000
240 2S 0.17239 -0.09953 -0.25252 -0.14299 0.00000
241 3S -0.58768 0.33930 -0.04227 0.61135 0.00000
242 4S -0.22138 0.12782 -0.01288 0.24891 0.00000
243 5PX 0.03656 -0.39270 0.21103 0.03660 -0.08552
244 5PY -0.39270 -0.41689 -0.12184 -0.02113 -0.14813
245 5PZ -0.43161 0.24919 -0.60685 0.64114 0.00000
246 6PX -0.04815 0.43341 -0.29379 -0.01500 0.10396
247 6PY 0.43341 0.45231 0.16962 0.00866 0.18007
248 6PZ 0.47869 -0.27637 0.64008 -0.71151 0.00000
249 7PX -0.11813 -0.18469 0.06995 0.21262 -0.03468
250 7PY -0.18469 -0.33139 -0.04039 -0.12276 -0.06006
251 7PZ -0.33556 0.19373 -0.29122 0.39478 0.00000
252 8D 0 -0.21575 0.12456 0.07812 0.02858 0.00000
253 8D+1 0.07977 -0.00252 0.07882 -0.07931 0.21679
254 8D-1 -0.00252 0.07685 -0.04551 0.04579 0.37550
255 8D+2 -0.07109 0.09827 0.01768 0.04226 -0.19916
256 8D-2 0.18035 -0.07109 -0.03062 -0.07319 -0.11499
257 9D 0 0.14368 -0.08295 0.01561 -0.07254 0.00000
258 9D+1 -0.01543 -0.00449 -0.01356 -0.01488 -0.10969
259 9D-1 -0.00449 -0.02062 0.00783 0.00859 -0.18999
260 9D+2 0.01737 -0.03722 -0.03623 0.00318 0.16139
261 9D-2 -0.05728 0.01737 0.06275 -0.00551 0.09318
262 10F 0 -0.00612 0.00353 0.00057 0.05203 0.00000
263 10F+1 0.05270 -0.03591 0.05740 -0.06354 -0.01502
264 10F-1 -0.03591 0.01124 -0.03314 0.03669 -0.02601
265 10F+2 0.02112 0.00854 0.00226 -0.02997 0.01851
266 10F-2 -0.01585 0.02112 -0.00392 0.05192 0.01069
267 10F+3 -0.00177 -0.00307 0.00000 0.00000 0.06752
268 10F-3 0.01995 -0.01152 0.03611 0.02187 0.00000
269 8 H 1S 0.08723 0.05036 0.11855 0.07634 0.00000
270 2S -0.17239 -0.09953 -0.25252 -0.14299 0.00000
271 3S 0.58768 0.33930 -0.04227 0.61135 0.00000
272 4S 0.22138 0.12782 -0.01288 0.24891 0.00000
273 5PX 0.03656 0.39270 -0.21103 -0.03660 -0.08552
274 5PY 0.39270 -0.41689 -0.12184 -0.02113 0.14813
275 5PZ 0.43161 0.24919 -0.60685 0.64114 0.00000
276 6PX -0.04815 -0.43341 0.29379 0.01500 0.10396
277 6PY -0.43341 0.45231 0.16962 0.00866 -0.18007
278 6PZ -0.47869 -0.27637 0.64008 -0.71151 0.00000
279 7PX -0.11813 0.18469 -0.06995 -0.21262 -0.03468
280 7PY 0.18469 -0.33139 -0.04039 -0.12276 0.06006
281 7PZ 0.33556 0.19373 -0.29122 0.39478 0.00000
282 8D 0 0.21575 0.12456 0.07812 0.02858 0.00000
283 8D+1 0.07977 0.00252 -0.07882 0.07931 0.21679
284 8D-1 0.00252 0.07685 -0.04551 0.04579 -0.37550
285 8D+2 0.07109 0.09827 0.01768 0.04226 0.19916
286 8D-2 0.18035 0.07109 0.03062 0.07319 -0.11499
287 9D 0 -0.14368 -0.08295 0.01561 -0.07254 0.00000
288 9D+1 -0.01543 0.00449 0.01356 0.01488 -0.10969
289 9D-1 0.00449 -0.02062 0.00783 0.00859 0.18999
290 9D+2 -0.01737 -0.03722 -0.03623 0.00318 -0.16139
291 9D-2 -0.05728 -0.01737 -0.06275 0.00551 0.09318
292 10F 0 0.00612 0.00353 0.00057 0.05203 0.00000
293 10F+1 0.05270 0.03591 -0.05740 0.06354 -0.01502
294 10F-1 0.03591 0.01124 -0.03314 0.03669 0.02601
295 10F+2 -0.02112 0.00854 0.00226 -0.02997 -0.01851
296 10F-2 -0.01585 -0.02112 0.00392 -0.05192 0.01069
297 10F+3 -0.00177 0.00307 0.00000 0.00000 0.06752
298 10F-3 -0.01995 -0.01152 0.03611 0.02187 0.00000
256 257 258 259 260
(EG)--V (EG)--V (A2G)--V (EU)--V (EU)--V
Eigenvalues -- 8.33811 8.33811 8.35498 8.37486 8.37486
1 1 Si 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 -0.39197 0.00000 -0.34818 0.00000
8 7PY -0.39197 0.00000 0.00000 0.00000 0.34818
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.46361 0.00000 -0.41237 0.00000
11 8PY -0.46361 0.00000 0.00000 0.00000 0.41237
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.68586 0.00000 0.57520 0.00000
14 9PY 0.68586 0.00000 0.00000 0.00000 -0.57520
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 0.28907 0.00000 0.87200 0.00000
17 10PY 0.28907 0.00000 0.00000 0.00000 -0.87200
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 -0.04127 0.00000 0.19976 0.00000
20 11PY -0.04127 0.00000 0.00000 0.00000 -0.19976
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 0.35192 0.00000 0.21642 0.00000
24 12D-1 0.35192 0.00000 0.00000 0.00000 -0.21642
25 12D+2 -0.14924 0.00000 0.00000 0.00000 0.64026
26 12D-2 0.00000 -0.14924 0.00000 -0.64026 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.14917 0.00000 0.18794 0.00000
29 13D-1 0.14917 0.00000 0.00000 0.00000 -0.18794
30 13D+2 -0.24822 0.00000 0.00000 0.00000 0.23671
31 13D-2 0.00000 -0.24822 0.00000 -0.23671 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 -0.05512 0.00000 -0.04909 0.00000
34 14D-1 -0.05512 0.00000 0.00000 0.00000 0.04909
35 14D+2 0.08620 0.00000 0.00000 0.00000 -0.06980
36 14D-2 0.00000 0.08620 0.00000 0.06980 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 -0.10176 0.00000 -0.07818 0.00000
39 15F-1 -0.10176 0.00000 0.00000 0.00000 0.07818
40 15F+2 -0.12182 0.00000 0.00000 0.00000 0.12812
41 15F-2 0.00000 -0.12182 0.00000 -0.12812 0.00000
42 15F+3 0.00000 0.00000 0.18813 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 -0.20897 0.00000 -0.10125 0.00000
46 16F-1 -0.20897 0.00000 0.00000 0.00000 0.10125
47 16F+2 0.18478 0.00000 0.00000 0.00000 -0.12833
48 16F-2 0.00000 0.18478 0.00000 0.12833 0.00000
49 16F+3 0.00000 0.00000 -0.07227 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 0.01196 0.00000 -0.00715 0.00000
53 17G-1 0.01196 0.00000 0.00000 0.00000 0.00715
54 17G+2 0.12898 0.00000 0.00000 0.00000 -0.07883
55 17G-2 0.00000 0.12898 0.00000 0.07883 0.00000
56 17G+3 0.00000 0.00000 -0.04363 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.27650 0.00000 0.00000 0.00000 -0.28456
59 17G-4 0.00000 -0.27650 0.00000 -0.28456 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00000
61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
62 3S 0.00000 0.00000 0.00000 0.00000 0.00000
63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
64 5S 0.00000 0.00000 0.00000 0.00000 0.00000
65 6S 0.00000 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 0.39197 0.00000 -0.34818 0.00000
67 7PY 0.39197 0.00000 0.00000 0.00000 0.34818
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 0.46361 0.00000 -0.41237 0.00000
70 8PY 0.46361 0.00000 0.00000 0.00000 0.41237
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 -0.68586 0.00000 0.57520 0.00000
73 9PY -0.68586 0.00000 0.00000 0.00000 -0.57520
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 -0.28907 0.00000 0.87200 0.00000
76 10PY -0.28907 0.00000 0.00000 0.00000 -0.87200
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 0.04127 0.00000 0.19976 0.00000
79 11PY 0.04127 0.00000 0.00000 0.00000 -0.19976
80 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.35192 0.00000 -0.21642 0.00000
83 12D-1 0.35192 0.00000 0.00000 0.00000 0.21642
84 12D+2 -0.14924 0.00000 0.00000 0.00000 -0.64026
85 12D-2 0.00000 -0.14924 0.00000 0.64026 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.14917 0.00000 -0.18794 0.00000
88 13D-1 0.14917 0.00000 0.00000 0.00000 0.18794
89 13D+2 -0.24822 0.00000 0.00000 0.00000 -0.23671
90 13D-2 0.00000 -0.24822 0.00000 0.23671 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 -0.05512 0.00000 0.04909 0.00000
93 14D-1 -0.05512 0.00000 0.00000 0.00000 -0.04909
94 14D+2 0.08620 0.00000 0.00000 0.00000 0.06980
95 14D-2 0.00000 0.08620 0.00000 -0.06980 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.10176 0.00000 -0.07818 0.00000
98 15F-1 0.10176 0.00000 0.00000 0.00000 0.07818
99 15F+2 0.12182 0.00000 0.00000 0.00000 0.12812
100 15F-2 0.00000 0.12182 0.00000 -0.12812 0.00000
101 15F+3 0.00000 0.00000 -0.18813 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.20897 0.00000 -0.10125 0.00000
105 16F-1 0.20897 0.00000 0.00000 0.00000 0.10125
106 16F+2 -0.18478 0.00000 0.00000 0.00000 -0.12833
107 16F-2 0.00000 -0.18478 0.00000 0.12833 0.00000
108 16F+3 0.00000 0.00000 0.07227 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.01196 0.00000 0.00715 0.00000
112 17G-1 0.01196 0.00000 0.00000 0.00000 -0.00715
113 17G+2 0.12898 0.00000 0.00000 0.00000 0.07883
114 17G-2 0.00000 0.12898 0.00000 -0.07883 0.00000
115 17G+3 0.00000 0.00000 -0.04363 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.27650 0.00000 0.00000 0.00000 0.28456
118 17G-4 0.00000 -0.27650 0.00000 0.28456 0.00000
119 3 H 1S 0.01376 0.00000 0.00000 0.00000 0.08796
120 2S -0.06205 0.00000 0.00000 0.00000 -0.13632
121 3S -0.59116 0.00000 0.00000 0.00000 1.11234
122 4S -0.19201 0.00000 0.00000 0.00000 0.43031
123 5PX 0.00000 0.45451 -0.08769 0.67553 0.00000
124 5PY 0.46479 0.00000 0.00000 0.00000 -0.31405
125 5PZ -0.56698 0.00000 0.00000 0.00000 0.21362
126 6PX 0.00000 -0.53838 0.08674 -0.80452 0.00000
127 6PY -0.44177 0.00000 0.00000 0.00000 0.28066
128 6PZ 0.69624 0.00000 0.00000 0.00000 -0.28898
129 7PX 0.00000 0.14861 0.01411 0.37682 0.00000
130 7PY 0.44123 0.00000 0.00000 0.00000 -0.45972
131 7PZ -0.12454 0.00000 0.00000 0.00000 -0.13049
132 8D 0 0.04737 0.00000 0.00000 0.00000 -0.23120
133 8D+1 0.00000 -0.03463 0.36771 0.08955 0.00000
134 8D-1 -0.17984 0.00000 0.00000 0.00000 0.19991
135 8D+2 -0.21784 0.00000 0.00000 0.00000 0.27888
136 8D-2 0.00000 0.11212 -0.34611 0.08097 0.00000
137 9D 0 -0.11933 0.00000 0.00000 0.00000 0.19832
138 9D+1 0.00000 0.06659 -0.20526 0.00148 0.00000
139 9D-1 -0.03621 0.00000 0.00000 0.00000 -0.01397
140 9D+2 0.12093 0.00000 0.00000 0.00000 -0.18223
141 9D-2 0.00000 0.05912 0.20313 0.06787 0.00000
142 10F 0 0.04640 0.00000 0.00000 0.00000 -0.06431
143 10F+1 0.00000 -0.02033 0.02404 -0.02323 0.00000
144 10F-1 0.13038 0.00000 0.00000 0.00000 -0.09401
145 10F+2 -0.04336 0.00000 0.00000 0.00000 0.02175
146 10F-2 0.00000 -0.05291 -0.00574 -0.04810 0.00000
147 10F+3 0.00000 0.09869 0.04241 0.09373 0.00000
148 10F-3 0.04838 0.00000 0.00000 0.00000 -0.01386
149 4 H 1S -0.00688 -0.01191 0.00000 0.07618 -0.04398
150 2S 0.03103 0.05374 0.00000 -0.11806 0.06816
151 3S 0.29558 0.51196 0.00000 0.96331 -0.55617
152 4S 0.09601 0.16629 0.00000 0.37266 -0.21515
153 5PX 0.00445 0.46222 0.04385 0.40442 0.15653
154 5PY 0.45708 0.00445 -0.07594 -0.15653 -0.58516
155 5PZ 0.28349 0.49102 0.00000 0.18500 -0.10681
156 6PX 0.04183 -0.46593 -0.04337 -0.41162 -0.22684
157 6PY -0.51423 0.04183 0.07512 0.22684 0.67355
158 6PZ -0.34812 -0.60296 0.00000 -0.25026 0.14449
159 7PX 0.12671 0.36808 -0.00706 0.43899 -0.03589
160 7PY 0.22177 0.12671 0.01222 0.03589 -0.39755
161 7PZ 0.06227 0.10786 0.00000 -0.11300 0.06524
162 8D 0 -0.02368 -0.04102 0.00000 -0.20023 0.11560
163 8D+1 -0.06288 -0.14354 -0.18386 -0.12754 0.12534
164 8D-1 -0.07093 -0.06288 0.31845 -0.12534 -0.01718
165 8D+2 0.02963 -0.14288 -0.29974 -0.15582 0.00899
166 8D-2 -0.14288 -0.13535 0.17305 -0.18892 0.15582
167 9D 0 0.05966 0.10334 0.00000 0.17175 -0.09916
168 9D+1 -0.04451 -0.01051 0.10263 0.01085 -0.00541
169 9D-1 0.04089 -0.04451 -0.17776 0.00541 -0.00460
170 9D+2 0.07457 0.02677 0.17592 0.04952 -0.09646
171 9D-2 0.02677 0.10548 -0.10157 0.15364 -0.04952
172 10F 0 -0.02320 -0.04018 0.00000 -0.05570 0.03216
173 10F+1 0.06526 0.09270 -0.01202 0.06470 -0.05077
174 10F-1 0.01735 0.06526 0.02082 0.05077 -0.00608
175 10F+2 -0.05052 0.00413 -0.00497 0.01141 0.04151
176 10F-2 0.00413 -0.04575 0.00287 -0.02833 -0.01141
177 10F+3 0.08547 -0.04935 0.04241 -0.04686 -0.08117
178 10F-3 -0.02419 -0.04190 0.00000 -0.01201 0.00693
179 5 H 1S -0.00688 0.01191 0.00000 -0.07618 -0.04398
180 2S 0.03103 -0.05374 0.00000 0.11806 0.06816
181 3S 0.29558 -0.51196 0.00000 -0.96331 -0.55617
182 4S 0.09601 -0.16629 0.00000 -0.37266 -0.21515
183 5PX -0.00445 0.46222 0.04385 0.40442 -0.15653
184 5PY 0.45708 -0.00445 0.07594 0.15653 -0.58516
185 5PZ 0.28349 -0.49102 0.00000 -0.18500 -0.10681
186 6PX -0.04183 -0.46593 -0.04337 -0.41162 0.22684
187 6PY -0.51423 -0.04183 -0.07512 -0.22684 0.67355
188 6PZ -0.34812 0.60296 0.00000 0.25026 0.14449
189 7PX -0.12671 0.36808 -0.00706 0.43899 0.03589
190 7PY 0.22177 -0.12671 -0.01222 -0.03589 -0.39755
191 7PZ 0.06227 -0.10786 0.00000 0.11300 0.06524
192 8D 0 -0.02368 0.04102 0.00000 0.20023 0.11560
193 8D+1 0.06288 -0.14354 -0.18386 -0.12754 -0.12534
194 8D-1 -0.07093 0.06288 -0.31845 0.12534 -0.01718
195 8D+2 0.02963 0.14288 0.29974 0.15582 0.00899
196 8D-2 0.14288 -0.13535 0.17305 -0.18892 -0.15582
197 9D 0 0.05966 -0.10334 0.00000 -0.17175 -0.09916
198 9D+1 0.04451 -0.01051 0.10263 0.01085 0.00541
199 9D-1 0.04089 0.04451 0.17776 -0.00541 -0.00460
200 9D+2 0.07457 -0.02677 -0.17592 -0.04952 -0.09646
201 9D-2 -0.02677 0.10548 -0.10157 0.15364 0.04952
202 10F 0 -0.02320 0.04018 0.00000 0.05570 0.03216
203 10F+1 -0.06526 0.09270 -0.01202 0.06470 0.05077
204 10F-1 0.01735 -0.06526 -0.02082 -0.05077 -0.00608
205 10F+2 -0.05052 -0.00413 0.00497 -0.01141 0.04151
206 10F-2 -0.00413 -0.04575 0.00287 -0.02833 0.01141
207 10F+3 -0.08547 -0.04935 0.04241 -0.04686 0.08117
208 10F-3 -0.02419 0.04190 0.00000 0.01201 0.00693
209 6 H 1S 0.01376 0.00000 0.00000 0.00000 -0.08796
210 2S -0.06205 0.00000 0.00000 0.00000 0.13632
211 3S -0.59116 0.00000 0.00000 0.00000 -1.11234
212 4S -0.19201 0.00000 0.00000 0.00000 -0.43031
213 5PX 0.00000 -0.45451 0.08769 0.67553 0.00000
214 5PY -0.46479 0.00000 0.00000 0.00000 -0.31405
215 5PZ 0.56698 0.00000 0.00000 0.00000 0.21362
216 6PX 0.00000 0.53838 -0.08674 -0.80452 0.00000
217 6PY 0.44177 0.00000 0.00000 0.00000 0.28066
218 6PZ -0.69624 0.00000 0.00000 0.00000 -0.28898
219 7PX 0.00000 -0.14861 -0.01411 0.37682 0.00000
220 7PY -0.44123 0.00000 0.00000 0.00000 -0.45972
221 7PZ 0.12454 0.00000 0.00000 0.00000 -0.13049
222 8D 0 0.04737 0.00000 0.00000 0.00000 0.23120
223 8D+1 0.00000 -0.03463 0.36771 -0.08955 0.00000
224 8D-1 -0.17984 0.00000 0.00000 0.00000 -0.19991
225 8D+2 -0.21784 0.00000 0.00000 0.00000 -0.27888
226 8D-2 0.00000 0.11212 -0.34611 -0.08097 0.00000
227 9D 0 -0.11933 0.00000 0.00000 0.00000 -0.19832
228 9D+1 0.00000 0.06659 -0.20526 -0.00148 0.00000
229 9D-1 -0.03621 0.00000 0.00000 0.00000 0.01397
230 9D+2 0.12093 0.00000 0.00000 0.00000 0.18223
231 9D-2 0.00000 0.05912 0.20313 -0.06787 0.00000
232 10F 0 -0.04640 0.00000 0.00000 0.00000 -0.06431
233 10F+1 0.00000 0.02033 -0.02404 -0.02323 0.00000
234 10F-1 -0.13038 0.00000 0.00000 0.00000 -0.09401
235 10F+2 0.04336 0.00000 0.00000 0.00000 0.02175
236 10F-2 0.00000 0.05291 0.00574 -0.04810 0.00000
237 10F+3 0.00000 -0.09869 -0.04241 0.09373 0.00000
238 10F-3 -0.04838 0.00000 0.00000 0.00000 -0.01386
239 7 H 1S -0.00688 0.01191 0.00000 0.07618 0.04398
240 2S 0.03103 -0.05374 0.00000 -0.11806 -0.06816
241 3S 0.29558 -0.51196 0.00000 0.96331 0.55617
242 4S 0.09601 -0.16629 0.00000 0.37266 0.21515
243 5PX 0.00445 -0.46222 -0.04385 0.40442 -0.15653
244 5PY -0.45708 0.00445 -0.07594 0.15653 -0.58516
245 5PZ -0.28349 0.49102 0.00000 -0.18500 -0.10681
246 6PX 0.04183 0.46593 0.04337 -0.41162 0.22684
247 6PY 0.51423 0.04183 0.07512 -0.22684 0.67355
248 6PZ 0.34812 -0.60296 0.00000 0.25026 0.14449
249 7PX 0.12671 -0.36808 0.00706 0.43899 0.03589
250 7PY -0.22177 0.12671 0.01222 -0.03589 -0.39755
251 7PZ -0.06227 0.10786 0.00000 0.11300 0.06524
252 8D 0 -0.02368 0.04102 0.00000 -0.20023 -0.11560
253 8D+1 0.06288 -0.14354 -0.18386 0.12754 0.12534
254 8D-1 -0.07093 0.06288 -0.31845 -0.12534 0.01718
255 8D+2 0.02963 0.14288 0.29974 -0.15582 -0.00899
256 8D-2 0.14288 -0.13535 0.17305 0.18892 0.15582
257 9D 0 0.05966 -0.10334 0.00000 0.17175 0.09916
258 9D+1 0.04451 -0.01051 0.10263 -0.01085 -0.00541
259 9D-1 0.04089 0.04451 0.17776 0.00541 0.00460
260 9D+2 0.07457 -0.02677 -0.17592 0.04952 0.09646
261 9D-2 -0.02677 0.10548 -0.10157 -0.15364 -0.04952
262 10F 0 0.02320 -0.04018 0.00000 0.05570 0.03216
263 10F+1 0.06526 -0.09270 0.01202 0.06470 0.05077
264 10F-1 -0.01735 0.06526 0.02082 -0.05077 -0.00608
265 10F+2 0.05052 0.00413 -0.00497 -0.01141 0.04151
266 10F-2 0.00413 0.04575 -0.00287 -0.02833 0.01141
267 10F+3 0.08547 0.04935 -0.04241 -0.04686 0.08117
268 10F-3 0.02419 -0.04190 0.00000 0.01201 0.00693
269 8 H 1S -0.00688 -0.01191 0.00000 -0.07618 0.04398
270 2S 0.03103 0.05374 0.00000 0.11806 -0.06816
271 3S 0.29558 0.51196 0.00000 -0.96331 0.55617
272 4S 0.09601 0.16629 0.00000 -0.37266 0.21515
273 5PX -0.00445 -0.46222 -0.04385 0.40442 0.15653
274 5PY -0.45708 -0.00445 0.07594 -0.15653 -0.58516
275 5PZ -0.28349 -0.49102 0.00000 0.18500 -0.10681
276 6PX -0.04183 0.46593 0.04337 -0.41162 -0.22684
277 6PY 0.51423 -0.04183 -0.07512 0.22684 0.67355
278 6PZ 0.34812 0.60296 0.00000 -0.25026 0.14449
279 7PX -0.12671 -0.36808 0.00706 0.43899 -0.03589
280 7PY -0.22177 -0.12671 -0.01222 0.03589 -0.39755
281 7PZ -0.06227 -0.10786 0.00000 -0.11300 0.06524
282 8D 0 -0.02368 -0.04102 0.00000 0.20023 -0.11560
283 8D+1 -0.06288 -0.14354 -0.18386 0.12754 -0.12534
284 8D-1 -0.07093 -0.06288 0.31845 0.12534 0.01718
285 8D+2 0.02963 -0.14288 -0.29974 0.15582 -0.00899
286 8D-2 -0.14288 -0.13535 0.17305 0.18892 -0.15582
287 9D 0 0.05966 0.10334 0.00000 -0.17175 0.09916
288 9D+1 -0.04451 -0.01051 0.10263 -0.01085 0.00541
289 9D-1 0.04089 -0.04451 -0.17776 -0.00541 0.00460
290 9D+2 0.07457 0.02677 0.17592 -0.04952 0.09646
291 9D-2 0.02677 0.10548 -0.10157 -0.15364 0.04952
292 10F 0 0.02320 0.04018 0.00000 -0.05570 0.03216
293 10F+1 -0.06526 -0.09270 0.01202 0.06470 -0.05077
294 10F-1 -0.01735 -0.06526 -0.02082 0.05077 -0.00608
295 10F+2 0.05052 -0.00413 0.00497 0.01141 0.04151
296 10F-2 -0.00413 0.04575 -0.00287 -0.02833 -0.01141
297 10F+3 -0.08547 0.04935 -0.04241 -0.04686 -0.08117
298 10F-3 0.02419 0.04190 0.00000 -0.01201 0.00693
261 262 263 264 265
(A1U)--V (A2U)--V (EG)--V (EG)--V (EU)--V
Eigenvalues -- 8.41661 8.44435 8.44501 8.44501 8.48705
1 1 Si 1S 0.00000 -0.06486 0.00000 0.00000 0.00000
2 2S 0.00000 -0.74996 0.00000 0.00000 0.00000
3 3S 0.00000 -1.03023 0.00000 0.00000 0.00000
4 4S 0.00000 -2.84558 0.00000 0.00000 0.00000
5 5S 0.00000 5.95196 0.00000 0.00000 0.00000
6 6S 0.00000 0.20792 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 0.00440 0.00000 0.11488
8 7PY 0.00000 0.00000 0.00000 0.00440 0.00000
9 7PZ 0.00000 -0.39724 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 0.01173 0.00000 0.13775
11 8PY 0.00000 0.00000 0.00000 0.01173 0.00000
12 8PZ 0.00000 -0.42940 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 -0.07150 0.00000 -0.15874
14 9PY 0.00000 0.00000 0.00000 -0.07150 0.00000
15 9PZ 0.00000 0.98182 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 1.15109 0.00000 -0.62867
17 10PY 0.00000 0.00000 0.00000 1.15109 0.00000
18 10PZ 0.00000 -1.20400 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.32197 0.00000 -0.02133
20 11PY 0.00000 0.00000 0.00000 0.32197 0.00000
21 11PZ 0.00000 -0.31985 0.00000 0.00000 0.00000
22 12D 0 0.00000 0.44615 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 -0.56743 0.00000 -0.35891
24 12D-1 0.00000 0.00000 0.00000 -0.56743 0.00000
25 12D+2 0.00000 0.00000 0.00000 -0.26492 0.00000
26 12D-2 0.00000 0.00000 -0.26492 0.00000 0.12544
27 13D 0 0.00000 -0.05712 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 0.04726 0.00000 0.08280
29 13D-1 0.00000 0.00000 0.00000 0.04726 0.00000
30 13D+2 0.00000 0.00000 0.00000 -0.16784 0.00000
31 13D-2 0.00000 0.00000 -0.16784 0.00000 0.16570
32 14D 0 0.00000 -0.10437 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.04959 0.00000 -0.00637
34 14D-1 0.00000 0.00000 0.00000 0.04959 0.00000
35 14D+2 0.00000 0.00000 0.00000 -0.00017 0.00000
36 14D-2 0.00000 0.00000 -0.00017 0.00000 -0.01889
37 15F 0 0.00000 -0.62812 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.00000 0.40357 0.00000 0.12867
39 15F-1 0.00000 0.00000 0.00000 0.40357 0.00000
40 15F+2 0.00000 0.00000 0.00000 -0.04146 0.00000
41 15F-2 0.00000 0.00000 -0.04146 0.00000 0.25902
42 15F+3 0.05874 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 -0.30235 0.00000 0.00000 0.00000
44 16F 0 0.00000 -0.24862 0.00000 0.00000 0.00000
45 16F+1 0.00000 0.00000 -0.01373 0.00000 0.13938
46 16F-1 0.00000 0.00000 0.00000 -0.01373 0.00000
47 16F+2 0.00000 0.00000 0.00000 -0.05456 0.00000
48 16F-2 0.00000 0.00000 -0.05456 0.00000 -0.14901
49 16F+3 0.37641 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 -0.30349 0.00000 0.00000 0.00000
51 17G 0 0.00000 -0.01205 0.00000 0.00000 0.00000
52 17G+1 0.00000 0.00000 -0.01303 0.00000 0.08878
53 17G-1 0.00000 0.00000 0.00000 -0.01303 0.00000
54 17G+2 0.00000 0.00000 0.00000 -0.05017 0.00000
55 17G-2 0.00000 0.00000 -0.05017 0.00000 -0.28914
56 17G+3 0.29910 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 -0.20603 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.00000 0.06646 0.00000
59 17G-4 0.00000 0.00000 -0.06646 0.00000 0.04347
60 2 Si 1S 0.00000 0.06486 0.00000 0.00000 0.00000
61 2S 0.00000 0.74996 0.00000 0.00000 0.00000
62 3S 0.00000 1.03023 0.00000 0.00000 0.00000
63 4S 0.00000 2.84558 0.00000 0.00000 0.00000
64 5S 0.00000 -5.95196 0.00000 0.00000 0.00000
65 6S 0.00000 -0.20792 0.00000 0.00000 0.00000
66 7PX 0.00000 0.00000 -0.00440 0.00000 0.11488
67 7PY 0.00000 0.00000 0.00000 -0.00440 0.00000
68 7PZ 0.00000 -0.39724 0.00000 0.00000 0.00000
69 8PX 0.00000 0.00000 -0.01173 0.00000 0.13775
70 8PY 0.00000 0.00000 0.00000 -0.01173 0.00000
71 8PZ 0.00000 -0.42940 0.00000 0.00000 0.00000
72 9PX 0.00000 0.00000 0.07150 0.00000 -0.15874
73 9PY 0.00000 0.00000 0.00000 0.07150 0.00000
74 9PZ 0.00000 0.98182 0.00000 0.00000 0.00000
75 10PX 0.00000 0.00000 -1.15109 0.00000 -0.62867
76 10PY 0.00000 0.00000 0.00000 -1.15109 0.00000
77 10PZ 0.00000 -1.20400 0.00000 0.00000 0.00000
78 11PX 0.00000 0.00000 -0.32197 0.00000 -0.02133
79 11PY 0.00000 0.00000 0.00000 -0.32197 0.00000
80 11PZ 0.00000 -0.31985 0.00000 0.00000 0.00000
81 12D 0 0.00000 -0.44615 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.00000 -0.56743 0.00000 0.35891
83 12D-1 0.00000 0.00000 0.00000 -0.56743 0.00000
84 12D+2 0.00000 0.00000 0.00000 -0.26492 0.00000
85 12D-2 0.00000 0.00000 -0.26492 0.00000 -0.12544
86 13D 0 0.00000 0.05712 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.00000 0.04726 0.00000 -0.08280
88 13D-1 0.00000 0.00000 0.00000 0.04726 0.00000
89 13D+2 0.00000 0.00000 0.00000 -0.16784 0.00000
90 13D-2 0.00000 0.00000 -0.16784 0.00000 -0.16570
91 14D 0 0.00000 0.10437 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.00000 0.04959 0.00000 0.00637
93 14D-1 0.00000 0.00000 0.00000 0.04959 0.00000
94 14D+2 0.00000 0.00000 0.00000 -0.00017 0.00000
95 14D-2 0.00000 0.00000 -0.00017 0.00000 0.01889
96 15F 0 0.00000 -0.62812 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.00000 -0.40357 0.00000 0.12867
98 15F-1 0.00000 0.00000 0.00000 -0.40357 0.00000
99 15F+2 0.00000 0.00000 0.00000 0.04146 0.00000
100 15F-2 0.00000 0.00000 0.04146 0.00000 0.25902
101 15F+3 0.05874 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 -0.30235 0.00000 0.00000 0.00000
103 16F 0 0.00000 -0.24862 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.00000 0.01373 0.00000 0.13938
105 16F-1 0.00000 0.00000 0.00000 0.01373 0.00000
106 16F+2 0.00000 0.00000 0.00000 0.05456 0.00000
107 16F-2 0.00000 0.00000 0.05456 0.00000 -0.14901
108 16F+3 0.37641 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 -0.30349 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.01205 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.00000 -0.01303 0.00000 -0.08878
112 17G-1 0.00000 0.00000 0.00000 -0.01303 0.00000
113 17G+2 0.00000 0.00000 0.00000 -0.05017 0.00000
114 17G-2 0.00000 0.00000 -0.05017 0.00000 0.28914
115 17G+3 -0.29910 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.20603 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.00000 0.06646 0.00000
118 17G-4 0.00000 0.00000 -0.06646 0.00000 -0.04347
119 3 H 1S 0.00000 0.12432 0.00000 -0.06933 0.00000
120 2S 0.00000 -0.18020 0.00000 0.16662 0.00000
121 3S 0.00000 -1.29813 0.00000 -0.66244 0.00000
122 4S 0.00000 0.23074 0.00000 -0.19510 0.00000
123 5PX -0.59439 0.00000 0.11084 0.00000 -0.07962
124 5PY 0.00000 -0.48376 0.00000 -0.19479 0.00000
125 5PZ 0.00000 -0.06169 0.00000 0.31273 0.00000
126 6PX 0.71221 0.00000 -0.13812 0.00000 0.09416
127 6PY 0.00000 0.66290 0.00000 0.23627 0.00000
128 6PZ 0.00000 0.09943 0.00000 -0.37610 0.00000
129 7PX -0.16067 0.00000 0.10733 0.00000 -0.03309
130 7PY 0.00000 0.27029 0.00000 0.15501 0.00000
131 7PZ 0.00000 0.14953 0.00000 0.29988 0.00000
132 8D 0 0.00000 -0.21930 0.00000 0.55277 0.00000
133 8D+1 -0.00965 0.00000 0.11978 0.00000 -0.04666
134 8D-1 0.00000 0.10415 0.00000 -0.21222 0.00000
135 8D+2 0.00000 0.23295 0.00000 -0.28647 0.00000
136 8D-2 -0.26011 0.00000 -0.09548 0.00000 -0.10223
137 9D 0 0.00000 0.19164 0.00000 -0.31547 0.00000
138 9D+1 -0.03257 0.00000 -0.06018 0.00000 0.04550
139 9D-1 0.00000 -0.11214 0.00000 0.13112 0.00000
140 9D+2 0.00000 -0.02940 0.00000 0.22327 0.00000
141 9D-2 -0.02193 0.00000 0.06091 0.00000 0.02018
142 10F 0 0.00000 -0.01041 0.00000 0.03740 0.00000
143 10F+1 -0.03192 0.00000 -0.02729 0.00000 -0.02839
144 10F-1 0.00000 -0.05157 0.00000 0.01777 0.00000
145 10F+2 0.00000 -0.02731 0.00000 0.00350 0.00000
146 10F-2 0.06089 0.00000 0.00334 0.00000 -0.03704
147 10F+3 -0.11333 0.00000 0.01088 0.00000 -0.05264
148 10F-3 0.00000 -0.01506 0.00000 -0.04412 0.00000
149 4 H 1S 0.00000 0.12432 0.06004 0.03467 -0.01817
150 2S 0.00000 -0.18020 -0.14429 -0.08331 0.01207
151 3S 0.00000 -1.29813 0.57369 0.33122 -0.51923
152 4S 0.00000 0.23074 0.16896 0.09755 -0.11111
153 5PX 0.29719 0.41895 -0.11838 -0.13234 -0.26211
154 5PY -0.51476 0.24188 -0.13234 0.03443 -0.10536
155 5PZ 0.00000 -0.06169 -0.27083 -0.15636 -0.52279
156 6PX -0.35610 -0.57409 0.14267 0.16211 0.29065
157 6PY 0.61679 -0.33145 0.16211 -0.04452 0.11345
158 6PZ 0.00000 0.09943 0.32571 0.18805 0.66037
159 7PX 0.08034 -0.23408 0.14309 0.02064 -0.23172
160 7PY -0.13915 -0.13515 0.02064 0.11925 -0.11468
161 7PZ 0.00000 0.14953 -0.25970 -0.14994 -0.21713
162 8D 0 0.00000 -0.21930 -0.47871 -0.27638 -0.42040
163 8D+1 0.00482 -0.09020 -0.12922 -0.14376 -0.06191
164 8D-1 -0.00835 -0.05207 -0.14376 0.03678 -0.00880
165 8D+2 -0.22526 -0.11647 -0.08270 -0.14323 -0.02642
166 8D-2 0.13005 -0.20174 -0.23872 -0.08270 -0.14800
167 9D 0 0.00000 0.19164 0.27320 0.15773 0.19754
168 9D+1 0.01628 0.09712 0.08330 0.08283 0.14239
169 9D-1 -0.02820 0.05607 0.08283 -0.01235 0.05594
170 9D+2 -0.01899 0.01470 0.07030 0.10150 0.05821
171 9D-2 0.01097 0.02546 0.18268 0.07030 0.12101
172 10F 0 0.00000 -0.01041 -0.03239 -0.01870 -0.05728
173 10F+1 0.01596 0.04466 0.00650 0.01951 -0.04794
174 10F-1 -0.02764 0.02579 0.01951 -0.01603 -0.01129
175 10F+2 0.05273 0.01365 0.00007 0.00338 0.04346
176 10F-2 -0.03044 0.02365 0.00346 0.00007 0.03824
177 10F+3 -0.11333 0.00000 -0.00544 0.00942 0.02632
178 10F-3 0.00000 -0.01506 0.03821 0.02206 0.07299
179 5 H 1S 0.00000 0.12432 -0.06004 0.03467 0.01817
180 2S 0.00000 -0.18020 0.14429 -0.08331 -0.01207
181 3S 0.00000 -1.29813 -0.57369 0.33122 0.51923
182 4S 0.00000 0.23074 -0.16896 0.09755 0.11111
183 5PX 0.29719 -0.41895 -0.11838 0.13234 -0.26211
184 5PY 0.51476 0.24188 0.13234 0.03443 0.10536
185 5PZ 0.00000 -0.06169 0.27083 -0.15636 0.52279
186 6PX -0.35610 0.57409 0.14267 -0.16211 0.29065
187 6PY -0.61679 -0.33145 -0.16211 -0.04452 -0.11345
188 6PZ 0.00000 0.09943 -0.32571 0.18805 -0.66037
189 7PX 0.08034 0.23408 0.14309 -0.02064 -0.23172
190 7PY 0.13915 -0.13515 -0.02064 0.11925 0.11468
191 7PZ 0.00000 0.14953 0.25970 -0.14994 0.21713
192 8D 0 0.00000 -0.21930 0.47871 -0.27638 0.42040
193 8D+1 0.00482 0.09020 -0.12922 0.14376 -0.06191
194 8D-1 0.00835 -0.05207 0.14376 0.03678 0.00880
195 8D+2 0.22526 -0.11647 0.08270 -0.14323 0.02642
196 8D-2 0.13005 0.20174 -0.23872 0.08270 -0.14800
197 9D 0 0.00000 0.19164 -0.27320 0.15773 -0.19754
198 9D+1 0.01628 -0.09712 0.08330 -0.08283 0.14239
199 9D-1 0.02820 0.05607 -0.08283 -0.01235 -0.05594
200 9D+2 0.01899 0.01470 -0.07030 0.10150 -0.05821
201 9D-2 0.01097 -0.02546 0.18268 -0.07030 0.12101
202 10F 0 0.00000 -0.01041 0.03239 -0.01870 0.05728
203 10F+1 0.01596 -0.04466 0.00650 -0.01951 -0.04794
204 10F-1 0.02764 0.02579 -0.01951 -0.01603 0.01129
205 10F+2 -0.05273 0.01365 -0.00007 0.00338 -0.04346
206 10F-2 -0.03044 -0.02365 0.00346 -0.00007 0.03824
207 10F+3 -0.11333 0.00000 -0.00544 -0.00942 0.02632
208 10F-3 0.00000 -0.01506 -0.03821 0.02206 -0.07299
209 6 H 1S 0.00000 -0.12432 0.00000 -0.06933 0.00000
210 2S 0.00000 0.18020 0.00000 0.16662 0.00000
211 3S 0.00000 1.29813 0.00000 -0.66244 0.00000
212 4S 0.00000 -0.23074 0.00000 -0.19510 0.00000
213 5PX -0.59439 0.00000 -0.11084 0.00000 -0.07962
214 5PY 0.00000 -0.48376 0.00000 0.19479 0.00000
215 5PZ 0.00000 -0.06169 0.00000 -0.31273 0.00000
216 6PX 0.71221 0.00000 0.13812 0.00000 0.09416
217 6PY 0.00000 0.66290 0.00000 -0.23627 0.00000
218 6PZ 0.00000 0.09943 0.00000 0.37610 0.00000
219 7PX -0.16067 0.00000 -0.10733 0.00000 -0.03309
220 7PY 0.00000 0.27029 0.00000 -0.15501 0.00000
221 7PZ 0.00000 0.14953 0.00000 -0.29988 0.00000
222 8D 0 0.00000 0.21930 0.00000 0.55277 0.00000
223 8D+1 0.00965 0.00000 0.11978 0.00000 0.04666
224 8D-1 0.00000 -0.10415 0.00000 -0.21222 0.00000
225 8D+2 0.00000 -0.23295 0.00000 -0.28647 0.00000
226 8D-2 0.26011 0.00000 -0.09548 0.00000 0.10223
227 9D 0 0.00000 -0.19164 0.00000 -0.31547 0.00000
228 9D+1 0.03257 0.00000 -0.06018 0.00000 -0.04550
229 9D-1 0.00000 0.11214 0.00000 0.13112 0.00000
230 9D+2 0.00000 0.02940 0.00000 0.22327 0.00000
231 9D-2 0.02193 0.00000 0.06091 0.00000 -0.02018
232 10F 0 0.00000 -0.01041 0.00000 -0.03740 0.00000
233 10F+1 -0.03192 0.00000 0.02729 0.00000 -0.02839
234 10F-1 0.00000 -0.05157 0.00000 -0.01777 0.00000
235 10F+2 0.00000 -0.02731 0.00000 -0.00350 0.00000
236 10F-2 0.06089 0.00000 -0.00334 0.00000 -0.03704
237 10F+3 -0.11333 0.00000 -0.01088 0.00000 -0.05264
238 10F-3 0.00000 -0.01506 0.00000 0.04412 0.00000
239 7 H 1S 0.00000 -0.12432 -0.06004 0.03467 -0.01817
240 2S 0.00000 0.18020 0.14429 -0.08331 0.01207
241 3S 0.00000 1.29813 -0.57369 0.33122 -0.51923
242 4S 0.00000 -0.23074 -0.16896 0.09755 -0.11111
243 5PX 0.29719 -0.41895 0.11838 -0.13234 -0.26211
244 5PY 0.51476 0.24188 -0.13234 -0.03443 0.10536
245 5PZ 0.00000 -0.06169 -0.27083 0.15636 0.52279
246 6PX -0.35610 0.57409 -0.14267 0.16211 0.29065
247 6PY -0.61679 -0.33145 0.16211 0.04452 -0.11345
248 6PZ 0.00000 0.09943 0.32571 -0.18805 -0.66037
249 7PX 0.08034 0.23408 -0.14309 0.02064 -0.23172
250 7PY 0.13915 -0.13515 0.02064 -0.11925 0.11468
251 7PZ 0.00000 0.14953 -0.25970 0.14994 0.21713
252 8D 0 0.00000 0.21930 0.47871 -0.27638 -0.42040
253 8D+1 -0.00482 -0.09020 -0.12922 0.14376 0.06191
254 8D-1 -0.00835 0.05207 0.14376 0.03678 -0.00880
255 8D+2 -0.22526 0.11647 0.08270 -0.14323 -0.02642
256 8D-2 -0.13005 -0.20174 -0.23872 0.08270 0.14800
257 9D 0 0.00000 -0.19164 -0.27320 0.15773 0.19754
258 9D+1 -0.01628 0.09712 0.08330 -0.08283 -0.14239
259 9D-1 -0.02820 -0.05607 -0.08283 -0.01235 0.05594
260 9D+2 -0.01899 -0.01470 -0.07030 0.10150 0.05821
261 9D-2 -0.01097 0.02546 0.18268 -0.07030 -0.12101
262 10F 0 0.00000 -0.01041 -0.03239 0.01870 0.05728
263 10F+1 0.01596 -0.04466 -0.00650 0.01951 -0.04794
264 10F-1 0.02764 0.02579 0.01951 0.01603 0.01129
265 10F+2 -0.05273 0.01365 0.00007 -0.00338 -0.04346
266 10F-2 -0.03044 -0.02365 -0.00346 0.00007 0.03824
267 10F+3 -0.11333 0.00000 0.00544 0.00942 0.02632
268 10F-3 0.00000 -0.01506 0.03821 -0.02206 -0.07299
269 8 H 1S 0.00000 -0.12432 0.06004 0.03467 0.01817
270 2S 0.00000 0.18020 -0.14429 -0.08331 -0.01207
271 3S 0.00000 1.29813 0.57369 0.33122 0.51923
272 4S 0.00000 -0.23074 0.16896 0.09755 0.11111
273 5PX 0.29719 0.41895 0.11838 0.13234 -0.26211
274 5PY -0.51476 0.24188 0.13234 -0.03443 -0.10536
275 5PZ 0.00000 -0.06169 0.27083 0.15636 -0.52279
276 6PX -0.35610 -0.57409 -0.14267 -0.16211 0.29065
277 6PY 0.61679 -0.33145 -0.16211 0.04452 0.11345
278 6PZ 0.00000 0.09943 -0.32571 -0.18805 0.66037
279 7PX 0.08034 -0.23408 -0.14309 -0.02064 -0.23172
280 7PY -0.13915 -0.13515 -0.02064 -0.11925 -0.11468
281 7PZ 0.00000 0.14953 0.25970 0.14994 -0.21713
282 8D 0 0.00000 0.21930 -0.47871 -0.27638 0.42040
283 8D+1 -0.00482 0.09020 -0.12922 -0.14376 0.06191
284 8D-1 0.00835 0.05207 -0.14376 0.03678 0.00880
285 8D+2 0.22526 0.11647 -0.08270 -0.14323 0.02642
286 8D-2 -0.13005 0.20174 -0.23872 -0.08270 0.14800
287 9D 0 0.00000 -0.19164 0.27320 0.15773 -0.19754
288 9D+1 -0.01628 -0.09712 0.08330 0.08283 -0.14239
289 9D-1 0.02820 -0.05607 0.08283 -0.01235 -0.05594
290 9D+2 0.01899 -0.01470 0.07030 0.10150 -0.05821
291 9D-2 -0.01097 -0.02546 0.18268 0.07030 -0.12101
292 10F 0 0.00000 -0.01041 0.03239 0.01870 -0.05728
293 10F+1 0.01596 0.04466 -0.00650 -0.01951 -0.04794
294 10F-1 -0.02764 0.02579 -0.01951 0.01603 -0.01129
295 10F+2 0.05273 0.01365 -0.00007 -0.00338 0.04346
296 10F-2 -0.03044 0.02365 -0.00346 -0.00007 0.03824
297 10F+3 -0.11333 0.00000 0.00544 -0.00942 0.02632
298 10F-3 0.00000 -0.01506 -0.03821 -0.02206 0.07299
266 267 268 269 270
(EU)--V (EG)--V (EG)--V (A2G)--V (A1G)--V
Eigenvalues -- 8.48705 8.49024 8.49024 8.51269 8.52551
1 1 Si 1S 0.00000 0.00000 0.00000 0.00000 -0.00545
2 2S 0.00000 0.00000 0.00000 0.00000 -0.06645
3 3S 0.00000 0.00000 0.00000 0.00000 -0.08468
4 4S 0.00000 0.00000 0.00000 0.00000 -0.33734
5 5S 0.00000 0.00000 0.00000 0.00000 1.01356
6 6S 0.00000 0.00000 0.00000 0.00000 0.00388
7 7PX 0.00000 0.00000 -0.04597 0.00000 0.00000
8 7PY -0.11488 -0.04597 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.07991
10 8PX 0.00000 0.00000 -0.05499 0.00000 0.00000
11 8PY -0.13775 -0.05499 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.09591
13 9PX 0.00000 0.00000 0.06849 0.00000 0.00000
14 9PY 0.15874 0.06849 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 -0.19084
16 10PX 0.00000 0.00000 -0.09142 0.00000 0.00000
17 10PY 0.62867 -0.09142 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.32100
19 11PX 0.00000 0.00000 -0.24289 0.00000 0.00000
20 11PY 0.02133 -0.24289 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 0.07098
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.24436
23 12D+1 0.00000 0.00000 0.30934 0.00000 0.00000
24 12D-1 0.35891 0.30934 0.00000 0.00000 0.00000
25 12D+2 -0.12544 0.17032 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.17032 0.00000 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.02689
28 13D+1 0.00000 0.00000 -0.06727 0.00000 0.00000
29 13D-1 -0.08280 -0.06727 0.00000 0.00000 0.00000
30 13D+2 -0.16570 -0.16998 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 -0.16998 0.00000 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.02772
33 14D+1 0.00000 0.00000 -0.01000 0.00000 0.00000
34 14D-1 0.00637 -0.01000 0.00000 0.00000 0.00000
35 14D+2 0.01889 0.01323 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.01323 0.00000 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.12963
38 15F+1 0.00000 0.00000 0.05736 0.00000 0.00000
39 15F-1 -0.12867 0.05736 0.00000 0.00000 0.00000
40 15F+2 -0.25902 0.10198 0.00000 0.00000 0.00000
41 15F-2 0.00000 0.00000 0.10198 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 -0.05534 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 -0.35469
44 16F 0 0.00000 0.00000 0.00000 0.00000 -0.02845
45 16F+1 0.00000 0.00000 -0.05915 0.00000 0.00000
46 16F-1 -0.13938 -0.05915 0.00000 0.00000 0.00000
47 16F+2 0.14901 0.03656 0.00000 0.00000 0.00000
48 16F-2 0.00000 0.00000 0.03656 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.48693 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00217
51 17G 0 0.00000 0.00000 0.00000 0.00000 -0.01142
52 17G+1 0.00000 0.00000 -0.00674 0.00000 0.00000
53 17G-1 -0.08878 -0.00674 0.00000 0.00000 0.00000
54 17G+2 0.28914 0.16638 0.00000 0.00000 0.00000
55 17G-2 0.00000 0.00000 0.16638 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.43642 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 -0.03607
58 17G+4 0.04347 -0.10961 0.00000 0.00000 0.00000
59 17G-4 0.00000 0.00000 0.10961 0.00000 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 -0.00545
61 2S 0.00000 0.00000 0.00000 0.00000 -0.06645
62 3S 0.00000 0.00000 0.00000 0.00000 -0.08468
63 4S 0.00000 0.00000 0.00000 0.00000 -0.33734
64 5S 0.00000 0.00000 0.00000 0.00000 1.01356
65 6S 0.00000 0.00000 0.00000 0.00000 0.00388
66 7PX 0.00000 0.00000 0.04597 0.00000 0.00000
67 7PY -0.11488 0.04597 0.00000 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 -0.07991
69 8PX 0.00000 0.00000 0.05499 0.00000 0.00000
70 8PY -0.13775 0.05499 0.00000 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 -0.09591
72 9PX 0.00000 0.00000 -0.06849 0.00000 0.00000
73 9PY 0.15874 -0.06849 0.00000 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.19084
75 10PX 0.00000 0.00000 0.09142 0.00000 0.00000
76 10PY 0.62867 0.09142 0.00000 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 -0.32100
78 11PX 0.00000 0.00000 0.24289 0.00000 0.00000
79 11PY 0.02133 0.24289 0.00000 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 -0.07098
81 12D 0 0.00000 0.00000 0.00000 0.00000 -0.24436
82 12D+1 0.00000 0.00000 0.30934 0.00000 0.00000
83 12D-1 -0.35891 0.30934 0.00000 0.00000 0.00000
84 12D+2 0.12544 0.17032 0.00000 0.00000 0.00000
85 12D-2 0.00000 0.00000 0.17032 0.00000 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.02689
87 13D+1 0.00000 0.00000 -0.06727 0.00000 0.00000
88 13D-1 0.08280 -0.06727 0.00000 0.00000 0.00000
89 13D+2 0.16570 -0.16998 0.00000 0.00000 0.00000
90 13D-2 0.00000 0.00000 -0.16998 0.00000 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.02772
92 14D+1 0.00000 0.00000 -0.01000 0.00000 0.00000
93 14D-1 -0.00637 -0.01000 0.00000 0.00000 0.00000
94 14D+2 -0.01889 0.01323 0.00000 0.00000 0.00000
95 14D-2 0.00000 0.00000 0.01323 0.00000 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 -0.12963
97 15F+1 0.00000 0.00000 -0.05736 0.00000 0.00000
98 15F-1 -0.12867 -0.05736 0.00000 0.00000 0.00000
99 15F+2 -0.25902 -0.10198 0.00000 0.00000 0.00000
100 15F-2 0.00000 0.00000 -0.10198 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.05534 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.35469
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.02845
104 16F+1 0.00000 0.00000 0.05915 0.00000 0.00000
105 16F-1 -0.13938 0.05915 0.00000 0.00000 0.00000
106 16F+2 0.14901 -0.03656 0.00000 0.00000 0.00000
107 16F-2 0.00000 0.00000 -0.03656 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 -0.48693 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 -0.00217
110 17G 0 0.00000 0.00000 0.00000 0.00000 -0.01142
111 17G+1 0.00000 0.00000 -0.00674 0.00000 0.00000
112 17G-1 0.08878 -0.00674 0.00000 0.00000 0.00000
113 17G+2 -0.28914 0.16638 0.00000 0.00000 0.00000
114 17G-2 0.00000 0.00000 0.16638 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.43642 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 -0.03607
117 17G+4 -0.04347 -0.10961 0.00000 0.00000 0.00000
118 17G-4 0.00000 0.00000 0.10961 0.00000 0.00000
119 3 H 1S -0.02099 -0.03643 0.00000 0.00000 0.02380
120 2S 0.01394 0.09903 0.00000 0.00000 -0.04772
121 3S -0.59955 -0.10177 0.00000 0.00000 -0.30647
122 4S -0.12830 0.16486 0.00000 0.00000 -0.02590
123 5PX 0.00000 0.00000 -0.18139 -0.60454 0.00000
124 5PY 0.32294 0.02268 0.00000 0.00000 -0.00720
125 5PZ -0.60367 -0.31968 0.00000 0.00000 -0.05345
126 6PX 0.00000 0.00000 0.23279 0.76304 0.00000
127 6PY -0.35615 -0.05089 0.00000 0.00000 0.02041
128 6PZ 0.76253 0.39131 0.00000 0.00000 0.06629
129 7PX 0.00000 0.00000 -0.13057 -0.19089 0.00000
130 7PY 0.29793 0.05703 0.00000 0.00000 0.05435
131 7PZ -0.25071 -0.19210 0.00000 0.00000 0.03339
132 8D 0 -0.48544 0.00125 0.00000 0.00000 0.29535
133 8D+1 0.00000 0.00000 0.66160 -0.19887 0.00000
134 8D-1 0.06699 -0.00313 0.00000 0.00000 -0.23034
135 8D+2 0.16325 0.10885 0.00000 0.00000 -0.35813
136 8D-2 0.00000 0.00000 -0.11816 -0.13422 0.00000
137 9D 0 0.22810 -0.02083 0.00000 0.00000 -0.19560
138 9D+1 0.00000 0.00000 -0.45575 0.08039 0.00000
139 9D-1 -0.17469 -0.05380 0.00000 0.00000 0.14659
140 9D+2 -0.15461 -0.09924 0.00000 0.00000 0.23350
141 9D-2 0.00000 0.00000 0.04977 -0.14136 0.00000
142 10F 0 -0.06615 -0.02181 0.00000 0.00000 0.02623
143 10F+1 0.00000 0.00000 0.04660 -0.06510 0.00000
144 10F-1 0.05446 0.03398 0.00000 0.00000 0.00814
145 10F+2 -0.06334 -0.01628 0.00000 0.00000 0.00999
146 10F-2 0.00000 0.00000 0.10578 0.06573 0.00000
147 10F+3 0.00000 0.00000 0.01116 -0.16429 0.00000
148 10F-3 0.08428 0.06438 0.00000 0.00000 -0.04860
149 4 H 1S 0.01049 0.01822 0.03155 0.00000 0.02380
150 2S -0.00697 -0.04951 -0.08576 0.00000 -0.04772
151 3S 0.29978 0.05088 0.08813 0.00000 -0.30647
152 4S 0.06415 -0.08243 -0.14278 0.00000 -0.02590
153 5PX 0.10536 0.08837 -0.02834 0.30227 0.00624
154 5PY 0.14045 -0.13038 0.08837 -0.52355 0.00360
155 5PZ 0.30184 0.15984 0.27685 0.00000 -0.05345
156 6PX -0.11345 -0.12284 0.02003 -0.38152 -0.01768
157 6PY -0.15966 0.16187 -0.12284 0.66081 -0.01021
158 6PZ -0.38127 -0.19565 -0.33888 0.00000 0.06629
159 7PX 0.11468 0.08124 0.01013 0.09544 -0.04707
160 7PY 0.09930 -0.08367 0.08124 -0.16532 -0.02717
161 7PZ 0.12536 0.09605 0.16636 0.00000 0.03339
162 8D 0 0.24272 -0.00063 -0.00109 0.00000 0.29535
163 8D+1 0.00880 -0.28783 0.16305 0.09943 0.19948
164 8D-1 0.05174 0.49542 -0.28783 -0.17222 0.11517
165 8D+2 0.11749 -0.06141 0.09830 -0.11624 0.17906
166 8D-2 0.02642 0.09830 0.05210 0.06711 0.31015
167 9D 0 -0.11405 0.01042 0.01804 0.00000 -0.19560
168 9D+1 -0.05594 0.17405 -0.15429 -0.04020 -0.12695
169 9D-1 -0.07780 -0.35526 0.17405 0.06962 -0.07329
170 9D+2 -0.05379 0.01251 -0.06452 -0.12242 -0.11675
171 9D-2 -0.05821 -0.06452 -0.06199 0.07068 -0.20222
172 10F 0 0.03307 0.01091 0.01889 0.00000 0.02623
173 10F+1 0.01129 -0.00547 0.03714 0.03255 -0.00705
174 10F-1 0.03491 0.04345 -0.00547 -0.05638 -0.00407
175 10F+2 0.01194 0.07527 -0.05285 0.05692 -0.00500
176 10F-2 -0.04346 -0.05285 0.01424 -0.03287 -0.00866
177 10F+3 0.04559 0.00967 -0.00558 -0.16429 0.00000
178 10F-3 -0.04214 -0.03219 -0.05575 0.00000 -0.04860
179 5 H 1S 0.01049 0.01822 -0.03155 0.00000 0.02380
180 2S -0.00697 -0.04951 0.08576 0.00000 -0.04772
181 3S 0.29978 0.05088 -0.08813 0.00000 -0.30647
182 4S 0.06415 -0.08243 0.14278 0.00000 -0.02590
183 5PX -0.10536 -0.08837 -0.02834 0.30227 -0.00624
184 5PY 0.14045 -0.13038 -0.08837 0.52355 0.00360
185 5PZ 0.30184 0.15984 -0.27685 0.00000 -0.05345
186 6PX 0.11345 0.12284 0.02003 -0.38152 0.01768
187 6PY -0.15966 0.16187 0.12284 -0.66081 -0.01021
188 6PZ -0.38127 -0.19565 0.33888 0.00000 0.06629
189 7PX -0.11468 -0.08124 0.01013 0.09544 0.04707
190 7PY 0.09930 -0.08367 -0.08124 0.16532 -0.02717
191 7PZ 0.12536 0.09605 -0.16636 0.00000 0.03339
192 8D 0 0.24272 -0.00063 0.00109 0.00000 0.29535
193 8D+1 -0.00880 0.28783 0.16305 0.09943 -0.19948
194 8D-1 0.05174 0.49542 0.28783 0.17222 0.11517
195 8D+2 0.11749 -0.06141 -0.09830 0.11624 0.17906
196 8D-2 -0.02642 -0.09830 0.05210 0.06711 -0.31015
197 9D 0 -0.11405 0.01042 -0.01804 0.00000 -0.19560
198 9D+1 0.05594 -0.17405 -0.15429 -0.04020 0.12695
199 9D-1 -0.07780 -0.35526 -0.17405 -0.06962 -0.07329
200 9D+2 -0.05379 0.01251 0.06452 0.12242 -0.11675
201 9D-2 0.05821 0.06452 -0.06199 0.07068 0.20222
202 10F 0 0.03307 0.01091 -0.01889 0.00000 0.02623
203 10F+1 -0.01129 0.00547 0.03714 0.03255 0.00705
204 10F-1 0.03491 0.04345 0.00547 0.05638 -0.00407
205 10F+2 0.01194 0.07527 0.05285 -0.05692 -0.00500
206 10F-2 0.04346 0.05285 0.01424 -0.03287 0.00866
207 10F+3 -0.04559 -0.00967 -0.00558 -0.16429 0.00000
208 10F-3 -0.04214 -0.03219 0.05575 0.00000 -0.04860
209 6 H 1S 0.02099 -0.03643 0.00000 0.00000 0.02380
210 2S -0.01394 0.09903 0.00000 0.00000 -0.04772
211 3S 0.59955 -0.10177 0.00000 0.00000 -0.30647
212 4S 0.12830 0.16486 0.00000 0.00000 -0.02590
213 5PX 0.00000 0.00000 0.18139 0.60454 0.00000
214 5PY 0.32294 -0.02268 0.00000 0.00000 0.00720
215 5PZ -0.60367 0.31968 0.00000 0.00000 0.05345
216 6PX 0.00000 0.00000 -0.23279 -0.76304 0.00000
217 6PY -0.35615 0.05089 0.00000 0.00000 -0.02041
218 6PZ 0.76253 -0.39131 0.00000 0.00000 -0.06629
219 7PX 0.00000 0.00000 0.13057 0.19089 0.00000
220 7PY 0.29793 -0.05703 0.00000 0.00000 -0.05435
221 7PZ -0.25071 0.19210 0.00000 0.00000 -0.03339
222 8D 0 0.48544 0.00125 0.00000 0.00000 0.29535
223 8D+1 0.00000 0.00000 0.66160 -0.19887 0.00000
224 8D-1 -0.06699 -0.00313 0.00000 0.00000 -0.23034
225 8D+2 -0.16325 0.10885 0.00000 0.00000 -0.35813
226 8D-2 0.00000 0.00000 -0.11816 -0.13422 0.00000
227 9D 0 -0.22810 -0.02083 0.00000 0.00000 -0.19560
228 9D+1 0.00000 0.00000 -0.45575 0.08039 0.00000
229 9D-1 0.17469 -0.05380 0.00000 0.00000 0.14659
230 9D+2 0.15461 -0.09924 0.00000 0.00000 0.23350
231 9D-2 0.00000 0.00000 0.04977 -0.14136 0.00000
232 10F 0 -0.06615 0.02181 0.00000 0.00000 -0.02623
233 10F+1 0.00000 0.00000 -0.04660 0.06510 0.00000
234 10F-1 0.05446 -0.03398 0.00000 0.00000 -0.00814
235 10F+2 -0.06334 0.01628 0.00000 0.00000 -0.00999
236 10F-2 0.00000 0.00000 -0.10578 -0.06573 0.00000
237 10F+3 0.00000 0.00000 -0.01116 0.16429 0.00000
238 10F-3 0.08428 -0.06438 0.00000 0.00000 0.04860
239 7 H 1S -0.01049 0.01822 -0.03155 0.00000 0.02380
240 2S 0.00697 -0.04951 0.08576 0.00000 -0.04772
241 3S -0.29978 0.05088 -0.08813 0.00000 -0.30647
242 4S -0.06415 -0.08243 0.14278 0.00000 -0.02590
243 5PX -0.10536 0.08837 0.02834 -0.30227 0.00624
244 5PY 0.14045 0.13038 0.08837 -0.52355 -0.00360
245 5PZ 0.30184 -0.15984 0.27685 0.00000 0.05345
246 6PX 0.11345 -0.12284 -0.02003 0.38152 -0.01768
247 6PY -0.15966 -0.16187 -0.12284 0.66081 0.01021
248 6PZ -0.38127 0.19565 -0.33888 0.00000 -0.06629
249 7PX -0.11468 0.08124 -0.01013 -0.09544 -0.04707
250 7PY 0.09930 0.08367 0.08124 -0.16532 0.02717
251 7PZ 0.12536 -0.09605 0.16636 0.00000 -0.03339
252 8D 0 -0.24272 -0.00063 0.00109 0.00000 0.29535
253 8D+1 0.00880 0.28783 0.16305 0.09943 -0.19948
254 8D-1 -0.05174 0.49542 0.28783 0.17222 0.11517
255 8D+2 -0.11749 -0.06141 -0.09830 0.11624 0.17906
256 8D-2 0.02642 -0.09830 0.05210 0.06711 -0.31015
257 9D 0 0.11405 0.01042 -0.01804 0.00000 -0.19560
258 9D+1 -0.05594 -0.17405 -0.15429 -0.04020 0.12695
259 9D-1 0.07780 -0.35526 -0.17405 -0.06962 -0.07329
260 9D+2 0.05379 0.01251 0.06452 0.12242 -0.11675
261 9D-2 -0.05821 0.06452 -0.06199 0.07068 0.20222
262 10F 0 0.03307 -0.01091 0.01889 0.00000 -0.02623
263 10F+1 -0.01129 -0.00547 -0.03714 -0.03255 -0.00705
264 10F-1 0.03491 -0.04345 -0.00547 -0.05638 0.00407
265 10F+2 0.01194 -0.07527 -0.05285 0.05692 0.00500
266 10F-2 0.04346 -0.05285 -0.01424 0.03287 -0.00866
267 10F+3 -0.04559 0.00967 0.00558 0.16429 0.00000
268 10F-3 -0.04214 0.03219 -0.05575 0.00000 0.04860
269 8 H 1S -0.01049 0.01822 0.03155 0.00000 0.02380
270 2S 0.00697 -0.04951 -0.08576 0.00000 -0.04772
271 3S -0.29978 0.05088 0.08813 0.00000 -0.30647
272 4S -0.06415 -0.08243 -0.14278 0.00000 -0.02590
273 5PX 0.10536 -0.08837 0.02834 -0.30227 -0.00624
274 5PY 0.14045 0.13038 -0.08837 0.52355 -0.00360
275 5PZ 0.30184 -0.15984 -0.27685 0.00000 0.05345
276 6PX -0.11345 0.12284 -0.02003 0.38152 0.01768
277 6PY -0.15966 -0.16187 0.12284 -0.66081 0.01021
278 6PZ -0.38127 0.19565 0.33888 0.00000 -0.06629
279 7PX 0.11468 -0.08124 -0.01013 -0.09544 0.04707
280 7PY 0.09930 0.08367 -0.08124 0.16532 0.02717
281 7PZ 0.12536 -0.09605 -0.16636 0.00000 -0.03339
282 8D 0 -0.24272 -0.00063 -0.00109 0.00000 0.29535
283 8D+1 -0.00880 -0.28783 0.16305 0.09943 0.19948
284 8D-1 -0.05174 0.49542 -0.28783 -0.17222 0.11517
285 8D+2 -0.11749 -0.06141 0.09830 -0.11624 0.17906
286 8D-2 -0.02642 0.09830 0.05210 0.06711 0.31015
287 9D 0 0.11405 0.01042 0.01804 0.00000 -0.19560
288 9D+1 0.05594 0.17405 -0.15429 -0.04020 -0.12695
289 9D-1 0.07780 -0.35526 0.17405 0.06962 -0.07329
290 9D+2 0.05379 0.01251 -0.06452 -0.12242 -0.11675
291 9D-2 0.05821 -0.06452 -0.06199 0.07068 -0.20222
292 10F 0 0.03307 -0.01091 -0.01889 0.00000 -0.02623
293 10F+1 0.01129 0.00547 -0.03714 -0.03255 0.00705
294 10F-1 0.03491 -0.04345 0.00547 0.05638 0.00407
295 10F+2 0.01194 -0.07527 0.05285 -0.05692 0.00500
296 10F-2 -0.04346 0.05285 -0.01424 0.03287 0.00866
297 10F+3 0.04559 -0.00967 0.00558 0.16429 0.00000
298 10F-3 -0.04214 0.03219 0.05575 0.00000 0.04860
271 272 273 274 275
(EU)--V (EU)--V (A1G)--V (A2U)--V (A1U)--V
Eigenvalues -- 8.54571 8.54571 8.64969 8.66289 8.86932
1 1 Si 1S 0.00000 0.00000 -0.09596 -0.05837 0.00000
2 2S 0.00000 0.00000 -1.09410 -0.65523 0.00000
3 3S 0.00000 0.00000 -1.50497 -0.91834 0.00000
4 4S 0.00000 0.00000 -4.36501 -3.05366 0.00000
5 5S 0.00000 0.00000 9.44376 6.77047 0.00000
6 6S 0.00000 0.00000 -0.19999 0.78579 0.00000
7 7PX 0.04134 0.00000 0.00000 0.00000 0.00000
8 7PY 0.00000 0.04134 0.00000 0.00000 0.00000
9 7PZ 0.00000 0.00000 -0.70203 -0.83692 0.00000
10 8PX 0.05034 0.00000 0.00000 0.00000 0.00000
11 8PY 0.00000 0.05034 0.00000 0.00000 0.00000
12 8PZ 0.00000 0.00000 -0.75594 -0.93254 0.00000
13 9PX -0.10006 0.00000 0.00000 0.00000 0.00000
14 9PY 0.00000 -0.10006 0.00000 0.00000 0.00000
15 9PZ 0.00000 0.00000 1.66983 1.79928 0.00000
16 10PX 0.03531 0.00000 0.00000 0.00000 0.00000
17 10PY 0.00000 0.03531 0.00000 0.00000 0.00000
18 10PZ 0.00000 0.00000 1.45696 -0.75596 0.00000
19 11PX 0.01098 0.00000 0.00000 0.00000 0.00000
20 11PY 0.00000 0.01098 0.00000 0.00000 0.00000
21 11PZ 0.00000 0.00000 -0.06693 -0.27036 0.00000
22 12D 0 0.00000 0.00000 -0.25143 0.15953 0.00000
23 12D+1 0.01780 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.01780 0.00000 0.00000 0.00000
25 12D+2 0.00000 -0.04286 0.00000 0.00000 0.00000
26 12D-2 -0.04286 0.00000 0.00000 0.00000 0.00000
27 13D 0 0.00000 0.00000 -1.36680 -0.21202 0.00000
28 13D+1 0.03412 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.03412 0.00000 0.00000 0.00000
30 13D+2 0.00000 -0.15374 0.00000 0.00000 0.00000
31 13D-2 -0.15374 0.00000 0.00000 0.00000 0.00000
32 14D 0 0.00000 0.00000 -0.02624 -0.04048 0.00000
33 14D+1 -0.00780 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 -0.00780 0.00000 0.00000 0.00000
35 14D+2 0.00000 -0.00893 0.00000 0.00000 0.00000
36 14D-2 -0.00893 0.00000 0.00000 0.00000 0.00000
37 15F 0 0.00000 0.00000 -0.95745 -0.34280 0.00000
38 15F+1 0.06023 0.00000 0.00000 0.00000 0.00000
39 15F-1 0.00000 0.06023 0.00000 0.00000 0.00000
40 15F+2 0.00000 0.28252 0.00000 0.00000 0.00000
41 15F-2 0.28252 0.00000 0.00000 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.50264
43 15F-3 0.00000 0.00000 -1.26593 -0.68402 0.00000
44 16F 0 0.00000 0.00000 -0.25989 -0.28935 0.00000
45 16F+1 0.00564 0.00000 0.00000 0.00000 0.00000
46 16F-1 0.00000 0.00564 0.00000 0.00000 0.00000
47 16F+2 0.00000 -0.09460 0.00000 0.00000 0.00000
48 16F-2 -0.09460 0.00000 0.00000 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.69820
50 16F-3 0.00000 0.00000 -0.57515 -0.29566 0.00000
51 17G 0 0.00000 0.00000 0.22007 -0.24704 0.00000
52 17G+1 0.00908 0.00000 0.00000 0.00000 0.00000
53 17G-1 0.00000 0.00908 0.00000 0.00000 0.00000
54 17G+2 0.00000 0.10815 0.00000 0.00000 0.00000
55 17G-2 0.10815 0.00000 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.47411
57 17G-3 0.00000 0.00000 -0.39184 -0.34197 0.00000
58 17G+4 0.00000 -0.14034 0.00000 0.00000 0.00000
59 17G-4 0.14034 0.00000 0.00000 0.00000 0.00000
60 2 Si 1S 0.00000 0.00000 -0.09596 0.05837 0.00000
61 2S 0.00000 0.00000 -1.09410 0.65523 0.00000
62 3S 0.00000 0.00000 -1.50497 0.91834 0.00000
63 4S 0.00000 0.00000 -4.36501 3.05366 0.00000
64 5S 0.00000 0.00000 9.44376 -6.77047 0.00000
65 6S 0.00000 0.00000 -0.19999 -0.78579 0.00000
66 7PX 0.04134 0.00000 0.00000 0.00000 0.00000
67 7PY 0.00000 0.04134 0.00000 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.70203 -0.83692 0.00000
69 8PX 0.05034 0.00000 0.00000 0.00000 0.00000
70 8PY 0.00000 0.05034 0.00000 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.75594 -0.93254 0.00000
72 9PX -0.10006 0.00000 0.00000 0.00000 0.00000
73 9PY 0.00000 -0.10006 0.00000 0.00000 0.00000
74 9PZ 0.00000 0.00000 -1.66983 1.79928 0.00000
75 10PX 0.03531 0.00000 0.00000 0.00000 0.00000
76 10PY 0.00000 0.03531 0.00000 0.00000 0.00000
77 10PZ 0.00000 0.00000 -1.45696 -0.75596 0.00000
78 11PX 0.01098 0.00000 0.00000 0.00000 0.00000
79 11PY 0.00000 0.01098 0.00000 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.06693 -0.27036 0.00000
81 12D 0 0.00000 0.00000 -0.25143 -0.15953 0.00000
82 12D+1 -0.01780 0.00000 0.00000 0.00000 0.00000
83 12D-1 0.00000 -0.01780 0.00000 0.00000 0.00000
84 12D+2 0.00000 0.04286 0.00000 0.00000 0.00000
85 12D-2 0.04286 0.00000 0.00000 0.00000 0.00000
86 13D 0 0.00000 0.00000 -1.36680 0.21202 0.00000
87 13D+1 -0.03412 0.00000 0.00000 0.00000 0.00000
88 13D-1 0.00000 -0.03412 0.00000 0.00000 0.00000
89 13D+2 0.00000 0.15374 0.00000 0.00000 0.00000
90 13D-2 0.15374 0.00000 0.00000 0.00000 0.00000
91 14D 0 0.00000 0.00000 -0.02624 0.04048 0.00000
92 14D+1 0.00780 0.00000 0.00000 0.00000 0.00000
93 14D-1 0.00000 0.00780 0.00000 0.00000 0.00000
94 14D+2 0.00000 0.00893 0.00000 0.00000 0.00000
95 14D-2 0.00893 0.00000 0.00000 0.00000 0.00000
96 15F 0 0.00000 0.00000 0.95745 -0.34280 0.00000
97 15F+1 0.06023 0.00000 0.00000 0.00000 0.00000
98 15F-1 0.00000 0.06023 0.00000 0.00000 0.00000
99 15F+2 0.00000 0.28252 0.00000 0.00000 0.00000
100 15F-2 0.28252 0.00000 0.00000 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.50264
102 15F-3 0.00000 0.00000 1.26593 -0.68402 0.00000
103 16F 0 0.00000 0.00000 0.25989 -0.28935 0.00000
104 16F+1 0.00564 0.00000 0.00000 0.00000 0.00000
105 16F-1 0.00000 0.00564 0.00000 0.00000 0.00000
106 16F+2 0.00000 -0.09460 0.00000 0.00000 0.00000
107 16F-2 -0.09460 0.00000 0.00000 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.69820
109 16F-3 0.00000 0.00000 0.57515 -0.29566 0.00000
110 17G 0 0.00000 0.00000 0.22007 0.24704 0.00000
111 17G+1 -0.00908 0.00000 0.00000 0.00000 0.00000
112 17G-1 0.00000 -0.00908 0.00000 0.00000 0.00000
113 17G+2 0.00000 -0.10815 0.00000 0.00000 0.00000
114 17G-2 -0.10815 0.00000 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 -0.47411
116 17G-3 0.00000 0.00000 -0.39184 0.34197 0.00000
117 17G+4 0.00000 0.14034 0.00000 0.00000 0.00000
118 17G-4 -0.14034 0.00000 0.00000 0.00000 0.00000
119 3 H 1S 0.00000 -0.03876 0.26694 0.11278 0.00000
120 2S 0.00000 0.12904 -0.42078 -0.16501 0.00000
121 3S 0.00000 -0.11693 -3.14559 -1.84367 0.00000
122 4S 0.00000 0.02877 0.09514 0.03209 0.00000
123 5PX -0.12438 0.00000 0.00000 0.00000 -0.27205
124 5PY 0.00000 -0.14171 -0.47273 -0.36699 0.00000
125 5PZ 0.00000 -0.09356 -0.35184 0.12357 0.00000
126 6PX 0.16427 0.00000 0.00000 0.00000 0.37611
127 6PY 0.00000 0.14317 0.78569 0.60751 0.00000
128 6PZ 0.00000 0.10775 0.51948 -0.12912 0.00000
129 7PX -0.03901 0.00000 0.00000 0.00000 0.42416
130 7PY 0.00000 -0.04323 0.87009 0.52951 0.00000
131 7PZ 0.00000 0.01180 0.32333 0.34458 0.00000
132 8D 0 0.00000 0.06091 -0.00141 0.22025 0.00000
133 8D+1 0.69409 0.00000 0.00000 0.00000 0.28054
134 8D-1 0.00000 -0.09352 0.10201 -0.21034 0.00000
135 8D+2 0.00000 0.08730 -0.02624 -0.22864 0.00000
136 8D-2 -0.11437 0.00000 0.00000 0.00000 0.39526
137 9D 0 0.00000 -0.02817 0.04814 -0.04171 0.00000
138 9D+1 -0.49847 0.00000 0.00000 0.00000 -0.29688
139 9D-1 0.00000 0.03959 -0.24612 0.13590 0.00000
140 9D+2 0.00000 -0.05991 0.19687 0.33827 0.00000
141 9D-2 0.02239 0.00000 0.00000 0.00000 -0.59019
142 10F 0 0.00000 -0.00800 -0.03845 0.06041 0.00000
143 10F+1 0.04602 0.00000 0.00000 0.00000 -0.03250
144 10F-1 0.00000 -0.01817 0.00227 -0.08866 0.00000
145 10F+2 0.00000 0.01025 -0.06831 0.03014 0.00000
146 10F-2 0.11805 0.00000 0.00000 0.00000 0.12882
147 10F+3 -0.02090 0.00000 0.00000 0.00000 -0.22259
148 10F-3 0.00000 0.02949 -0.05295 -0.08712 0.00000
149 4 H 1S 0.03357 0.01938 0.26694 0.11278 0.00000
150 2S -0.11175 -0.06452 -0.42078 -0.16501 0.00000
151 3S 0.10127 0.05847 -3.14559 -1.84367 0.00000
152 4S -0.02491 -0.01438 0.09514 0.03209 0.00000
153 5PX -0.13738 -0.00750 0.40940 0.31783 0.13603
154 5PY -0.00750 -0.12872 0.23636 0.18350 -0.23561
155 5PZ 0.08103 0.04678 -0.35184 0.12357 0.00000
156 6PX 0.14845 -0.00914 -0.68043 -0.52612 -0.18805
157 6PY -0.00914 0.15900 -0.39284 -0.30376 0.32572
158 6PZ -0.09331 -0.05387 0.51948 -0.12912 0.00000
159 7PX -0.04218 -0.00183 -0.75352 -0.45857 -0.21208
160 7PY -0.00183 -0.04007 -0.43504 -0.26475 0.36733
161 7PZ -0.01022 -0.00590 0.32333 0.34458 0.00000
162 8D 0 -0.05275 -0.03046 -0.00141 0.22025 0.00000
163 8D+1 0.10338 -0.34105 -0.08834 0.18216 -0.14027
164 8D-1 -0.34105 0.49719 -0.05101 0.10517 0.24295
165 8D+2 0.08732 -0.06395 0.01312 0.11432 0.34230
166 8D-2 0.03688 0.08732 0.02273 0.19801 -0.19763
167 9D 0 0.02440 0.01408 0.04814 -0.04171 0.00000
168 9D+1 -0.09493 0.23299 0.21315 -0.11769 0.14844
169 9D-1 0.23299 -0.36396 0.12306 -0.06795 -0.25710
170 9D+2 -0.03564 0.00181 -0.09843 -0.16914 -0.51112
171 9D-2 -0.03934 -0.03564 -0.17049 -0.29295 0.29509
172 10F 0 0.00692 0.00400 -0.03845 0.06041 0.00000
173 10F+1 -0.00212 -0.02779 -0.00197 0.07678 0.01625
174 10F-1 -0.02779 0.02997 -0.00114 0.04433 -0.02815
175 10F+2 -0.04668 0.09110 0.03415 -0.01507 0.11156
176 10F-2 0.03720 -0.04668 0.05915 -0.02610 -0.06441
177 10F+3 0.01045 -0.01810 0.00000 0.00000 -0.22259
178 10F-3 -0.02554 -0.01475 -0.05295 -0.08712 0.00000
179 5 H 1S -0.03357 0.01938 0.26694 0.11278 0.00000
180 2S 0.11175 -0.06452 -0.42078 -0.16501 0.00000
181 3S -0.10127 0.05847 -3.14559 -1.84367 0.00000
182 4S 0.02491 -0.01438 0.09514 0.03209 0.00000
183 5PX -0.13738 0.00750 -0.40940 -0.31783 0.13603
184 5PY 0.00750 -0.12872 0.23636 0.18350 0.23561
185 5PZ -0.08103 0.04678 -0.35184 0.12357 0.00000
186 6PX 0.14845 0.00914 0.68043 0.52612 -0.18805
187 6PY 0.00914 0.15900 -0.39284 -0.30376 -0.32572
188 6PZ 0.09331 -0.05387 0.51948 -0.12912 0.00000
189 7PX -0.04218 0.00183 0.75352 0.45857 -0.21208
190 7PY 0.00183 -0.04007 -0.43504 -0.26475 -0.36733
191 7PZ 0.01022 -0.00590 0.32333 0.34458 0.00000
192 8D 0 0.05275 -0.03046 -0.00141 0.22025 0.00000
193 8D+1 0.10338 0.34105 0.08834 -0.18216 -0.14027
194 8D-1 0.34105 0.49719 -0.05101 0.10517 -0.24295
195 8D+2 -0.08732 -0.06395 0.01312 0.11432 -0.34230
196 8D-2 0.03688 -0.08732 -0.02273 -0.19801 -0.19763
197 9D 0 -0.02440 0.01408 0.04814 -0.04171 0.00000
198 9D+1 -0.09493 -0.23299 -0.21315 0.11769 0.14844
199 9D-1 -0.23299 -0.36396 0.12306 -0.06795 0.25710
200 9D+2 0.03564 0.00181 -0.09843 -0.16914 0.51112
201 9D-2 -0.03934 0.03564 0.17049 0.29295 0.29509
202 10F 0 -0.00692 0.00400 -0.03845 0.06041 0.00000
203 10F+1 -0.00212 0.02779 0.00197 -0.07678 0.01625
204 10F-1 0.02779 0.02997 -0.00114 0.04433 0.02815
205 10F+2 0.04668 0.09110 0.03415 -0.01507 -0.11156
206 10F-2 0.03720 0.04668 -0.05915 0.02610 -0.06441
207 10F+3 0.01045 0.01810 0.00000 0.00000 -0.22259
208 10F-3 0.02554 -0.01475 -0.05295 -0.08712 0.00000
209 6 H 1S 0.00000 0.03876 0.26694 -0.11278 0.00000
210 2S 0.00000 -0.12904 -0.42078 0.16501 0.00000
211 3S 0.00000 0.11693 -3.14559 1.84367 0.00000
212 4S 0.00000 -0.02877 0.09514 -0.03209 0.00000
213 5PX -0.12438 0.00000 0.00000 0.00000 -0.27205
214 5PY 0.00000 -0.14171 0.47273 -0.36699 0.00000
215 5PZ 0.00000 -0.09356 0.35184 0.12357 0.00000
216 6PX 0.16427 0.00000 0.00000 0.00000 0.37611
217 6PY 0.00000 0.14317 -0.78569 0.60751 0.00000
218 6PZ 0.00000 0.10775 -0.51948 -0.12912 0.00000
219 7PX -0.03901 0.00000 0.00000 0.00000 0.42416
220 7PY 0.00000 -0.04323 -0.87009 0.52951 0.00000
221 7PZ 0.00000 0.01180 -0.32333 0.34458 0.00000
222 8D 0 0.00000 -0.06091 -0.00141 -0.22025 0.00000
223 8D+1 -0.69409 0.00000 0.00000 0.00000 -0.28054
224 8D-1 0.00000 0.09352 0.10201 0.21034 0.00000
225 8D+2 0.00000 -0.08730 -0.02624 0.22864 0.00000
226 8D-2 0.11437 0.00000 0.00000 0.00000 -0.39526
227 9D 0 0.00000 0.02817 0.04814 0.04171 0.00000
228 9D+1 0.49847 0.00000 0.00000 0.00000 0.29688
229 9D-1 0.00000 -0.03959 -0.24612 -0.13590 0.00000
230 9D+2 0.00000 0.05991 0.19687 -0.33827 0.00000
231 9D-2 -0.02239 0.00000 0.00000 0.00000 0.59019
232 10F 0 0.00000 -0.00800 0.03845 0.06041 0.00000
233 10F+1 0.04602 0.00000 0.00000 0.00000 -0.03250
234 10F-1 0.00000 -0.01817 -0.00227 -0.08866 0.00000
235 10F+2 0.00000 0.01025 0.06831 0.03014 0.00000
236 10F-2 0.11805 0.00000 0.00000 0.00000 0.12882
237 10F+3 -0.02090 0.00000 0.00000 0.00000 -0.22259
238 10F-3 0.00000 0.02949 0.05295 -0.08712 0.00000
239 7 H 1S 0.03357 -0.01938 0.26694 -0.11278 0.00000
240 2S -0.11175 0.06452 -0.42078 0.16501 0.00000
241 3S 0.10127 -0.05847 -3.14559 1.84367 0.00000
242 4S -0.02491 0.01438 0.09514 -0.03209 0.00000
243 5PX -0.13738 0.00750 0.40940 -0.31783 0.13603
244 5PY 0.00750 -0.12872 -0.23636 0.18350 0.23561
245 5PZ -0.08103 0.04678 0.35184 0.12357 0.00000
246 6PX 0.14845 0.00914 -0.68043 0.52612 -0.18805
247 6PY 0.00914 0.15900 0.39284 -0.30376 -0.32572
248 6PZ 0.09331 -0.05387 -0.51948 -0.12912 0.00000
249 7PX -0.04218 0.00183 -0.75352 0.45857 -0.21208
250 7PY 0.00183 -0.04007 0.43504 -0.26475 -0.36733
251 7PZ 0.01022 -0.00590 -0.32333 0.34458 0.00000
252 8D 0 -0.05275 0.03046 -0.00141 -0.22025 0.00000
253 8D+1 -0.10338 -0.34105 0.08834 0.18216 0.14027
254 8D-1 -0.34105 -0.49719 -0.05101 -0.10517 0.24295
255 8D+2 0.08732 0.06395 0.01312 -0.11432 0.34230
256 8D-2 -0.03688 0.08732 -0.02273 0.19801 0.19763
257 9D 0 0.02440 -0.01408 0.04814 0.04171 0.00000
258 9D+1 0.09493 0.23299 -0.21315 -0.11769 -0.14844
259 9D-1 0.23299 0.36396 0.12306 0.06795 -0.25710
260 9D+2 -0.03564 -0.00181 -0.09843 0.16914 -0.51112
261 9D-2 0.03934 -0.03564 0.17049 -0.29295 -0.29509
262 10F 0 -0.00692 0.00400 0.03845 0.06041 0.00000
263 10F+1 -0.00212 0.02779 -0.00197 -0.07678 0.01625
264 10F-1 0.02779 0.02997 0.00114 0.04433 0.02815
265 10F+2 0.04668 0.09110 -0.03415 -0.01507 -0.11156
266 10F-2 0.03720 0.04668 0.05915 0.02610 -0.06441
267 10F+3 0.01045 0.01810 0.00000 0.00000 -0.22259
268 10F-3 0.02554 -0.01475 0.05295 -0.08712 0.00000
269 8 H 1S -0.03357 -0.01938 0.26694 -0.11278 0.00000
270 2S 0.11175 0.06452 -0.42078 0.16501 0.00000
271 3S -0.10127 -0.05847 -3.14559 1.84367 0.00000
272 4S 0.02491 0.01438 0.09514 -0.03209 0.00000
273 5PX -0.13738 -0.00750 -0.40940 0.31783 0.13603
274 5PY -0.00750 -0.12872 -0.23636 0.18350 -0.23561
275 5PZ 0.08103 0.04678 0.35184 0.12357 0.00000
276 6PX 0.14845 -0.00914 0.68043 -0.52612 -0.18805
277 6PY -0.00914 0.15900 0.39284 -0.30376 0.32572
278 6PZ -0.09331 -0.05387 -0.51948 -0.12912 0.00000
279 7PX -0.04218 -0.00183 0.75352 -0.45857 -0.21208
280 7PY -0.00183 -0.04007 0.43504 -0.26475 0.36733
281 7PZ -0.01022 -0.00590 -0.32333 0.34458 0.00000
282 8D 0 0.05275 0.03046 -0.00141 -0.22025 0.00000
283 8D+1 -0.10338 0.34105 -0.08834 -0.18216 0.14027
284 8D-1 0.34105 -0.49719 -0.05101 -0.10517 -0.24295
285 8D+2 -0.08732 0.06395 0.01312 -0.11432 -0.34230
286 8D-2 -0.03688 -0.08732 0.02273 -0.19801 0.19763
287 9D 0 -0.02440 -0.01408 0.04814 0.04171 0.00000
288 9D+1 0.09493 -0.23299 0.21315 0.11769 -0.14844
289 9D-1 -0.23299 0.36396 0.12306 0.06795 0.25710
290 9D+2 0.03564 -0.00181 -0.09843 0.16914 0.51112
291 9D-2 0.03934 0.03564 -0.17049 0.29295 -0.29509
292 10F 0 0.00692 0.00400 0.03845 0.06041 0.00000
293 10F+1 -0.00212 -0.02779 0.00197 0.07678 0.01625
294 10F-1 -0.02779 0.02997 0.00114 0.04433 -0.02815
295 10F+2 -0.04668 0.09110 -0.03415 -0.01507 0.11156
296 10F-2 0.03720 -0.04668 -0.05915 -0.02610 -0.06441
297 10F+3 0.01045 -0.01810 0.00000 0.00000 -0.22259
298 10F-3 -0.02554 -0.01475 0.05295 -0.08712 0.00000
276 277 278 279 280
(EG)--V (EG)--V (EU)--V (EU)--V (A2U)--V
Eigenvalues -- 8.94990 8.94990 9.02448 9.02448 9.06479
1 1 Si 1S 0.00000 0.00000 0.00000 0.00000 -0.01761
2 2S 0.00000 0.00000 0.00000 0.00000 -0.21971
3 3S 0.00000 0.00000 0.00000 0.00000 -0.27112
4 4S 0.00000 0.00000 0.00000 0.00000 -1.20308
5 5S 0.00000 0.00000 0.00000 0.00000 3.18581
6 6S 0.00000 0.00000 0.00000 0.00000 0.74797
7 7PX 0.00000 0.28451 0.00000 0.21117 0.00000
8 7PY 0.28451 0.00000 -0.21117 0.00000 0.00000
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.02545
10 8PX 0.00000 0.32145 0.00000 0.24773 0.00000
11 8PY 0.32145 0.00000 -0.24773 0.00000 0.00000
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.02592
13 9PX 0.00000 -0.44772 0.00000 -0.27459 0.00000
14 9PY -0.44772 0.00000 0.27459 0.00000 0.00000
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.18300
16 10PX 0.00000 -0.33248 0.00000 -0.30437 0.00000
17 10PY -0.33248 0.00000 0.30437 0.00000 0.00000
18 10PZ 0.00000 0.00000 0.00000 0.00000 -0.59312
19 11PX 0.00000 0.06358 0.00000 -0.14130 0.00000
20 11PY 0.06358 0.00000 0.14130 0.00000 0.00000
21 11PZ 0.00000 0.00000 0.00000 0.00000 -0.10347
22 12D 0 0.00000 0.00000 0.00000 0.00000 -0.16204
23 12D+1 0.00000 0.00759 0.00000 0.04180 0.00000
24 12D-1 0.00759 0.00000 -0.04180 0.00000 0.00000
25 12D+2 -0.01016 0.00000 -0.32302 0.00000 0.00000
26 12D-2 0.00000 -0.01016 0.00000 0.32302 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 -0.81955
28 13D+1 0.00000 0.37770 0.00000 0.74928 0.00000
29 13D-1 0.37770 0.00000 -0.74928 0.00000 0.00000
30 13D+2 -0.09362 0.00000 0.12872 0.00000 0.00000
31 13D-2 0.00000 -0.09362 0.00000 -0.12872 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 -0.00065
33 14D+1 0.00000 -0.00357 0.00000 -0.02771 0.00000
34 14D-1 -0.00357 0.00000 0.02771 0.00000 0.00000
35 14D+2 -0.01727 0.00000 0.03029 0.00000 0.00000
36 14D-2 0.00000 -0.01727 0.00000 -0.03029 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.02642
38 15F+1 0.00000 0.35444 0.00000 0.53095 0.00000
39 15F-1 0.35444 0.00000 -0.53095 0.00000 0.00000
40 15F+2 -0.25476 0.00000 0.59098 0.00000 0.00000
41 15F-2 0.00000 -0.25476 0.00000 -0.59098 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 -0.54165
44 16F 0 0.00000 0.00000 0.00000 0.00000 -0.03215
45 16F+1 0.00000 0.36951 0.00000 0.29144 0.00000
46 16F-1 0.36951 0.00000 -0.29144 0.00000 0.00000
47 16F+2 -0.31018 0.00000 0.27895 0.00000 0.00000
48 16F-2 0.00000 -0.31018 0.00000 -0.27895 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 -0.29184
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.20554
52 17G+1 0.00000 0.01431 0.00000 -0.01434 0.00000
53 17G-1 0.01431 0.00000 0.01434 0.00000 0.00000
54 17G+2 -0.28031 0.00000 0.33465 0.00000 0.00000
55 17G-2 0.00000 -0.28031 0.00000 -0.33465 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 -0.00691
58 17G+4 -0.28146 0.00000 0.23383 0.00000 0.00000
59 17G-4 0.00000 0.28146 0.00000 0.23383 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.01761
61 2S 0.00000 0.00000 0.00000 0.00000 0.21971
62 3S 0.00000 0.00000 0.00000 0.00000 0.27112
63 4S 0.00000 0.00000 0.00000 0.00000 1.20308
64 5S 0.00000 0.00000 0.00000 0.00000 -3.18581
65 6S 0.00000 0.00000 0.00000 0.00000 -0.74797
66 7PX 0.00000 -0.28451 0.00000 0.21117 0.00000
67 7PY -0.28451 0.00000 -0.21117 0.00000 0.00000
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.02545
69 8PX 0.00000 -0.32145 0.00000 0.24773 0.00000
70 8PY -0.32145 0.00000 -0.24773 0.00000 0.00000
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.02592
72 9PX 0.00000 0.44772 0.00000 -0.27459 0.00000
73 9PY 0.44772 0.00000 0.27459 0.00000 0.00000
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.18300
75 10PX 0.00000 0.33248 0.00000 -0.30437 0.00000
76 10PY 0.33248 0.00000 0.30437 0.00000 0.00000
77 10PZ 0.00000 0.00000 0.00000 0.00000 -0.59312
78 11PX 0.00000 -0.06358 0.00000 -0.14130 0.00000
79 11PY -0.06358 0.00000 0.14130 0.00000 0.00000
80 11PZ 0.00000 0.00000 0.00000 0.00000 -0.10347
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.16204
82 12D+1 0.00000 0.00759 0.00000 -0.04180 0.00000
83 12D-1 0.00759 0.00000 0.04180 0.00000 0.00000
84 12D+2 -0.01016 0.00000 0.32302 0.00000 0.00000
85 12D-2 0.00000 -0.01016 0.00000 -0.32302 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.81955
87 13D+1 0.00000 0.37770 0.00000 -0.74928 0.00000
88 13D-1 0.37770 0.00000 0.74928 0.00000 0.00000
89 13D+2 -0.09362 0.00000 -0.12872 0.00000 0.00000
90 13D-2 0.00000 -0.09362 0.00000 0.12872 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00065
92 14D+1 0.00000 -0.00357 0.00000 0.02771 0.00000
93 14D-1 -0.00357 0.00000 -0.02771 0.00000 0.00000
94 14D+2 -0.01727 0.00000 -0.03029 0.00000 0.00000
95 14D-2 0.00000 -0.01727 0.00000 0.03029 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.02642
97 15F+1 0.00000 -0.35444 0.00000 0.53095 0.00000
98 15F-1 -0.35444 0.00000 -0.53095 0.00000 0.00000
99 15F+2 0.25476 0.00000 0.59098 0.00000 0.00000
100 15F-2 0.00000 0.25476 0.00000 -0.59098 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 -0.54165
103 16F 0 0.00000 0.00000 0.00000 0.00000 -0.03215
104 16F+1 0.00000 -0.36951 0.00000 0.29144 0.00000
105 16F-1 -0.36951 0.00000 -0.29144 0.00000 0.00000
106 16F+2 0.31018 0.00000 0.27895 0.00000 0.00000
107 16F-2 0.00000 0.31018 0.00000 -0.27895 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 -0.29184
110 17G 0 0.00000 0.00000 0.00000 0.00000 -0.20554
111 17G+1 0.00000 0.01431 0.00000 0.01434 0.00000
112 17G-1 0.01431 0.00000 -0.01434 0.00000 0.00000
113 17G+2 -0.28031 0.00000 -0.33465 0.00000 0.00000
114 17G-2 0.00000 -0.28031 0.00000 0.33465 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00691
117 17G+4 -0.28146 0.00000 -0.23383 0.00000 0.00000
118 17G-4 0.00000 0.28146 0.00000 -0.23383 0.00000
119 3 H 1S 0.04638 0.00000 -0.11538 0.00000 0.02485
120 2S -0.05197 0.00000 0.19251 0.00000 0.00968
121 3S 0.10557 0.00000 0.04281 0.00000 -1.10419
122 4S -0.00220 0.00000 -0.24633 0.00000 -0.07884
123 5PX 0.00000 -0.13329 0.00000 -0.15683 0.00000
124 5PY -0.13776 0.00000 0.20800 0.00000 -0.09110
125 5PZ 0.17549 0.00000 -0.13927 0.00000 -0.04732
126 6PX 0.00000 0.18076 0.00000 0.22413 0.00000
127 6PY 0.14321 0.00000 -0.26869 0.00000 0.17588
128 6PZ -0.24270 0.00000 0.17980 0.00000 0.04193
129 7PX 0.00000 0.27195 0.00000 0.16555 0.00000
130 7PY 0.13860 0.00000 -0.29615 0.00000 0.21331
131 7PZ -0.55247 0.00000 0.78550 0.00000 0.65956
132 8D 0 -0.36890 0.00000 0.36248 0.00000 0.35999
133 8D+1 0.00000 0.13789 0.00000 0.01310 0.00000
134 8D-1 -0.45827 0.00000 0.50300 0.00000 0.41554
135 8D+2 -0.29456 0.00000 0.34896 0.00000 0.02950
136 8D-2 0.00000 0.29265 0.00000 0.21275 0.00000
137 9D 0 0.45640 0.00000 -0.49447 0.00000 -0.35321
138 9D+1 0.00000 -0.15563 0.00000 -0.03418 0.00000
139 9D-1 0.58257 0.00000 -0.63403 0.00000 -0.48944
140 9D+2 0.31209 0.00000 -0.40508 0.00000 0.00827
141 9D-2 0.00000 -0.38671 0.00000 -0.30469 0.00000
142 10F 0 0.01350 0.00000 -0.01463 0.00000 -0.03956
143 10F+1 0.00000 -0.02052 0.00000 -0.03459 0.00000
144 10F-1 -0.20572 0.00000 0.19496 0.00000 0.10262
145 10F+2 0.12138 0.00000 -0.11236 0.00000 -0.06794
146 10F-2 0.00000 0.06711 0.00000 0.03221 0.00000
147 10F+3 0.00000 -0.12241 0.00000 -0.09317 0.00000
148 10F-3 -0.10194 0.00000 0.10636 0.00000 -0.01250
149 4 H 1S -0.02319 -0.04017 0.05769 -0.09992 0.02485
150 2S 0.02599 0.04501 -0.09626 0.16672 0.00968
151 3S -0.05279 -0.09143 -0.02141 0.03708 -1.10419
152 4S 0.00110 0.00191 0.12317 -0.21333 -0.07884
153 5PX -0.00193 -0.13664 0.02216 -0.19521 0.07890
154 5PY -0.13441 -0.00193 0.16962 -0.02216 0.04555
155 5PZ -0.08774 -0.15198 0.06963 -0.12061 -0.04732
156 6PX -0.01626 0.15260 -0.01929 0.25755 -0.15232
157 6PY 0.17137 -0.01626 -0.23527 0.01929 -0.08794
158 6PZ 0.12135 0.21018 -0.08990 0.15572 0.04193
159 7PX -0.05774 0.17194 -0.05655 0.26350 -0.18473
160 7PY 0.23861 -0.05774 -0.19820 0.05655 -0.10666
161 7PZ 0.27624 0.47846 -0.39275 0.68027 0.65956
162 8D 0 0.18445 0.31948 -0.18124 0.31391 0.35999
163 8D+1 -0.25814 -0.30923 0.22348 -0.37398 -0.35987
164 8D-1 -0.01115 -0.25814 0.11593 -0.22348 -0.20777
165 8D+2 0.14585 -0.25427 -0.07233 -0.24323 -0.01475
166 8D-2 -0.25427 -0.14775 0.24323 -0.20853 -0.02555
167 9D 0 -0.22820 -0.39525 0.24724 -0.42823 -0.35321
168 9D+1 0.31965 0.39802 -0.28935 0.46698 0.42386
169 9D-1 0.02892 0.31965 -0.13287 0.28935 0.24472
170 9D+2 -0.21201 0.30259 0.12725 0.30734 -0.00413
171 9D-2 0.30259 0.13739 -0.30734 0.22764 -0.00716
172 10F 0 -0.00675 -0.01169 0.00732 -0.01267 -0.03956
173 10F+1 -0.08020 -0.15942 0.06944 -0.15487 -0.08887
174 10F-1 -0.06682 -0.08020 0.07468 -0.06944 -0.05131
175 10F+2 0.08068 0.02350 -0.05225 0.03471 0.03397
176 10F-2 0.02350 0.10781 -0.03471 0.09233 0.05884
177 10F+3 -0.10601 0.06120 0.08069 0.04658 0.00000
178 10F-3 0.05097 0.08828 -0.05318 0.09211 -0.01250
179 5 H 1S -0.02319 0.04017 0.05769 0.09992 0.02485
180 2S 0.02599 -0.04501 -0.09626 -0.16672 0.00968
181 3S -0.05279 0.09143 -0.02141 -0.03708 -1.10419
182 4S 0.00110 -0.00191 0.12317 0.21333 -0.07884
183 5PX 0.00193 -0.13664 -0.02216 -0.19521 -0.07890
184 5PY -0.13441 0.00193 0.16962 0.02216 0.04555
185 5PZ -0.08774 0.15198 0.06963 0.12061 -0.04732
186 6PX 0.01626 0.15260 0.01929 0.25755 0.15232
187 6PY 0.17137 0.01626 -0.23527 -0.01929 -0.08794
188 6PZ 0.12135 -0.21018 -0.08990 -0.15572 0.04193
189 7PX 0.05774 0.17194 0.05655 0.26350 0.18473
190 7PY 0.23861 0.05774 -0.19820 -0.05655 -0.10666
191 7PZ 0.27624 -0.47846 -0.39275 -0.68027 0.65956
192 8D 0 0.18445 -0.31948 -0.18124 -0.31391 0.35999
193 8D+1 0.25814 -0.30923 -0.22348 -0.37398 0.35987
194 8D-1 -0.01115 0.25814 0.11593 0.22348 -0.20777
195 8D+2 0.14585 0.25427 -0.07233 0.24323 -0.01475
196 8D-2 0.25427 -0.14775 -0.24323 -0.20853 0.02555
197 9D 0 -0.22820 0.39525 0.24724 0.42823 -0.35321
198 9D+1 -0.31965 0.39802 0.28935 0.46698 -0.42386
199 9D-1 0.02892 -0.31965 -0.13287 -0.28935 0.24472
200 9D+2 -0.21201 -0.30259 0.12725 -0.30734 -0.00413
201 9D-2 -0.30259 0.13739 0.30734 0.22764 0.00716
202 10F 0 -0.00675 0.01169 0.00732 0.01267 -0.03956
203 10F+1 0.08020 -0.15942 -0.06944 -0.15487 0.08887
204 10F-1 -0.06682 0.08020 0.07468 0.06944 -0.05131
205 10F+2 0.08068 -0.02350 -0.05225 -0.03471 0.03397
206 10F-2 -0.02350 0.10781 0.03471 0.09233 -0.05884
207 10F+3 0.10601 0.06120 -0.08069 0.04658 0.00000
208 10F-3 0.05097 -0.08828 -0.05318 -0.09211 -0.01250
209 6 H 1S 0.04638 0.00000 0.11538 0.00000 -0.02485
210 2S -0.05197 0.00000 -0.19251 0.00000 -0.00968
211 3S 0.10557 0.00000 -0.04281 0.00000 1.10419
212 4S -0.00220 0.00000 0.24633 0.00000 0.07884
213 5PX 0.00000 0.13329 0.00000 -0.15683 0.00000
214 5PY 0.13776 0.00000 0.20800 0.00000 -0.09110
215 5PZ -0.17549 0.00000 -0.13927 0.00000 -0.04732
216 6PX 0.00000 -0.18076 0.00000 0.22413 0.00000
217 6PY -0.14321 0.00000 -0.26869 0.00000 0.17588
218 6PZ 0.24270 0.00000 0.17980 0.00000 0.04193
219 7PX 0.00000 -0.27195 0.00000 0.16555 0.00000
220 7PY -0.13860 0.00000 -0.29615 0.00000 0.21331
221 7PZ 0.55247 0.00000 0.78550 0.00000 0.65956
222 8D 0 -0.36890 0.00000 -0.36248 0.00000 -0.35999
223 8D+1 0.00000 0.13789 0.00000 -0.01310 0.00000
224 8D-1 -0.45827 0.00000 -0.50300 0.00000 -0.41554
225 8D+2 -0.29456 0.00000 -0.34896 0.00000 -0.02950
226 8D-2 0.00000 0.29265 0.00000 -0.21275 0.00000
227 9D 0 0.45640 0.00000 0.49447 0.00000 0.35321
228 9D+1 0.00000 -0.15563 0.00000 0.03418 0.00000
229 9D-1 0.58257 0.00000 0.63403 0.00000 0.48944
230 9D+2 0.31209 0.00000 0.40508 0.00000 -0.00827
231 9D-2 0.00000 -0.38671 0.00000 0.30469 0.00000
232 10F 0 -0.01350 0.00000 -0.01463 0.00000 -0.03956
233 10F+1 0.00000 0.02052 0.00000 -0.03459 0.00000
234 10F-1 0.20572 0.00000 0.19496 0.00000 0.10262
235 10F+2 -0.12138 0.00000 -0.11236 0.00000 -0.06794
236 10F-2 0.00000 -0.06711 0.00000 0.03221 0.00000
237 10F+3 0.00000 0.12241 0.00000 -0.09317 0.00000
238 10F-3 0.10194 0.00000 0.10636 0.00000 -0.01250
239 7 H 1S -0.02319 0.04017 -0.05769 -0.09992 -0.02485
240 2S 0.02599 -0.04501 0.09626 0.16672 -0.00968
241 3S -0.05279 0.09143 0.02141 0.03708 1.10419
242 4S 0.00110 -0.00191 -0.12317 -0.21333 0.07884
243 5PX -0.00193 0.13664 -0.02216 -0.19521 -0.07890
244 5PY 0.13441 -0.00193 0.16962 0.02216 0.04555
245 5PZ 0.08774 -0.15198 0.06963 0.12061 -0.04732
246 6PX -0.01626 -0.15260 0.01929 0.25755 0.15232
247 6PY -0.17137 -0.01626 -0.23527 -0.01929 -0.08794
248 6PZ -0.12135 0.21018 -0.08990 -0.15572 0.04193
249 7PX -0.05774 -0.17194 0.05655 0.26350 0.18473
250 7PY -0.23861 -0.05774 -0.19820 -0.05655 -0.10666
251 7PZ -0.27624 0.47846 -0.39275 -0.68027 0.65956
252 8D 0 0.18445 -0.31948 0.18124 0.31391 -0.35999
253 8D+1 0.25814 -0.30923 0.22348 0.37398 -0.35987
254 8D-1 -0.01115 0.25814 -0.11593 -0.22348 0.20777
255 8D+2 0.14585 0.25427 0.07233 -0.24323 0.01475
256 8D-2 0.25427 -0.14775 0.24323 0.20853 -0.02555
257 9D 0 -0.22820 0.39525 -0.24724 -0.42823 0.35321
258 9D+1 -0.31965 0.39802 -0.28935 -0.46698 0.42386
259 9D-1 0.02892 -0.31965 0.13287 0.28935 -0.24472
260 9D+2 -0.21201 -0.30259 -0.12725 0.30734 0.00413
261 9D-2 -0.30259 0.13739 -0.30734 -0.22764 -0.00716
262 10F 0 0.00675 -0.01169 0.00732 0.01267 -0.03956
263 10F+1 -0.08020 0.15942 -0.06944 -0.15487 0.08887
264 10F-1 0.06682 -0.08020 0.07468 0.06944 -0.05131
265 10F+2 -0.08068 0.02350 -0.05225 -0.03471 0.03397
266 10F-2 0.02350 -0.10781 0.03471 0.09233 -0.05884
267 10F+3 -0.10601 -0.06120 -0.08069 0.04658 0.00000
268 10F-3 -0.05097 0.08828 -0.05318 -0.09211 -0.01250
269 8 H 1S -0.02319 -0.04017 -0.05769 0.09992 -0.02485
270 2S 0.02599 0.04501 0.09626 -0.16672 -0.00968
271 3S -0.05279 -0.09143 0.02141 -0.03708 1.10419
272 4S 0.00110 0.00191 -0.12317 0.21333 0.07884
273 5PX 0.00193 0.13664 0.02216 -0.19521 0.07890
274 5PY 0.13441 0.00193 0.16962 -0.02216 0.04555
275 5PZ 0.08774 0.15198 0.06963 -0.12061 -0.04732
276 6PX 0.01626 -0.15260 -0.01929 0.25755 -0.15232
277 6PY -0.17137 0.01626 -0.23527 0.01929 -0.08794
278 6PZ -0.12135 -0.21018 -0.08990 0.15572 0.04193
279 7PX 0.05774 -0.17194 -0.05655 0.26350 -0.18473
280 7PY -0.23861 0.05774 -0.19820 0.05655 -0.10666
281 7PZ -0.27624 -0.47846 -0.39275 0.68027 0.65956
282 8D 0 0.18445 0.31948 0.18124 -0.31391 -0.35999
283 8D+1 -0.25814 -0.30923 -0.22348 0.37398 0.35987
284 8D-1 -0.01115 -0.25814 -0.11593 0.22348 0.20777
285 8D+2 0.14585 -0.25427 0.07233 0.24323 0.01475
286 8D-2 -0.25427 -0.14775 -0.24323 0.20853 0.02555
287 9D 0 -0.22820 -0.39525 -0.24724 0.42823 0.35321
288 9D+1 0.31965 0.39802 0.28935 -0.46698 -0.42386
289 9D-1 0.02892 0.31965 0.13287 -0.28935 -0.24472
290 9D+2 -0.21201 0.30259 -0.12725 -0.30734 0.00413
291 9D-2 0.30259 0.13739 0.30734 -0.22764 0.00716
292 10F 0 0.00675 0.01169 0.00732 -0.01267 -0.03956
293 10F+1 0.08020 0.15942 0.06944 -0.15487 -0.08887
294 10F-1 0.06682 0.08020 0.07468 -0.06944 -0.05131
295 10F+2 -0.08068 -0.02350 -0.05225 0.03471 0.03397
296 10F-2 -0.02350 -0.10781 -0.03471 0.09233 0.05884
297 10F+3 0.10601 -0.06120 0.08069 0.04658 0.00000
298 10F-3 -0.05097 -0.08828 -0.05318 0.09211 -0.01250
281 282 283 284 285
(A2G)--V (EU)--V (EU)--V (EG)--V (EG)--V
Eigenvalues -- 9.07951 9.11624 9.11624 9.12583 9.12583
1 1 Si 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 -0.23831 0.00000 -0.19393 0.00000
8 7PY 0.00000 0.00000 -0.23831 0.00000 -0.19393
9 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 -0.27295 0.00000 -0.22594 0.00000
11 8PY 0.00000 0.00000 -0.27295 0.00000 -0.22594
12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 0.30863 0.00000 0.20550 0.00000
14 9PY 0.00000 0.00000 0.30863 0.00000 0.20550
15 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 -0.20927 0.00000 -0.30073 0.00000
17 10PY 0.00000 0.00000 -0.20927 0.00000 -0.30073
18 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 -0.11748 0.00000 -0.15352 0.00000
20 11PY 0.00000 0.00000 -0.11748 0.00000 -0.15352
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 -0.06473 0.00000 0.03972 0.00000
24 12D-1 0.00000 0.00000 -0.06473 0.00000 0.03972
25 12D+2 0.00000 0.00000 0.42517 0.00000 0.33200
26 12D-2 0.00000 0.42517 0.00000 0.33200 0.00000
27 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.37277 0.00000 0.39871 0.00000
29 13D-1 0.00000 0.00000 0.37277 0.00000 0.39871
30 13D+2 0.00000 0.00000 0.86525 0.00000 0.90605
31 13D-2 0.00000 0.86525 0.00000 0.90605 0.00000
32 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 -0.04853 0.00000 -0.06331 0.00000
34 14D-1 0.00000 0.00000 -0.04853 0.00000 -0.06331
35 14D+2 0.00000 0.00000 -0.01331 0.00000 -0.00989
36 14D-2 0.00000 -0.01331 0.00000 -0.00989 0.00000
37 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.13982 0.00000 0.14525 0.00000
39 15F-1 0.00000 0.00000 0.13982 0.00000 0.14525
40 15F+2 0.00000 0.00000 0.25924 0.00000 0.21921
41 15F-2 0.00000 0.25924 0.00000 0.21921 0.00000
42 15F+3 0.97119 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
44 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 0.01635 0.00000 0.11196 0.00000
46 16F-1 0.00000 0.00000 0.01635 0.00000 0.11196
47 16F+2 0.00000 0.00000 0.15582 0.00000 0.09647
48 16F-2 0.00000 0.15582 0.00000 0.09647 0.00000
49 16F+3 0.68563 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
51 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 -0.06622 0.00000 -0.07317 0.00000
53 17G-1 0.00000 0.00000 -0.06622 0.00000 -0.07317
54 17G+2 0.00000 0.00000 -0.03434 0.00000 -0.08635
55 17G-2 0.00000 -0.03434 0.00000 -0.08635 0.00000
56 17G+3 0.56545 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.21250 0.00000 0.14813
59 17G-4 0.00000 -0.21250 0.00000 -0.14813 0.00000
60 2 Si 1S 0.00000 0.00000 0.00000 0.00000 0.00000
61 2S 0.00000 0.00000 0.00000 0.00000 0.00000
62 3S 0.00000 0.00000 0.00000 0.00000 0.00000
63 4S 0.00000 0.00000 0.00000 0.00000 0.00000
64 5S 0.00000 0.00000 0.00000 0.00000 0.00000
65 6S 0.00000 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 -0.23831 0.00000 0.19393 0.00000
67 7PY 0.00000 0.00000 -0.23831 0.00000 0.19393
68 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 -0.27295 0.00000 0.22594 0.00000
70 8PY 0.00000 0.00000 -0.27295 0.00000 0.22594
71 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 0.30863 0.00000 -0.20550 0.00000
73 9PY 0.00000 0.00000 0.30863 0.00000 -0.20550
74 9PZ 0.00000 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 -0.20927 0.00000 0.30073 0.00000
76 10PY 0.00000 0.00000 -0.20927 0.00000 0.30073
77 10PZ 0.00000 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 -0.11748 0.00000 0.15352 0.00000
79 11PY 0.00000 0.00000 -0.11748 0.00000 0.15352
80 11PZ 0.00000 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.00000 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.06473 0.00000 0.03972 0.00000
83 12D-1 0.00000 0.00000 0.06473 0.00000 0.03972
84 12D+2 0.00000 0.00000 -0.42517 0.00000 0.33200
85 12D-2 0.00000 -0.42517 0.00000 0.33200 0.00000
86 13D 0 0.00000 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 -0.37277 0.00000 0.39871 0.00000
88 13D-1 0.00000 0.00000 -0.37277 0.00000 0.39871
89 13D+2 0.00000 0.00000 -0.86525 0.00000 0.90605
90 13D-2 0.00000 -0.86525 0.00000 0.90605 0.00000
91 14D 0 0.00000 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.04853 0.00000 -0.06331 0.00000
93 14D-1 0.00000 0.00000 0.04853 0.00000 -0.06331
94 14D+2 0.00000 0.00000 0.01331 0.00000 -0.00989
95 14D-2 0.00000 0.01331 0.00000 -0.00989 0.00000
96 15F 0 0.00000 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.13982 0.00000 -0.14525 0.00000
98 15F-1 0.00000 0.00000 0.13982 0.00000 -0.14525
99 15F+2 0.00000 0.00000 0.25924 0.00000 -0.21921
100 15F-2 0.00000 0.25924 0.00000 -0.21921 0.00000
101 15F+3 -0.97119 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.00000 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.01635 0.00000 -0.11196 0.00000
105 16F-1 0.00000 0.00000 0.01635 0.00000 -0.11196
106 16F+2 0.00000 0.00000 0.15582 0.00000 -0.09647
107 16F-2 0.00000 0.15582 0.00000 -0.09647 0.00000
108 16F+3 -0.68563 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00000 0.00000 0.00000 0.00000 0.00000
110 17G 0 0.00000 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.06622 0.00000 -0.07317 0.00000
112 17G-1 0.00000 0.00000 0.06622 0.00000 -0.07317
113 17G+2 0.00000 0.00000 0.03434 0.00000 -0.08635
114 17G-2 0.00000 0.03434 0.00000 -0.08635 0.00000
115 17G+3 0.56545 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 -0.21250 0.00000 0.14813
118 17G-4 0.00000 0.21250 0.00000 -0.14813 0.00000
119 3 H 1S 0.00000 0.00000 0.01724 0.00000 0.01920
120 2S 0.00000 0.00000 -0.09616 0.00000 -0.10204
121 3S 0.00000 0.00000 0.63106 0.00000 0.66147
122 4S 0.00000 0.00000 0.18945 0.00000 0.18624
123 5PX -0.28203 0.07943 0.00000 0.05761 0.00000
124 5PY 0.00000 0.00000 0.05033 0.00000 0.03734
125 5PZ 0.00000 0.00000 0.00193 0.00000 0.03089
126 6PX 0.39813 -0.05637 0.00000 -0.02592 0.00000
127 6PY 0.00000 0.00000 -0.04901 0.00000 -0.03606
128 6PZ 0.00000 0.00000 0.04121 0.00000 0.00192
129 7PX 0.66994 -0.69028 0.00000 -0.63407 0.00000
130 7PY 0.00000 0.00000 -0.10343 0.00000 -0.13123
131 7PZ 0.00000 0.00000 -0.29875 0.00000 -0.42459
132 8D 0 0.00000 0.00000 -0.14770 0.00000 -0.21007
133 8D+1 0.32551 -0.12463 0.00000 -0.10964 0.00000
134 8D-1 0.00000 0.00000 -0.26588 0.00000 -0.33406
135 8D+2 0.00000 0.00000 0.03186 0.00000 0.02929
136 8D-2 0.38341 -0.70699 0.00000 -0.66832 0.00000
137 9D 0 0.00000 0.00000 0.12725 0.00000 0.21230
138 9D+1 -0.37082 0.17725 0.00000 0.15557 0.00000
139 9D-1 0.00000 0.00000 0.25858 0.00000 0.36728
140 9D+2 0.00000 0.00000 -0.02636 0.00000 -0.02047
141 9D-2 -0.64989 0.79404 0.00000 0.73356 0.00000
142 10F 0 0.00000 0.00000 0.04942 0.00000 0.05118
143 10F+1 -0.03296 0.02564 0.00000 0.02694 0.00000
144 10F-1 0.00000 0.00000 -0.02985 0.00000 -0.07114
145 10F+2 0.00000 0.00000 0.02301 0.00000 0.05302
146 10F-2 0.12130 -0.08481 0.00000 -0.07369 0.00000
147 10F+3 -0.21683 0.18021 0.00000 0.15677 0.00000
148 10F-3 0.00000 0.00000 0.02973 0.00000 0.02116
149 4 H 1S 0.00000 -0.01493 -0.00862 -0.01663 -0.00960
150 2S 0.00000 0.08327 0.04808 0.08837 0.05102
151 3S 0.00000 -0.54651 -0.31553 -0.57285 -0.33074
152 4S 0.00000 -0.16407 -0.09473 -0.16129 -0.09312
153 5PX 0.14102 0.05761 -0.01260 0.04241 -0.00877
154 5PY -0.24425 -0.01260 0.07215 -0.00877 0.05254
155 5PZ 0.00000 -0.00168 -0.00097 -0.02675 -0.01544
156 6PX -0.19906 -0.05085 0.00319 -0.03352 -0.00439
157 6PY 0.34479 0.00319 -0.05453 -0.00439 -0.02845
158 6PZ 0.00000 -0.03569 -0.02061 -0.00166 -0.00096
159 7PX -0.33497 -0.25014 0.25411 -0.25694 0.21774
160 7PY 0.58018 0.25411 -0.54357 0.21774 -0.50836
161 7PZ 0.00000 0.25873 0.14938 0.36771 0.21229
162 8D 0 0.00000 0.12791 0.07385 0.18193 0.10504
163 8D+1 -0.16276 -0.23057 -0.06116 -0.27796 -0.09718
164 8D-1 0.28190 -0.06116 -0.15995 -0.09718 -0.16575
165 8D+2 0.33205 0.31993 -0.52228 0.30207 -0.49392
166 8D-2 -0.19171 -0.15285 0.31993 -0.14511 0.30207
167 9D 0 0.00000 -0.11020 -0.06363 -0.18386 -0.10615
168 9D+1 0.18541 0.23825 0.03522 0.31436 0.09167
169 9D-1 -0.32114 0.03522 0.19758 0.09167 0.20850
170 9D+2 -0.56282 -0.35524 0.58894 -0.32651 0.54505
171 9D-2 0.32495 0.17874 -0.35524 0.16804 -0.32651
172 10F 0 0.00000 -0.04280 -0.02471 -0.04432 -0.02559
173 10F+1 0.01648 -0.01597 -0.02403 -0.04662 -0.04247
174 10F-1 -0.02854 -0.02403 0.01177 -0.04247 0.00242
175 10F+2 0.10505 0.04669 -0.05786 0.05487 -0.04201
176 10F-2 -0.06065 -0.00394 0.04669 0.02135 0.05487
177 10F+3 -0.21683 -0.09011 0.15607 -0.07838 0.13577
178 10F-3 0.00000 -0.02575 -0.01487 -0.01833 -0.01058
179 5 H 1S 0.00000 0.01493 -0.00862 0.01663 -0.00960
180 2S 0.00000 -0.08327 0.04808 -0.08837 0.05102
181 3S 0.00000 0.54651 -0.31553 0.57285 -0.33074
182 4S 0.00000 0.16407 -0.09473 0.16129 -0.09312
183 5PX 0.14102 0.05761 0.01260 0.04241 0.00877
184 5PY 0.24425 0.01260 0.07215 0.00877 0.05254
185 5PZ 0.00000 0.00168 -0.00097 0.02675 -0.01544
186 6PX -0.19906 -0.05085 -0.00319 -0.03352 0.00439
187 6PY -0.34479 -0.00319 -0.05453 0.00439 -0.02845
188 6PZ 0.00000 0.03569 -0.02061 0.00166 -0.00096
189 7PX -0.33497 -0.25014 -0.25411 -0.25694 -0.21774
190 7PY -0.58018 -0.25411 -0.54357 -0.21774 -0.50836
191 7PZ 0.00000 -0.25873 0.14938 -0.36771 0.21229
192 8D 0 0.00000 -0.12791 0.07385 -0.18193 0.10504
193 8D+1 -0.16276 -0.23057 0.06116 -0.27796 0.09718
194 8D-1 -0.28190 0.06116 -0.15995 0.09718 -0.16575
195 8D+2 -0.33205 -0.31993 -0.52228 -0.30207 -0.49392
196 8D-2 -0.19171 -0.15285 -0.31993 -0.14511 -0.30207
197 9D 0 0.00000 0.11020 -0.06363 0.18386 -0.10615
198 9D+1 0.18541 0.23825 -0.03522 0.31436 -0.09167
199 9D-1 0.32114 -0.03522 0.19758 -0.09167 0.20850
200 9D+2 0.56282 0.35524 0.58894 0.32651 0.54505
201 9D-2 0.32495 0.17874 0.35524 0.16804 0.32651
202 10F 0 0.00000 0.04280 -0.02471 0.04432 -0.02559
203 10F+1 0.01648 -0.01597 0.02403 -0.04662 0.04247
204 10F-1 0.02854 0.02403 0.01177 0.04247 0.00242
205 10F+2 -0.10505 -0.04669 -0.05786 -0.05487 -0.04201
206 10F-2 -0.06065 -0.00394 -0.04669 0.02135 -0.05487
207 10F+3 -0.21683 -0.09011 -0.15607 -0.07838 -0.13577
208 10F-3 0.00000 0.02575 -0.01487 0.01833 -0.01058
209 6 H 1S 0.00000 0.00000 -0.01724 0.00000 0.01920
210 2S 0.00000 0.00000 0.09616 0.00000 -0.10204
211 3S 0.00000 0.00000 -0.63106 0.00000 0.66147
212 4S 0.00000 0.00000 -0.18945 0.00000 0.18624
213 5PX 0.28203 0.07943 0.00000 -0.05761 0.00000
214 5PY 0.00000 0.00000 0.05033 0.00000 -0.03734
215 5PZ 0.00000 0.00000 0.00193 0.00000 -0.03089
216 6PX -0.39813 -0.05637 0.00000 0.02592 0.00000
217 6PY 0.00000 0.00000 -0.04901 0.00000 0.03606
218 6PZ 0.00000 0.00000 0.04121 0.00000 -0.00192
219 7PX -0.66994 -0.69028 0.00000 0.63407 0.00000
220 7PY 0.00000 0.00000 -0.10343 0.00000 0.13123
221 7PZ 0.00000 0.00000 -0.29875 0.00000 0.42459
222 8D 0 0.00000 0.00000 0.14770 0.00000 -0.21007
223 8D+1 0.32551 0.12463 0.00000 -0.10964 0.00000
224 8D-1 0.00000 0.00000 0.26588 0.00000 -0.33406
225 8D+2 0.00000 0.00000 -0.03186 0.00000 0.02929
226 8D-2 0.38341 0.70699 0.00000 -0.66832 0.00000
227 9D 0 0.00000 0.00000 -0.12725 0.00000 0.21230
228 9D+1 -0.37082 -0.17725 0.00000 0.15557 0.00000
229 9D-1 0.00000 0.00000 -0.25858 0.00000 0.36728
230 9D+2 0.00000 0.00000 0.02636 0.00000 -0.02047
231 9D-2 -0.64989 -0.79404 0.00000 0.73356 0.00000
232 10F 0 0.00000 0.00000 0.04942 0.00000 -0.05118
233 10F+1 0.03296 0.02564 0.00000 -0.02694 0.00000
234 10F-1 0.00000 0.00000 -0.02985 0.00000 0.07114
235 10F+2 0.00000 0.00000 0.02301 0.00000 -0.05302
236 10F-2 -0.12130 -0.08481 0.00000 0.07369 0.00000
237 10F+3 0.21683 0.18021 0.00000 -0.15677 0.00000
238 10F-3 0.00000 0.00000 0.02973 0.00000 -0.02116
239 7 H 1S 0.00000 -0.01493 0.00862 0.01663 -0.00960
240 2S 0.00000 0.08327 -0.04808 -0.08837 0.05102
241 3S 0.00000 -0.54651 0.31553 0.57285 -0.33074
242 4S 0.00000 -0.16407 0.09473 0.16129 -0.09312
243 5PX -0.14102 0.05761 0.01260 -0.04241 -0.00877
244 5PY -0.24425 0.01260 0.07215 -0.00877 -0.05254
245 5PZ 0.00000 0.00168 -0.00097 -0.02675 0.01544
246 6PX 0.19906 -0.05085 -0.00319 0.03352 -0.00439
247 6PY 0.34479 -0.00319 -0.05453 -0.00439 0.02845
248 6PZ 0.00000 0.03569 -0.02061 -0.00166 0.00096
249 7PX 0.33497 -0.25014 -0.25411 0.25694 0.21774
250 7PY 0.58018 -0.25411 -0.54357 0.21774 0.50836
251 7PZ 0.00000 -0.25873 0.14938 0.36771 -0.21229
252 8D 0 0.00000 0.12791 -0.07385 -0.18193 0.10504
253 8D+1 -0.16276 0.23057 -0.06116 -0.27796 0.09718
254 8D-1 -0.28190 -0.06116 0.15995 0.09718 -0.16575
255 8D+2 -0.33205 0.31993 0.52228 -0.30207 -0.49392
256 8D-2 -0.19171 0.15285 0.31993 -0.14511 -0.30207
257 9D 0 0.00000 -0.11020 0.06363 0.18386 -0.10615
258 9D+1 0.18541 -0.23825 0.03522 0.31436 -0.09167
259 9D-1 0.32114 0.03522 -0.19758 -0.09167 0.20850
260 9D+2 0.56282 -0.35524 -0.58894 0.32651 0.54505
261 9D-2 0.32495 -0.17874 -0.35524 0.16804 0.32651
262 10F 0 0.00000 0.04280 -0.02471 -0.04432 0.02559
263 10F+1 -0.01648 -0.01597 0.02403 0.04662 -0.04247
264 10F-1 -0.02854 0.02403 0.01177 -0.04247 -0.00242
265 10F+2 0.10505 -0.04669 -0.05786 0.05487 0.04201
266 10F-2 0.06065 -0.00394 -0.04669 -0.02135 0.05487
267 10F+3 0.21683 -0.09011 -0.15607 0.07838 0.13577
268 10F-3 0.00000 0.02575 -0.01487 -0.01833 0.01058
269 8 H 1S 0.00000 0.01493 0.00862 -0.01663 -0.00960
270 2S 0.00000 -0.08327 -0.04808 0.08837 0.05102
271 3S 0.00000 0.54651 0.31553 -0.57285 -0.33074
272 4S 0.00000 0.16407 0.09473 -0.16129 -0.09312
273 5PX -0.14102 0.05761 -0.01260 -0.04241 0.00877
274 5PY 0.24425 -0.01260 0.07215 0.00877 -0.05254
275 5PZ 0.00000 -0.00168 -0.00097 0.02675 0.01544
276 6PX 0.19906 -0.05085 0.00319 0.03352 0.00439
277 6PY -0.34479 0.00319 -0.05453 0.00439 0.02845
278 6PZ 0.00000 -0.03569 -0.02061 0.00166 0.00096
279 7PX 0.33497 -0.25014 0.25411 0.25694 -0.21774
280 7PY -0.58018 0.25411 -0.54357 -0.21774 0.50836
281 7PZ 0.00000 0.25873 0.14938 -0.36771 -0.21229
282 8D 0 0.00000 -0.12791 -0.07385 0.18193 0.10504
283 8D+1 -0.16276 0.23057 0.06116 -0.27796 -0.09718
284 8D-1 0.28190 0.06116 0.15995 -0.09718 -0.16575
285 8D+2 0.33205 -0.31993 0.52228 0.30207 -0.49392
286 8D-2 -0.19171 0.15285 -0.31993 -0.14511 0.30207
287 9D 0 0.00000 0.11020 0.06363 -0.18386 -0.10615
288 9D+1 0.18541 -0.23825 -0.03522 0.31436 0.09167
289 9D-1 -0.32114 -0.03522 -0.19758 0.09167 0.20850
290 9D+2 -0.56282 0.35524 -0.58894 -0.32651 0.54505
291 9D-2 0.32495 -0.17874 0.35524 0.16804 -0.32651
292 10F 0 0.00000 -0.04280 -0.02471 0.04432 0.02559
293 10F+1 -0.01648 -0.01597 -0.02403 0.04662 0.04247
294 10F-1 0.02854 -0.02403 0.01177 0.04247 -0.00242
295 10F+2 -0.10505 0.04669 -0.05786 -0.05487 0.04201
296 10F-2 0.06065 -0.00394 0.04669 -0.02135 -0.05487
297 10F+3 0.21683 -0.09011 0.15607 0.07838 -0.13577
298 10F-3 0.00000 -0.02575 -0.01487 0.01833 0.01058
286 287 288 289 290
(A1G)--V (EG)--V (EG)--V (EU)--V (EU)--V
Eigenvalues -- 9.15479 9.34238 9.34238 9.38263 9.38263
1 1 Si 1S -0.02091 0.00000 0.00000 0.00000 0.00000
2 2S -0.22953 0.00000 0.00000 0.00000 0.00000
3 3S -0.31377 0.00000 0.00000 0.00000 0.00000
4 4S -0.56181 0.00000 0.00000 0.00000 0.00000
5 5S 0.99169 0.00000 0.00000 0.00000 0.00000
6 6S -0.01999 0.00000 0.00000 0.00000 0.00000
7 7PX 0.00000 0.03074 0.00000 0.09159 0.00000
8 7PY 0.00000 0.00000 -0.03074 0.00000 -0.09159
9 7PZ -0.70758 0.00000 0.00000 0.00000 0.00000
10 8PX 0.00000 0.10279 0.00000 0.16667 0.00000
11 8PY 0.00000 0.00000 -0.10279 0.00000 -0.16667
12 8PZ -0.77711 0.00000 0.00000 0.00000 0.00000
13 9PX 0.00000 1.00169 0.00000 0.91363 0.00000
14 9PY 0.00000 0.00000 -1.00169 0.00000 -0.91363
15 9PZ 1.52880 0.00000 0.00000 0.00000 0.00000
16 10PX 0.00000 1.72617 0.00000 1.39888 0.00000
17 10PY 0.00000 0.00000 -1.72617 0.00000 -1.39888
18 10PZ 0.42286 0.00000 0.00000 0.00000 0.00000
19 11PX 0.00000 0.16996 0.00000 0.24542 0.00000
20 11PY 0.00000 0.00000 -0.16996 0.00000 -0.24542
21 11PZ -0.17296 0.00000 0.00000 0.00000 0.00000
22 12D 0 0.44772 0.00000 0.00000 0.00000 0.00000
23 12D+1 0.00000 -0.00067 0.00000 0.19519 0.00000
24 12D-1 0.00000 0.00000 0.00067 0.00000 -0.19519
25 12D+2 0.00000 0.00000 0.23175 0.00000 0.42779
26 12D-2 0.00000 -0.23175 0.00000 -0.42779 0.00000
27 13D 0 0.40333 0.00000 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.30785 0.00000 0.29666 0.00000
29 13D-1 0.00000 0.00000 -0.30785 0.00000 -0.29666
30 13D+2 0.00000 0.00000 0.26963 0.00000 0.23125
31 13D-2 0.00000 -0.26963 0.00000 -0.23125 0.00000
32 14D 0 -0.09154 0.00000 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.20729 0.00000 0.18178 0.00000
34 14D-1 0.00000 0.00000 -0.20729 0.00000 -0.18178
35 14D+2 0.00000 0.00000 0.28220 0.00000 0.26589
36 14D-2 0.00000 -0.28220 0.00000 -0.26589 0.00000
37 15F 0 -0.44163 0.00000 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.10935 0.00000 -0.03101 0.00000
39 15F-1 0.00000 0.00000 -0.10935 0.00000 0.03101
40 15F+2 0.00000 0.00000 -0.10409 0.00000 -0.29099
41 15F-2 0.00000 0.10409 0.00000 0.29099 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.23896 0.00000 0.00000 0.00000 0.00000
44 16F 0 -0.16268 0.00000 0.00000 0.00000 0.00000
45 16F+1 0.00000 -0.05636 0.00000 0.04990 0.00000
46 16F-1 0.00000 0.00000 0.05636 0.00000 -0.04990
47 16F+2 0.00000 0.00000 -0.00866 0.00000 0.02655
48 16F-2 0.00000 0.00866 0.00000 -0.02655 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.05154 0.00000 0.00000 0.00000 0.00000
51 17G 0 -0.22052 0.00000 0.00000 0.00000 0.00000
52 17G+1 0.00000 0.12497 0.00000 0.12900 0.00000
53 17G-1 0.00000 0.00000 -0.12497 0.00000 -0.12900
54 17G+2 0.00000 0.00000 -0.06155 0.00000 0.02081
55 17G-2 0.00000 0.06155 0.00000 -0.02081 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.22953 0.00000 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.09727 0.00000 0.18331
59 17G-4 0.00000 0.09727 0.00000 0.18331 0.00000
60 2 Si 1S -0.02091 0.00000 0.00000 0.00000 0.00000
61 2S -0.22953 0.00000 0.00000 0.00000 0.00000
62 3S -0.31377 0.00000 0.00000 0.00000 0.00000
63 4S -0.56181 0.00000 0.00000 0.00000 0.00000
64 5S 0.99169 0.00000 0.00000 0.00000 0.00000
65 6S -0.01999 0.00000 0.00000 0.00000 0.00000
66 7PX 0.00000 -0.03074 0.00000 0.09159 0.00000
67 7PY 0.00000 0.00000 0.03074 0.00000 -0.09159
68 7PZ 0.70758 0.00000 0.00000 0.00000 0.00000
69 8PX 0.00000 -0.10279 0.00000 0.16667 0.00000
70 8PY 0.00000 0.00000 0.10279 0.00000 -0.16667
71 8PZ 0.77711 0.00000 0.00000 0.00000 0.00000
72 9PX 0.00000 -1.00169 0.00000 0.91363 0.00000
73 9PY 0.00000 0.00000 1.00169 0.00000 -0.91363
74 9PZ -1.52880 0.00000 0.00000 0.00000 0.00000
75 10PX 0.00000 -1.72617 0.00000 1.39888 0.00000
76 10PY 0.00000 0.00000 1.72617 0.00000 -1.39888
77 10PZ -0.42286 0.00000 0.00000 0.00000 0.00000
78 11PX 0.00000 -0.16996 0.00000 0.24542 0.00000
79 11PY 0.00000 0.00000 0.16996 0.00000 -0.24542
80 11PZ 0.17296 0.00000 0.00000 0.00000 0.00000
81 12D 0 0.44772 0.00000 0.00000 0.00000 0.00000
82 12D+1 0.00000 -0.00067 0.00000 -0.19519 0.00000
83 12D-1 0.00000 0.00000 0.00067 0.00000 0.19519
84 12D+2 0.00000 0.00000 0.23175 0.00000 -0.42779
85 12D-2 0.00000 -0.23175 0.00000 0.42779 0.00000
86 13D 0 0.40333 0.00000 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.30785 0.00000 -0.29666 0.00000
88 13D-1 0.00000 0.00000 -0.30785 0.00000 0.29666
89 13D+2 0.00000 0.00000 0.26963 0.00000 -0.23125
90 13D-2 0.00000 -0.26963 0.00000 0.23125 0.00000
91 14D 0 -0.09154 0.00000 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.20729 0.00000 -0.18178 0.00000
93 14D-1 0.00000 0.00000 -0.20729 0.00000 0.18178
94 14D+2 0.00000 0.00000 0.28220 0.00000 -0.26589
95 14D-2 0.00000 -0.28220 0.00000 0.26589 0.00000
96 15F 0 0.44163 0.00000 0.00000 0.00000 0.00000
97 15F+1 0.00000 -0.10935 0.00000 -0.03101 0.00000
98 15F-1 0.00000 0.00000 0.10935 0.00000 0.03101
99 15F+2 0.00000 0.00000 0.10409 0.00000 -0.29099
100 15F-2 0.00000 -0.10409 0.00000 0.29099 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 -0.23896 0.00000 0.00000 0.00000 0.00000
103 16F 0 0.16268 0.00000 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.05636 0.00000 0.04990 0.00000
105 16F-1 0.00000 0.00000 -0.05636 0.00000 -0.04990
106 16F+2 0.00000 0.00000 0.00866 0.00000 0.02655
107 16F-2 0.00000 -0.00866 0.00000 -0.02655 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 -0.05154 0.00000 0.00000 0.00000 0.00000
110 17G 0 -0.22052 0.00000 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.12497 0.00000 -0.12900 0.00000
112 17G-1 0.00000 0.00000 -0.12497 0.00000 0.12900
113 17G+2 0.00000 0.00000 -0.06155 0.00000 -0.02081
114 17G-2 0.00000 0.06155 0.00000 0.02081 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 -0.22953 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.09727 0.00000 -0.18331
118 17G-4 0.00000 0.09727 0.00000 -0.18331 0.00000
119 3 H 1S 0.00078 0.00000 0.38935 0.00000 0.43242
120 2S 0.00885 0.00000 -1.14866 0.00000 -1.24826
121 3S -0.40819 0.00000 2.46086 0.00000 2.36461
122 4S 0.04036 0.00000 0.40127 0.00000 0.57983
123 5PX 0.00000 -0.00117 0.00000 -0.02260 0.00000
124 5PY -0.05622 0.00000 0.00773 0.00000 -0.00789
125 5PZ 0.07907 0.00000 0.00059 0.00000 -0.07916
126 6PX 0.00000 0.04528 0.00000 0.07638 0.00000
127 6PY 0.10939 0.00000 0.20900 0.00000 0.25539
128 6PZ -0.05831 0.00000 0.08553 0.00000 0.22236
129 7PX 0.00000 -0.20071 0.00000 -0.16392 0.00000
130 7PY 0.40808 0.00000 -1.42954 0.00000 -1.37520
131 7PZ -0.41179 0.00000 -0.62155 0.00000 -0.68222
132 8D 0 -0.39227 0.00000 0.20831 0.00000 0.20052
133 8D+1 0.00000 0.05146 0.00000 0.09848 0.00000
134 8D-1 -0.33074 0.00000 -0.41835 0.00000 -0.43296
135 8D+2 -0.12362 0.00000 0.57419 0.00000 0.54791
136 8D-2 0.00000 -0.18640 0.00000 -0.17617 0.00000
137 9D 0 0.47367 0.00000 -0.23543 0.00000 -0.25615
138 9D+1 0.00000 -0.07342 0.00000 -0.13119 0.00000
139 9D-1 0.37574 0.00000 0.51528 0.00000 0.48168
140 9D+2 0.21207 0.00000 -0.67680 0.00000 -0.65019
141 9D-2 0.00000 0.18883 0.00000 0.15199 0.00000
142 10F 0 0.02239 0.00000 0.08283 0.00000 0.07192
143 10F+1 0.00000 0.02607 0.00000 0.03846 0.00000
144 10F-1 -0.15900 0.00000 0.02697 0.00000 0.06373
145 10F+2 0.05853 0.00000 0.12746 0.00000 0.09937
146 10F-2 0.00000 0.03791 0.00000 0.04689 0.00000
147 10F+3 0.00000 0.04568 0.00000 0.02018 0.00000
148 10F-3 -0.03708 0.00000 0.12771 0.00000 0.12836
149 4 H 1S 0.00078 0.33719 -0.19468 0.37449 -0.21621
150 2S 0.00885 -0.99477 0.57433 -1.08102 0.62413
151 3S -0.40819 2.13117 -1.23043 2.04781 -1.18230
152 4S 0.04036 0.34751 -0.20064 0.50214 -0.28991
153 5PX 0.04868 -0.00609 0.00284 0.00026 -0.01320
154 5PY 0.02811 -0.00284 0.00281 0.01320 0.01498
155 5PZ 0.07907 0.00051 -0.00029 -0.06855 0.03958
156 6PX -0.09474 -0.14543 0.11011 -0.17245 0.14366
157 6PY -0.05470 -0.11011 0.01829 -0.14366 0.00656
158 6PZ -0.05831 0.07407 -0.04277 0.19257 -0.11118
159 7PX -0.35341 1.02197 -0.70592 0.99042 -0.66646
160 7PY -0.20404 0.70592 -0.20685 0.66646 -0.22086
161 7PZ -0.41179 -0.53827 0.31077 -0.59082 0.34111
162 8D 0 -0.39227 0.18040 -0.10416 0.17365 -0.10026
163 8D+1 0.28643 0.32663 -0.15887 0.34934 -0.14484
164 8D-1 0.16537 0.15887 -0.14318 0.14484 -0.18210
165 8D+2 0.06181 -0.16792 0.28335 -0.16097 0.26911
166 8D-2 0.10706 -0.47725 0.16792 -0.45498 0.16097
167 9D 0 0.47367 -0.20388 0.11771 -0.22183 0.12807
168 9D+1 -0.32540 -0.40482 0.19133 -0.39406 0.15176
169 9D-1 -0.18787 -0.19133 0.18389 -0.15176 0.21882
170 9D+2 -0.10604 0.21130 -0.31082 0.21573 -0.27654
171 9D-2 -0.18366 0.55480 -0.21130 0.52564 -0.21573
172 10F 0 0.02239 0.07173 -0.04141 0.06228 -0.03596
173 10F+1 0.13770 -0.01371 0.02297 -0.03818 0.04425
174 10F-1 0.07950 -0.02297 -0.01281 -0.04425 -0.01291
175 10F+2 -0.02927 -0.07161 0.00343 -0.06333 -0.01032
176 10F-2 -0.05069 -0.08612 0.07161 -0.06281 0.06333
177 10F+3 0.00000 -0.02284 -0.03956 -0.01009 -0.01748
178 10F-3 -0.03708 0.11060 -0.06386 0.11117 -0.06418
179 5 H 1S 0.00078 -0.33719 -0.19468 -0.37449 -0.21621
180 2S 0.00885 0.99477 0.57433 1.08102 0.62413
181 3S -0.40819 -2.13117 -1.23043 -2.04781 -1.18230
182 4S 0.04036 -0.34751 -0.20064 -0.50214 -0.28991
183 5PX -0.04868 -0.00609 -0.00284 0.00026 0.01320
184 5PY 0.02811 0.00284 0.00281 -0.01320 0.01498
185 5PZ 0.07907 -0.00051 -0.00029 0.06855 0.03958
186 6PX 0.09474 -0.14543 -0.11011 -0.17245 -0.14366
187 6PY -0.05470 0.11011 0.01829 0.14366 0.00656
188 6PZ -0.05831 -0.07407 -0.04277 -0.19257 -0.11118
189 7PX 0.35341 1.02197 0.70592 0.99042 0.66646
190 7PY -0.20404 -0.70592 -0.20685 -0.66646 -0.22086
191 7PZ -0.41179 0.53827 0.31077 0.59082 0.34111
192 8D 0 -0.39227 -0.18040 -0.10416 -0.17365 -0.10026
193 8D+1 -0.28643 0.32663 0.15887 0.34934 0.14484
194 8D-1 0.16537 -0.15887 -0.14318 -0.14484 -0.18210
195 8D+2 0.06181 0.16792 0.28335 0.16097 0.26911
196 8D-2 -0.10706 -0.47725 -0.16792 -0.45498 -0.16097
197 9D 0 0.47367 0.20388 0.11771 0.22183 0.12807
198 9D+1 0.32540 -0.40482 -0.19133 -0.39406 -0.15176
199 9D-1 -0.18787 0.19133 0.18389 0.15176 0.21882
200 9D+2 -0.10604 -0.21130 -0.31082 -0.21573 -0.27654
201 9D-2 0.18366 0.55480 0.21130 0.52564 0.21573
202 10F 0 0.02239 -0.07173 -0.04141 -0.06228 -0.03596
203 10F+1 -0.13770 -0.01371 -0.02297 -0.03818 -0.04425
204 10F-1 0.07950 0.02297 -0.01281 0.04425 -0.01291
205 10F+2 -0.02927 0.07161 0.00343 0.06333 -0.01032
206 10F-2 0.05069 -0.08612 -0.07161 -0.06281 -0.06333
207 10F+3 0.00000 -0.02284 0.03956 -0.01009 0.01748
208 10F-3 -0.03708 -0.11060 -0.06386 -0.11117 -0.06418
209 6 H 1S 0.00078 0.00000 0.38935 0.00000 -0.43242
210 2S 0.00885 0.00000 -1.14866 0.00000 1.24826
211 3S -0.40819 0.00000 2.46086 0.00000 -2.36461
212 4S 0.04036 0.00000 0.40127 0.00000 -0.57983
213 5PX 0.00000 0.00117 0.00000 -0.02260 0.00000
214 5PY 0.05622 0.00000 -0.00773 0.00000 -0.00789
215 5PZ -0.07907 0.00000 -0.00059 0.00000 -0.07916
216 6PX 0.00000 -0.04528 0.00000 0.07638 0.00000
217 6PY -0.10939 0.00000 -0.20900 0.00000 0.25539
218 6PZ 0.05831 0.00000 -0.08553 0.00000 0.22236
219 7PX 0.00000 0.20071 0.00000 -0.16392 0.00000
220 7PY -0.40808 0.00000 1.42954 0.00000 -1.37520
221 7PZ 0.41179 0.00000 0.62155 0.00000 -0.68222
222 8D 0 -0.39227 0.00000 0.20831 0.00000 -0.20052
223 8D+1 0.00000 0.05146 0.00000 -0.09848 0.00000
224 8D-1 -0.33074 0.00000 -0.41835 0.00000 0.43296
225 8D+2 -0.12362 0.00000 0.57419 0.00000 -0.54791
226 8D-2 0.00000 -0.18640 0.00000 0.17617 0.00000
227 9D 0 0.47367 0.00000 -0.23543 0.00000 0.25615
228 9D+1 0.00000 -0.07342 0.00000 0.13119 0.00000
229 9D-1 0.37574 0.00000 0.51528 0.00000 -0.48168
230 9D+2 0.21207 0.00000 -0.67680 0.00000 0.65019
231 9D-2 0.00000 0.18883 0.00000 -0.15199 0.00000
232 10F 0 -0.02239 0.00000 -0.08283 0.00000 0.07192
233 10F+1 0.00000 -0.02607 0.00000 0.03846 0.00000
234 10F-1 0.15900 0.00000 -0.02697 0.00000 0.06373
235 10F+2 -0.05853 0.00000 -0.12746 0.00000 0.09937
236 10F-2 0.00000 -0.03791 0.00000 0.04689 0.00000
237 10F+3 0.00000 -0.04568 0.00000 0.02018 0.00000
238 10F-3 0.03708 0.00000 -0.12771 0.00000 0.12836
239 7 H 1S 0.00078 -0.33719 -0.19468 0.37449 0.21621
240 2S 0.00885 0.99477 0.57433 -1.08102 -0.62413
241 3S -0.40819 -2.13117 -1.23043 2.04781 1.18230
242 4S 0.04036 -0.34751 -0.20064 0.50214 0.28991
243 5PX 0.04868 0.00609 0.00284 0.00026 0.01320
244 5PY -0.02811 -0.00284 -0.00281 -0.01320 0.01498
245 5PZ -0.07907 0.00051 0.00029 0.06855 0.03958
246 6PX -0.09474 0.14543 0.11011 -0.17245 -0.14366
247 6PY 0.05470 -0.11011 -0.01829 0.14366 0.00656
248 6PZ 0.05831 0.07407 0.04277 -0.19257 -0.11118
249 7PX -0.35341 -1.02197 -0.70592 0.99042 0.66646
250 7PY 0.20404 0.70592 0.20685 -0.66646 -0.22086
251 7PZ 0.41179 -0.53827 -0.31077 0.59082 0.34111
252 8D 0 -0.39227 -0.18040 -0.10416 0.17365 0.10026
253 8D+1 -0.28643 0.32663 0.15887 -0.34934 -0.14484
254 8D-1 0.16537 -0.15887 -0.14318 0.14484 0.18210
255 8D+2 0.06181 0.16792 0.28335 -0.16097 -0.26911
256 8D-2 -0.10706 -0.47725 -0.16792 0.45498 0.16097
257 9D 0 0.47367 0.20388 0.11771 -0.22183 -0.12807
258 9D+1 0.32540 -0.40482 -0.19133 0.39406 0.15176
259 9D-1 -0.18787 0.19133 0.18389 -0.15176 -0.21882
260 9D+2 -0.10604 -0.21130 -0.31082 0.21573 0.27654
261 9D-2 0.18366 0.55480 0.21130 -0.52564 -0.21573
262 10F 0 -0.02239 0.07173 0.04141 -0.06228 -0.03596
263 10F+1 0.13770 0.01371 0.02297 -0.03818 -0.04425
264 10F-1 -0.07950 -0.02297 0.01281 0.04425 -0.01291
265 10F+2 0.02927 -0.07161 -0.00343 0.06333 -0.01032
266 10F-2 -0.05069 0.08612 0.07161 -0.06281 -0.06333
267 10F+3 0.00000 0.02284 -0.03956 -0.01009 0.01748
268 10F-3 0.03708 0.11060 0.06386 -0.11117 -0.06418
269 8 H 1S 0.00078 0.33719 -0.19468 -0.37449 0.21621
270 2S 0.00885 -0.99477 0.57433 1.08102 -0.62413
271 3S -0.40819 2.13117 -1.23043 -2.04781 1.18230
272 4S 0.04036 0.34751 -0.20064 -0.50214 0.28991
273 5PX -0.04868 0.00609 -0.00284 0.00026 -0.01320
274 5PY -0.02811 0.00284 -0.00281 0.01320 0.01498
275 5PZ -0.07907 -0.00051 0.00029 -0.06855 0.03958
276 6PX 0.09474 0.14543 -0.11011 -0.17245 0.14366
277 6PY 0.05470 0.11011 -0.01829 -0.14366 0.00656
278 6PZ 0.05831 -0.07407 0.04277 0.19257 -0.11118
279 7PX 0.35341 -1.02197 0.70592 0.99042 -0.66646
280 7PY 0.20404 -0.70592 0.20685 0.66646 -0.22086
281 7PZ 0.41179 0.53827 -0.31077 -0.59082 0.34111
282 8D 0 -0.39227 0.18040 -0.10416 -0.17365 0.10026
283 8D+1 0.28643 0.32663 -0.15887 -0.34934 0.14484
284 8D-1 0.16537 0.15887 -0.14318 -0.14484 0.18210
285 8D+2 0.06181 -0.16792 0.28335 0.16097 -0.26911
286 8D-2 0.10706 -0.47725 0.16792 0.45498 -0.16097
287 9D 0 0.47367 -0.20388 0.11771 0.22183 -0.12807
288 9D+1 -0.32540 -0.40482 0.19133 0.39406 -0.15176
289 9D-1 -0.18787 -0.19133 0.18389 0.15176 -0.21882
290 9D+2 -0.10604 0.21130 -0.31082 -0.21573 0.27654
291 9D-2 -0.18366 0.55480 -0.21130 -0.52564 0.21573
292 10F 0 -0.02239 -0.07173 0.04141 0.06228 -0.03596
293 10F+1 -0.13770 0.01371 -0.02297 -0.03818 0.04425
294 10F-1 -0.07950 0.02297 0.01281 -0.04425 -0.01291
295 10F+2 0.02927 0.07161 -0.00343 -0.06333 -0.01032
296 10F-2 0.05069 0.08612 -0.07161 -0.06281 0.06333
297 10F+3 0.00000 0.02284 0.03956 -0.01009 -0.01748
298 10F-3 0.03708 -0.11060 0.06386 0.11117 -0.06418
291 292 293 294 295
(A1G)--V (A2U)--V (EG)--V (EG)--V (EU)--V
Eigenvalues -- 9.49857 9.52150 10.45715 10.45715 10.48452
1 1 Si 1S 0.02774 0.00826 0.00000 0.00000 0.00000
2 2S 0.12252 -0.07333 0.00000 0.00000 0.00000
3 3S 0.47084 0.16305 0.00000 0.00000 0.00000
4 4S 0.16733 -1.74937 0.00000 0.00000 0.00000
5 5S 4.88640 9.38376 0.00000 0.00000 0.00000
6 6S 0.98267 0.50081 0.00000 0.00000 0.00000
7 7PX 0.00000 0.00000 -2.10047 0.00000 -2.17125
8 7PY 0.00000 0.00000 0.00000 2.10047 0.00000
9 7PZ 0.09901 -0.26761 0.00000 0.00000 0.00000
10 8PX 0.00000 0.00000 -2.21988 0.00000 -2.29349
11 8PY 0.00000 0.00000 0.00000 2.21988 0.00000
12 8PZ 0.13755 -0.25787 0.00000 0.00000 0.00000
13 9PX 0.00000 0.00000 4.92319 0.00000 5.17461
14 9PY 0.00000 0.00000 0.00000 -4.92319 0.00000
15 9PZ 0.35897 1.22627 0.00000 0.00000 0.00000
16 10PX 0.00000 0.00000 5.95197 0.00000 6.17650
17 10PY 0.00000 0.00000 0.00000 -5.95197 0.00000
18 10PZ 1.25722 1.44976 0.00000 0.00000 0.00000
19 11PX 0.00000 0.00000 0.29422 0.00000 0.32806
20 11PY 0.00000 0.00000 0.00000 -0.29422 0.00000
21 11PZ 0.16335 0.15574 0.00000 0.00000 0.00000
22 12D 0 -0.46267 -0.28483 0.00000 0.00000 0.00000
23 12D+1 0.00000 0.00000 0.58373 0.00000 1.00631
24 12D-1 0.00000 0.00000 0.00000 -0.58373 0.00000
25 12D+2 0.00000 0.00000 0.00000 1.17419 0.00000
26 12D-2 0.00000 0.00000 -1.17419 0.00000 -1.53217
27 13D 0 -0.52803 -0.45402 0.00000 0.00000 0.00000
28 13D+1 0.00000 0.00000 2.77275 0.00000 2.59491
29 13D-1 0.00000 0.00000 0.00000 -2.77275 0.00000
30 13D+2 0.00000 0.00000 0.00000 3.63275 0.00000
31 13D-2 0.00000 0.00000 -3.63275 0.00000 -3.57897
32 14D 0 -0.07982 -0.16111 0.00000 0.00000 0.00000
33 14D+1 0.00000 0.00000 0.01746 0.00000 0.05760
34 14D-1 0.00000 0.00000 0.00000 -0.01746 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.01382 0.00000
36 14D-2 0.00000 0.00000 -0.01382 0.00000 -0.06387
37 15F 0 -0.03567 -0.54499 0.00000 0.00000 0.00000
38 15F+1 0.00000 0.00000 -0.32222 0.00000 -0.45717
39 15F-1 0.00000 0.00000 0.00000 0.32222 0.00000
40 15F+2 0.00000 0.00000 0.00000 0.91581 0.00000
41 15F-2 0.00000 0.00000 -0.91581 0.00000 -0.92335
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.20943 -0.48961 0.00000 0.00000 0.00000
44 16F 0 -0.00841 -0.17868 0.00000 0.00000 0.00000
45 16F+1 0.00000 0.00000 -0.38055 0.00000 -0.40046
46 16F-1 0.00000 0.00000 0.00000 0.38055 0.00000
47 16F+2 0.00000 0.00000 0.00000 0.80987 0.00000
48 16F-2 0.00000 0.00000 -0.80987 0.00000 -0.76879
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 -0.01675 -0.16056 0.00000 0.00000 0.00000
51 17G 0 0.06668 -0.06886 0.00000 0.00000 0.00000
52 17G+1 0.00000 0.00000 -0.48914 0.00000 -0.45175
53 17G-1 0.00000 0.00000 0.00000 0.48914 0.00000
54 17G+2 0.00000 0.00000 0.00000 -0.04075 0.00000
55 17G-2 0.00000 0.00000 0.04075 0.00000 0.11750
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.31246 0.05698 0.00000 0.00000 0.00000
58 17G+4 0.00000 0.00000 0.00000 -0.56697 0.00000
59 17G-4 0.00000 0.00000 -0.56697 0.00000 -0.58296
60 2 Si 1S 0.02774 -0.00826 0.00000 0.00000 0.00000
61 2S 0.12252 0.07333 0.00000 0.00000 0.00000
62 3S 0.47084 -0.16305 0.00000 0.00000 0.00000
63 4S 0.16733 1.74937 0.00000 0.00000 0.00000
64 5S 4.88640 -9.38376 0.00000 0.00000 0.00000
65 6S 0.98267 -0.50081 0.00000 0.00000 0.00000
66 7PX 0.00000 0.00000 2.10047 0.00000 -2.17125
67 7PY 0.00000 0.00000 0.00000 -2.10047 0.00000
68 7PZ -0.09901 -0.26761 0.00000 0.00000 0.00000
69 8PX 0.00000 0.00000 2.21988 0.00000 -2.29349
70 8PY 0.00000 0.00000 0.00000 -2.21988 0.00000
71 8PZ -0.13755 -0.25787 0.00000 0.00000 0.00000
72 9PX 0.00000 0.00000 -4.92319 0.00000 5.17461
73 9PY 0.00000 0.00000 0.00000 4.92319 0.00000
74 9PZ -0.35897 1.22627 0.00000 0.00000 0.00000
75 10PX 0.00000 0.00000 -5.95197 0.00000 6.17650
76 10PY 0.00000 0.00000 0.00000 5.95197 0.00000
77 10PZ -1.25722 1.44976 0.00000 0.00000 0.00000
78 11PX 0.00000 0.00000 -0.29422 0.00000 0.32806
79 11PY 0.00000 0.00000 0.00000 0.29422 0.00000
80 11PZ -0.16335 0.15574 0.00000 0.00000 0.00000
81 12D 0 -0.46267 0.28483 0.00000 0.00000 0.00000
82 12D+1 0.00000 0.00000 0.58373 0.00000 -1.00631
83 12D-1 0.00000 0.00000 0.00000 -0.58373 0.00000
84 12D+2 0.00000 0.00000 0.00000 1.17419 0.00000
85 12D-2 0.00000 0.00000 -1.17419 0.00000 1.53217
86 13D 0 -0.52803 0.45402 0.00000 0.00000 0.00000
87 13D+1 0.00000 0.00000 2.77275 0.00000 -2.59491
88 13D-1 0.00000 0.00000 0.00000 -2.77275 0.00000
89 13D+2 0.00000 0.00000 0.00000 3.63275 0.00000
90 13D-2 0.00000 0.00000 -3.63275 0.00000 3.57897
91 14D 0 -0.07982 0.16111 0.00000 0.00000 0.00000
92 14D+1 0.00000 0.00000 0.01746 0.00000 -0.05760
93 14D-1 0.00000 0.00000 0.00000 -0.01746 0.00000
94 14D+2 0.00000 0.00000 0.00000 0.01382 0.00000
95 14D-2 0.00000 0.00000 -0.01382 0.00000 0.06387
96 15F 0 0.03567 -0.54499 0.00000 0.00000 0.00000
97 15F+1 0.00000 0.00000 0.32222 0.00000 -0.45717
98 15F-1 0.00000 0.00000 0.00000 -0.32222 0.00000
99 15F+2 0.00000 0.00000 0.00000 -0.91581 0.00000
100 15F-2 0.00000 0.00000 0.91581 0.00000 -0.92335
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.20943 -0.48961 0.00000 0.00000 0.00000
103 16F 0 0.00841 -0.17868 0.00000 0.00000 0.00000
104 16F+1 0.00000 0.00000 0.38055 0.00000 -0.40046
105 16F-1 0.00000 0.00000 0.00000 -0.38055 0.00000
106 16F+2 0.00000 0.00000 0.00000 -0.80987 0.00000
107 16F-2 0.00000 0.00000 0.80987 0.00000 -0.76879
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.01675 -0.16056 0.00000 0.00000 0.00000
110 17G 0 0.06668 0.06886 0.00000 0.00000 0.00000
111 17G+1 0.00000 0.00000 -0.48914 0.00000 0.45175
112 17G-1 0.00000 0.00000 0.00000 0.48914 0.00000
113 17G+2 0.00000 0.00000 0.00000 -0.04075 0.00000
114 17G-2 0.00000 0.00000 0.04075 0.00000 -0.11750
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.31246 -0.05698 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.00000 -0.56697 0.00000
118 17G-4 0.00000 0.00000 -0.56697 0.00000 0.58296
119 3 H 1S -0.34346 -0.30080 0.00000 -0.47124 0.00000
120 2S 1.05359 0.99607 0.00000 0.55713 0.00000
121 3S -2.56244 -3.79852 0.00000 7.73973 0.00000
122 4S -0.43266 -0.33880 0.00000 0.86311 0.00000
123 5PX 0.00000 0.00000 0.04724 0.00000 0.06261
124 5PY 0.01412 -0.07539 0.00000 0.81684 0.00000
125 5PZ -0.02459 -0.01543 0.00000 0.28469 0.00000
126 6PX 0.00000 0.00000 -0.10881 0.00000 -0.13671
127 6PY -0.24607 -0.03625 0.00000 -1.87280 0.00000
128 6PZ -0.02678 -0.01407 0.00000 -0.66929 0.00000
129 7PX 0.00000 0.00000 0.05627 0.00000 0.07788
130 7PY 1.37010 1.88758 0.00000 -2.92558 0.00000
131 7PZ 0.56780 0.56919 0.00000 -1.20569 0.00000
132 8D 0 -0.18482 -0.25255 0.00000 0.06324 0.00000
133 8D+1 0.00000 0.00000 -0.01539 0.00000 -0.01732
134 8D-1 0.33875 0.25493 0.00000 -0.10611 0.00000
135 8D+2 -0.37983 -0.41998 0.00000 0.14904 0.00000
136 8D-2 0.00000 0.00000 0.00979 0.00000 -0.00248
137 9D 0 0.19124 0.34185 0.00000 -0.36942 0.00000
138 9D+1 0.00000 0.00000 0.08641 0.00000 0.08591
139 9D-1 -0.43442 -0.34839 0.00000 0.72545 0.00000
140 9D+2 0.42754 0.58078 0.00000 -0.92728 0.00000
141 9D-2 0.00000 0.00000 0.06080 0.00000 0.09081
142 10F 0 -0.04372 -0.02364 0.00000 0.08561 0.00000
143 10F+1 0.00000 0.00000 -0.02254 0.00000 -0.02659
144 10F-1 -0.00929 -0.06854 0.00000 0.02177 0.00000
145 10F+2 -0.07102 -0.05794 0.00000 0.12182 0.00000
146 10F-2 0.00000 0.00000 -0.07699 0.00000 -0.07470
147 10F+3 0.00000 0.00000 0.02534 0.00000 0.04213
148 10F-3 -0.02099 -0.05337 0.00000 0.10359 0.00000
149 4 H 1S -0.34346 -0.30080 -0.40811 0.23562 -0.34956
150 2S 1.05359 0.99607 0.48249 -0.27857 0.31102
151 3S -2.56244 -3.79852 6.70280 -3.86986 7.10620
152 4S -0.43266 -0.33880 0.74747 -0.43155 0.94270
153 5PX -0.01223 0.06529 -0.60082 0.37416 -0.56929
154 5PY -0.00706 0.03769 -0.37416 0.16878 -0.36483
155 5PZ -0.02459 -0.01543 0.24655 -0.14235 0.29644
156 6PX 0.21311 0.03140 1.37740 -0.85806 1.30278
157 6PY 0.12304 0.01813 0.85806 -0.38659 0.83109
158 6PZ -0.02678 -0.01407 -0.57962 0.33464 -0.65536
159 7PX -1.18654 -1.63469 2.20825 -1.24245 2.33258
160 7PY -0.68505 -0.94379 1.24245 -0.77360 1.30175
161 7PZ 0.56780 0.56919 -1.04415 0.60284 -1.09286
162 8D 0 -0.18482 -0.25255 0.05477 -0.03162 0.02665
163 8D+1 -0.29337 -0.22077 0.07574 -0.05261 0.12218
164 8D-1 -0.16938 -0.12746 0.05261 -0.01498 0.08054
165 8D+2 0.18992 0.20999 -0.06877 0.02992 -0.06886
166 8D-2 0.32895 0.36371 -0.10933 0.06877 -0.12175
167 9D 0 0.19124 0.34185 -0.31993 0.18471 -0.26893
168 9D+1 0.37622 0.30172 -0.52248 0.35154 -0.61671
169 9D-1 0.21721 0.17420 -0.35154 0.11655 -0.40566
170 9D+2 -0.21377 -0.29039 0.37520 -0.27742 0.36819
171 9D-2 -0.37026 -0.50297 0.71066 -0.37520 0.72853
172 10F 0 -0.04372 -0.02364 0.07414 -0.04280 0.07633
173 10F+1 0.00804 0.05935 -0.02196 -0.00033 -0.00294
174 10F-1 0.00464 0.03427 0.00033 0.02234 0.01366
175 10F+2 0.03551 0.02897 -0.01941 0.08819 -0.03140
176 10F-2 0.06151 0.05018 -0.11061 0.01941 -0.12908
177 10F+3 0.00000 0.00000 -0.01267 -0.02194 -0.02106
178 10F-3 -0.02099 -0.05337 0.08971 -0.05180 0.09325
179 5 H 1S -0.34346 -0.30080 0.40811 0.23562 0.34956
180 2S 1.05359 0.99607 -0.48249 -0.27857 -0.31102
181 3S -2.56244 -3.79852 -6.70280 -3.86986 -7.10620
182 4S -0.43266 -0.33880 -0.74747 -0.43155 -0.94270
183 5PX 0.01223 -0.06529 -0.60082 -0.37416 -0.56929
184 5PY -0.00706 0.03769 0.37416 0.16878 0.36483
185 5PZ -0.02459 -0.01543 -0.24655 -0.14235 -0.29644
186 6PX -0.21311 -0.03140 1.37740 0.85806 1.30278
187 6PY 0.12304 0.01813 -0.85806 -0.38659 -0.83109
188 6PZ -0.02678 -0.01407 0.57962 0.33464 0.65536
189 7PX 1.18654 1.63469 2.20825 1.24245 2.33258
190 7PY -0.68505 -0.94379 -1.24245 -0.77360 -1.30175
191 7PZ 0.56780 0.56919 1.04415 0.60284 1.09286
192 8D 0 -0.18482 -0.25255 -0.05477 -0.03162 -0.02665
193 8D+1 0.29337 0.22077 0.07574 0.05261 0.12218
194 8D-1 -0.16938 -0.12746 -0.05261 -0.01498 -0.08054
195 8D+2 0.18992 0.20999 0.06877 0.02992 0.06886
196 8D-2 -0.32895 -0.36371 -0.10933 -0.06877 -0.12175
197 9D 0 0.19124 0.34185 0.31993 0.18471 0.26893
198 9D+1 -0.37622 -0.30172 -0.52248 -0.35154 -0.61671
199 9D-1 0.21721 0.17420 0.35154 0.11655 0.40566
200 9D+2 -0.21377 -0.29039 -0.37520 -0.27742 -0.36819
201 9D-2 0.37026 0.50297 0.71066 0.37520 0.72853
202 10F 0 -0.04372 -0.02364 -0.07414 -0.04280 -0.07633
203 10F+1 -0.00804 -0.05935 -0.02196 0.00033 -0.00294
204 10F-1 0.00464 0.03427 -0.00033 0.02234 -0.01366
205 10F+2 0.03551 0.02897 0.01941 0.08819 0.03140
206 10F-2 -0.06151 -0.05018 -0.11061 -0.01941 -0.12908
207 10F+3 0.00000 0.00000 -0.01267 0.02194 -0.02106
208 10F-3 -0.02099 -0.05337 -0.08971 -0.05180 -0.09325
209 6 H 1S -0.34346 0.30080 0.00000 -0.47124 0.00000
210 2S 1.05359 -0.99607 0.00000 0.55713 0.00000
211 3S -2.56244 3.79852 0.00000 7.73973 0.00000
212 4S -0.43266 0.33880 0.00000 0.86311 0.00000
213 5PX 0.00000 0.00000 -0.04724 0.00000 0.06261
214 5PY -0.01412 -0.07539 0.00000 -0.81684 0.00000
215 5PZ 0.02459 -0.01543 0.00000 -0.28469 0.00000
216 6PX 0.00000 0.00000 0.10881 0.00000 -0.13671
217 6PY 0.24607 -0.03625 0.00000 1.87280 0.00000
218 6PZ 0.02678 -0.01407 0.00000 0.66929 0.00000
219 7PX 0.00000 0.00000 -0.05627 0.00000 0.07788
220 7PY -1.37010 1.88758 0.00000 2.92558 0.00000
221 7PZ -0.56780 0.56919 0.00000 1.20569 0.00000
222 8D 0 -0.18482 0.25255 0.00000 0.06324 0.00000
223 8D+1 0.00000 0.00000 -0.01539 0.00000 0.01732
224 8D-1 0.33875 -0.25493 0.00000 -0.10611 0.00000
225 8D+2 -0.37983 0.41998 0.00000 0.14904 0.00000
226 8D-2 0.00000 0.00000 0.00979 0.00000 0.00248
227 9D 0 0.19124 -0.34185 0.00000 -0.36942 0.00000
228 9D+1 0.00000 0.00000 0.08641 0.00000 -0.08591
229 9D-1 -0.43442 0.34839 0.00000 0.72545 0.00000
230 9D+2 0.42754 -0.58078 0.00000 -0.92728 0.00000
231 9D-2 0.00000 0.00000 0.06080 0.00000 -0.09081
232 10F 0 0.04372 -0.02364 0.00000 -0.08561 0.00000
233 10F+1 0.00000 0.00000 0.02254 0.00000 -0.02659
234 10F-1 0.00929 -0.06854 0.00000 -0.02177 0.00000
235 10F+2 0.07102 -0.05794 0.00000 -0.12182 0.00000
236 10F-2 0.00000 0.00000 0.07699 0.00000 -0.07470
237 10F+3 0.00000 0.00000 -0.02534 0.00000 0.04213
238 10F-3 0.02099 -0.05337 0.00000 -0.10359 0.00000
239 7 H 1S -0.34346 0.30080 0.40811 0.23562 -0.34956
240 2S 1.05359 -0.99607 -0.48249 -0.27857 0.31102
241 3S -2.56244 3.79852 -6.70280 -3.86986 7.10620
242 4S -0.43266 0.33880 -0.74747 -0.43155 0.94270
243 5PX -0.01223 -0.06529 0.60082 0.37416 -0.56929
244 5PY 0.00706 0.03769 -0.37416 -0.16878 0.36483
245 5PZ 0.02459 -0.01543 0.24655 0.14235 -0.29644
246 6PX 0.21311 -0.03140 -1.37740 -0.85806 1.30278
247 6PY -0.12304 0.01813 0.85806 0.38659 -0.83109
248 6PZ 0.02678 -0.01407 -0.57962 -0.33464 0.65536
249 7PX -1.18654 1.63469 -2.20825 -1.24245 2.33258
250 7PY 0.68505 -0.94379 1.24245 0.77360 -1.30175
251 7PZ -0.56780 0.56919 -1.04415 -0.60284 1.09286
252 8D 0 -0.18482 0.25255 -0.05477 -0.03162 0.02665
253 8D+1 0.29337 -0.22077 0.07574 0.05261 -0.12218
254 8D-1 -0.16938 0.12746 -0.05261 -0.01498 0.08054
255 8D+2 0.18992 -0.20999 0.06877 0.02992 -0.06886
256 8D-2 -0.32895 0.36371 -0.10933 -0.06877 0.12175
257 9D 0 0.19124 -0.34185 0.31993 0.18471 -0.26893
258 9D+1 -0.37622 0.30172 -0.52248 -0.35154 0.61671
259 9D-1 0.21721 -0.17420 0.35154 0.11655 -0.40566
260 9D+2 -0.21377 0.29039 -0.37520 -0.27742 0.36819
261 9D-2 0.37026 -0.50297 0.71066 0.37520 -0.72853
262 10F 0 0.04372 -0.02364 0.07414 0.04280 -0.07633
263 10F+1 0.00804 -0.05935 0.02196 -0.00033 -0.00294
264 10F-1 -0.00464 0.03427 0.00033 -0.02234 -0.01366
265 10F+2 -0.03551 0.02897 -0.01941 -0.08819 0.03140
266 10F-2 0.06151 -0.05018 0.11061 0.01941 -0.12908
267 10F+3 0.00000 0.00000 0.01267 -0.02194 -0.02106
268 10F-3 0.02099 -0.05337 0.08971 0.05180 -0.09325
269 8 H 1S -0.34346 0.30080 -0.40811 0.23562 0.34956
270 2S 1.05359 -0.99607 0.48249 -0.27857 -0.31102
271 3S -2.56244 3.79852 6.70280 -3.86986 -7.10620
272 4S -0.43266 0.33880 0.74747 -0.43155 -0.94270
273 5PX 0.01223 0.06529 0.60082 -0.37416 -0.56929
274 5PY 0.00706 0.03769 0.37416 -0.16878 -0.36483
275 5PZ 0.02459 -0.01543 -0.24655 0.14235 0.29644
276 6PX -0.21311 0.03140 -1.37740 0.85806 1.30278
277 6PY -0.12304 0.01813 -0.85806 0.38659 0.83109
278 6PZ 0.02678 -0.01407 0.57962 -0.33464 -0.65536
279 7PX 1.18654 -1.63469 -2.20825 1.24245 2.33258
280 7PY 0.68505 -0.94379 -1.24245 0.77360 1.30175
281 7PZ -0.56780 0.56919 1.04415 -0.60284 -1.09286
282 8D 0 -0.18482 0.25255 0.05477 -0.03162 -0.02665
283 8D+1 -0.29337 0.22077 0.07574 -0.05261 -0.12218
284 8D-1 -0.16938 0.12746 0.05261 -0.01498 -0.08054
285 8D+2 0.18992 -0.20999 -0.06877 0.02992 0.06886
286 8D-2 0.32895 -0.36371 -0.10933 0.06877 0.12175
287 9D 0 0.19124 -0.34185 -0.31993 0.18471 0.26893
288 9D+1 0.37622 -0.30172 -0.52248 0.35154 0.61671
289 9D-1 0.21721 -0.17420 -0.35154 0.11655 0.40566
290 9D+2 -0.21377 0.29039 0.37520 -0.27742 -0.36819
291 9D-2 -0.37026 0.50297 0.71066 -0.37520 -0.72853
292 10F 0 0.04372 -0.02364 -0.07414 0.04280 0.07633
293 10F+1 -0.00804 0.05935 0.02196 0.00033 -0.00294
294 10F-1 -0.00464 0.03427 -0.00033 -0.02234 0.01366
295 10F+2 -0.03551 0.02897 0.01941 -0.08819 -0.03140
296 10F-2 -0.06151 0.05018 0.11061 -0.01941 -0.12908
297 10F+3 0.00000 0.00000 0.01267 0.02194 -0.02106
298 10F-3 0.02099 -0.05337 -0.08971 0.05180 0.09325
296 297 298
(EU)--V (A1G)--V (A2U)--V
Eigenvalues -- 10.48452 13.12729 13.40348
1 1 Si 1S 0.00000 0.33921 0.34803
2 2S 0.00000 2.74890 2.79375
3 3S 0.00000 4.79718 4.92672
4 4S 0.00000 1.71155 2.52369
5 5S 0.00000 8.83619 7.58813
6 6S 0.00000 1.13310 -1.35737
7 7PX 0.00000 0.00000 0.00000
8 7PY 2.17125 0.00000 0.00000
9 7PZ 0.00000 -0.82638 -0.89679
10 8PX 0.00000 0.00000 0.00000
11 8PY 2.29349 0.00000 0.00000
12 8PZ 0.00000 -0.84112 -0.92121
13 9PX 0.00000 0.00000 0.00000
14 9PY -5.17461 0.00000 0.00000
15 9PZ 0.00000 2.17721 1.94787
16 10PX 0.00000 0.00000 0.00000
17 10PY -6.17650 0.00000 0.00000
18 10PZ 0.00000 2.32934 5.75497
19 11PX 0.00000 0.00000 0.00000
20 11PY -0.32806 0.00000 0.00000
21 11PZ 0.00000 0.06855 0.77058
22 12D 0 0.00000 -0.48620 -1.64255
23 12D+1 0.00000 0.00000 0.00000
24 12D-1 -1.00631 0.00000 0.00000
25 12D+2 1.53217 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000
27 13D 0 0.00000 -1.54258 -2.64749
28 13D+1 0.00000 0.00000 0.00000
29 13D-1 -2.59491 0.00000 0.00000
30 13D+2 3.57897 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000
32 14D 0 0.00000 -0.11319 0.10890
33 14D+1 0.00000 0.00000 0.00000
34 14D-1 -0.05760 0.00000 0.00000
35 14D+2 0.06387 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000
37 15F 0 0.00000 -0.39180 -0.06646
38 15F+1 0.00000 0.00000 0.00000
39 15F-1 0.45717 0.00000 0.00000
40 15F+2 0.92335 0.00000 0.00000
41 15F-2 0.00000 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000
43 15F-3 0.00000 -0.74521 -0.99661
44 16F 0 0.00000 -0.86633 -0.75895
45 16F+1 0.00000 0.00000 0.00000
46 16F-1 0.40046 0.00000 0.00000
47 16F+2 0.76879 0.00000 0.00000
48 16F-2 0.00000 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000
50 16F-3 0.00000 -1.22465 -1.27327
51 17G 0 0.00000 -0.12858 -0.15738
52 17G+1 0.00000 0.00000 0.00000
53 17G-1 0.45175 0.00000 0.00000
54 17G+2 -0.11750 0.00000 0.00000
55 17G-2 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000
57 17G-3 0.00000 -0.57927 -0.60352
58 17G+4 -0.58296 0.00000 0.00000
59 17G-4 0.00000 0.00000 0.00000
60 2 Si 1S 0.00000 0.33921 -0.34803
61 2S 0.00000 2.74890 -2.79375
62 3S 0.00000 4.79718 -4.92672
63 4S 0.00000 1.71155 -2.52369
64 5S 0.00000 8.83619 -7.58813
65 6S 0.00000 1.13310 1.35737
66 7PX 0.00000 0.00000 0.00000
67 7PY 2.17125 0.00000 0.00000
68 7PZ 0.00000 0.82638 -0.89679
69 8PX 0.00000 0.00000 0.00000
70 8PY 2.29349 0.00000 0.00000
71 8PZ 0.00000 0.84112 -0.92121
72 9PX 0.00000 0.00000 0.00000
73 9PY -5.17461 0.00000 0.00000
74 9PZ 0.00000 -2.17721 1.94787
75 10PX 0.00000 0.00000 0.00000
76 10PY -6.17650 0.00000 0.00000
77 10PZ 0.00000 -2.32934 5.75497
78 11PX 0.00000 0.00000 0.00000
79 11PY -0.32806 0.00000 0.00000
80 11PZ 0.00000 -0.06855 0.77058
81 12D 0 0.00000 -0.48620 1.64255
82 12D+1 0.00000 0.00000 0.00000
83 12D-1 1.00631 0.00000 0.00000
84 12D+2 -1.53217 0.00000 0.00000
85 12D-2 0.00000 0.00000 0.00000
86 13D 0 0.00000 -1.54258 2.64749
87 13D+1 0.00000 0.00000 0.00000
88 13D-1 2.59491 0.00000 0.00000
89 13D+2 -3.57897 0.00000 0.00000
90 13D-2 0.00000 0.00000 0.00000
91 14D 0 0.00000 -0.11319 -0.10890
92 14D+1 0.00000 0.00000 0.00000
93 14D-1 0.05760 0.00000 0.00000
94 14D+2 -0.06387 0.00000 0.00000
95 14D-2 0.00000 0.00000 0.00000
96 15F 0 0.00000 0.39180 -0.06646
97 15F+1 0.00000 0.00000 0.00000
98 15F-1 0.45717 0.00000 0.00000
99 15F+2 0.92335 0.00000 0.00000
100 15F-2 0.00000 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000
102 15F-3 0.00000 0.74521 -0.99661
103 16F 0 0.00000 0.86633 -0.75895
104 16F+1 0.00000 0.00000 0.00000
105 16F-1 0.40046 0.00000 0.00000
106 16F+2 0.76879 0.00000 0.00000
107 16F-2 0.00000 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000
109 16F-3 0.00000 1.22465 -1.27327
110 17G 0 0.00000 -0.12858 0.15738
111 17G+1 0.00000 0.00000 0.00000
112 17G-1 -0.45175 0.00000 0.00000
113 17G+2 0.11750 0.00000 0.00000
114 17G-2 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000
116 17G-3 0.00000 -0.57927 0.60352
117 17G+4 0.58296 0.00000 0.00000
118 17G-4 0.00000 0.00000 0.00000
119 3 H 1S -0.40364 0.22400 0.21830
120 2S 0.35914 -0.19431 -0.16217
121 3S 8.20554 -4.20175 -4.81477
122 4S 1.08854 -0.42592 -0.38491
123 5PX 0.00000 0.00000 0.00000
124 5PY 0.77992 -0.39502 -0.39840
125 5PZ 0.34230 -0.12524 -0.15321
126 6PX 0.00000 0.00000 0.00000
127 6PY -1.78261 1.01827 1.04921
128 6PZ -0.75674 0.32517 0.38407
129 7PX 0.00000 0.00000 0.00000
130 7PY -3.08415 1.86104 2.00168
131 7PZ -1.26193 0.64905 0.77029
132 8D 0 0.03077 -0.03724 -0.02501
133 8D+1 0.00000 0.00000 0.00000
134 8D-1 -0.16869 0.05457 0.06118
135 8D+2 0.16151 -0.08612 -0.07836
136 8D-2 0.00000 0.00000 0.00000
137 9D 0 -0.31054 0.30999 0.27487
138 9D+1 0.00000 0.00000 0.00000
139 9D-1 0.85091 -0.45232 -0.49755
140 9D+2 -0.94110 0.70645 0.70100
141 9D-2 0.00000 0.00000 0.00000
142 10F 0 0.08814 -0.08186 -0.08308
143 10F+1 0.00000 0.00000 0.00000
144 10F-1 -0.00495 -0.05778 -0.04035
145 10F+2 0.14720 -0.11906 -0.12123
146 10F-2 0.00000 0.00000 0.00000
147 10F+3 0.00000 0.00000 0.00000
148 10F-3 0.10768 -0.16592 -0.15618
149 4 H 1S 0.20182 0.22400 0.21830
150 2S -0.17957 -0.19431 -0.16217
151 3S -4.10277 -4.20175 -4.81477
152 4S -0.54427 -0.42592 -0.38491
153 5PX 0.36483 0.34210 0.34503
154 5PY 0.14803 0.19751 0.19920
155 5PZ -0.17115 -0.12524 -0.15321
156 6PX -0.83109 -0.88185 -0.90865
157 6PY -0.34312 -0.50913 -0.52461
158 6PZ 0.37837 0.32517 0.38407
159 7PX -1.30175 -1.61171 -1.73350
160 7PY -0.82945 -0.93052 -1.00084
161 7PZ 0.63096 0.64905 0.77029
162 8D 0 -0.01538 -0.03724 -0.02501
163 8D+1 -0.08054 -0.04726 -0.05298
164 8D-1 -0.02918 -0.02729 -0.03059
165 8D+2 0.04224 0.04306 0.03918
166 8D-2 0.06886 0.07459 0.06787
167 9D 0 0.15527 0.30999 0.27487
168 9D+1 0.40566 0.39172 0.43089
169 9D-1 0.14829 0.22616 0.24878
170 9D+2 -0.30338 -0.35322 -0.35050
171 9D-2 -0.36819 -0.61180 -0.60708
172 10F 0 -0.04407 -0.08186 -0.08308
173 10F+1 -0.01366 0.05004 0.03495
174 10F-1 0.01871 0.02889 0.02018
175 10F+2 0.09282 0.05953 0.06062
176 10F-2 0.03140 0.10311 0.10499
177 10F+3 -0.03648 0.00000 0.00000
178 10F-3 -0.05384 -0.16592 -0.15618
179 5 H 1S 0.20182 0.22400 0.21830
180 2S -0.17957 -0.19431 -0.16217
181 3S -4.10277 -4.20175 -4.81477
182 4S -0.54427 -0.42592 -0.38491
183 5PX -0.36483 -0.34210 -0.34503
184 5PY 0.14803 0.19751 0.19920
185 5PZ -0.17115 -0.12524 -0.15321
186 6PX 0.83109 0.88185 0.90865
187 6PY -0.34312 -0.50913 -0.52461
188 6PZ 0.37837 0.32517 0.38407
189 7PX 1.30175 1.61171 1.73350
190 7PY -0.82945 -0.93052 -1.00084
191 7PZ 0.63096 0.64905 0.77029
192 8D 0 -0.01538 -0.03724 -0.02501
193 8D+1 0.08054 0.04726 0.05298
194 8D-1 -0.02918 -0.02729 -0.03059
195 8D+2 0.04224 0.04306 0.03918
196 8D-2 -0.06886 -0.07459 -0.06787
197 9D 0 0.15527 0.30999 0.27487
198 9D+1 -0.40566 -0.39172 -0.43089
199 9D-1 0.14829 0.22616 0.24878
200 9D+2 -0.30338 -0.35322 -0.35050
201 9D-2 0.36819 0.61180 0.60708
202 10F 0 -0.04407 -0.08186 -0.08308
203 10F+1 0.01366 -0.05004 -0.03495
204 10F-1 0.01871 0.02889 0.02018
205 10F+2 0.09282 0.05953 0.06062
206 10F-2 -0.03140 -0.10311 -0.10499
207 10F+3 0.03648 0.00000 0.00000
208 10F-3 -0.05384 -0.16592 -0.15618
209 6 H 1S 0.40364 0.22400 -0.21830
210 2S -0.35914 -0.19431 0.16217
211 3S -8.20554 -4.20175 4.81477
212 4S -1.08854 -0.42592 0.38491
213 5PX 0.00000 0.00000 0.00000
214 5PY 0.77992 0.39502 -0.39840
215 5PZ 0.34230 0.12524 -0.15321
216 6PX 0.00000 0.00000 0.00000
217 6PY -1.78261 -1.01827 1.04921
218 6PZ -0.75674 -0.32517 0.38407
219 7PX 0.00000 0.00000 0.00000
220 7PY -3.08415 -1.86104 2.00168
221 7PZ -1.26193 -0.64905 0.77029
222 8D 0 -0.03077 -0.03724 0.02501
223 8D+1 0.00000 0.00000 0.00000
224 8D-1 0.16869 0.05457 -0.06118
225 8D+2 -0.16151 -0.08612 0.07836
226 8D-2 0.00000 0.00000 0.00000
227 9D 0 0.31054 0.30999 -0.27487
228 9D+1 0.00000 0.00000 0.00000
229 9D-1 -0.85091 -0.45232 0.49755
230 9D+2 0.94110 0.70645 -0.70100
231 9D-2 0.00000 0.00000 0.00000
232 10F 0 0.08814 0.08186 -0.08308
233 10F+1 0.00000 0.00000 0.00000
234 10F-1 -0.00495 0.05778 -0.04035
235 10F+2 0.14720 0.11906 -0.12123
236 10F-2 0.00000 0.00000 0.00000
237 10F+3 0.00000 0.00000 0.00000
238 10F-3 0.10768 0.16592 -0.15618
239 7 H 1S -0.20182 0.22400 -0.21830
240 2S 0.17957 -0.19431 0.16217
241 3S 4.10277 -4.20175 4.81477
242 4S 0.54427 -0.42592 0.38491
243 5PX -0.36483 0.34210 -0.34503
244 5PY 0.14803 -0.19751 0.19920
245 5PZ -0.17115 0.12524 -0.15321
246 6PX 0.83109 -0.88185 0.90865
247 6PY -0.34312 0.50913 -0.52461
248 6PZ 0.37837 -0.32517 0.38407
249 7PX 1.30175 -1.61171 1.73350
250 7PY -0.82945 0.93052 -1.00084
251 7PZ 0.63096 -0.64905 0.77029
252 8D 0 0.01538 -0.03724 0.02501
253 8D+1 -0.08054 0.04726 -0.05298
254 8D-1 0.02918 -0.02729 0.03059
255 8D+2 -0.04224 0.04306 -0.03918
256 8D-2 0.06886 -0.07459 0.06787
257 9D 0 -0.15527 0.30999 -0.27487
258 9D+1 0.40566 -0.39172 0.43089
259 9D-1 -0.14829 0.22616 -0.24878
260 9D+2 0.30338 -0.35322 0.35050
261 9D-2 -0.36819 0.61180 -0.60708
262 10F 0 -0.04407 0.08186 -0.08308
263 10F+1 0.01366 0.05004 -0.03495
264 10F-1 0.01871 -0.02889 0.02018
265 10F+2 0.09282 -0.05953 0.06062
266 10F-2 -0.03140 0.10311 -0.10499
267 10F+3 0.03648 0.00000 0.00000
268 10F-3 -0.05384 0.16592 -0.15618
269 8 H 1S -0.20182 0.22400 -0.21830
270 2S 0.17957 -0.19431 0.16217
271 3S 4.10277 -4.20175 4.81477
272 4S 0.54427 -0.42592 0.38491
273 5PX 0.36483 -0.34210 0.34503
274 5PY 0.14803 -0.19751 0.19920
275 5PZ -0.17115 0.12524 -0.15321
276 6PX -0.83109 0.88185 -0.90865
277 6PY -0.34312 0.50913 -0.52461
278 6PZ 0.37837 -0.32517 0.38407
279 7PX -1.30175 1.61171 -1.73350
280 7PY -0.82945 0.93052 -1.00084
281 7PZ 0.63096 -0.64905 0.77029
282 8D 0 0.01538 -0.03724 0.02501
283 8D+1 0.08054 -0.04726 0.05298
284 8D-1 0.02918 -0.02729 0.03059
285 8D+2 -0.04224 0.04306 -0.03918
286 8D-2 -0.06886 0.07459 -0.06787
287 9D 0 -0.15527 0.30999 -0.27487
288 9D+1 -0.40566 0.39172 -0.43089
289 9D-1 -0.14829 0.22616 -0.24878
290 9D+2 0.30338 -0.35322 0.35050
291 9D-2 0.36819 -0.61180 0.60708
292 10F 0 -0.04407 0.08186 -0.08308
293 10F+1 -0.01366 -0.05004 0.03495
294 10F-1 0.01871 -0.02889 0.02018
295 10F+2 0.09282 -0.05953 0.06062
296 10F-2 0.03140 -0.10311 0.10499
297 10F+3 -0.03648 0.00000 0.00000
298 10F-3 -0.05384 0.16592 -0.15618
Alpha Density Matrix:
1 2 3 4 5
1 1 Si 1S 1.07533
2 2S -0.15124 0.28865
3 3S 0.15265 -0.30723 0.35654
4 4S -0.00096 -0.00148 0.03149 0.03088
5 5S 0.03435 -0.07134 0.15667 0.08076 0.24334
6 6S 0.00518 -0.01138 0.03141 0.01860 0.05884
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 0.00006 -0.00018 0.00051 -0.00412 0.01365
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 -0.00005 0.00014 -0.00012 -0.00040 0.00124
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 0.00023 -0.00039 0.00036 0.00440 -0.01341
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 -0.00163 0.00302 -0.00831 0.00081 -0.03269
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 -0.00067 0.00141 -0.00378 -0.00096 -0.01071
22 12D 0 0.00036 -0.00062 0.00207 0.00064 0.00644
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 -0.00006 0.00031 0.00001 -0.00077 0.00415
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 -0.00019 0.00035 -0.00088 -0.00117 0.00044
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15F 0 -0.00107 0.00213 -0.00457 -0.00216 -0.00739
38 15F+1 0.00000 0.00000 0.00000 0.00000 0.00000
39 15F-1 0.00000 0.00000 0.00000 0.00000 0.00000
40 15F+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15F-2 0.00000 0.00000 0.00000 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.00101 0.00209 -0.00409 -0.00191 -0.00561
44 16F 0 -0.00056 0.00131 -0.00297 -0.00156 -0.00479
45 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
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267 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
268 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
269 8 H 1S -0.00020 0.00000 -0.00001 0.00000 0.00000
270 2S -0.00054 0.00001 -0.00002 0.00001 0.00000
271 3S -0.00104 0.00001 -0.00004 0.00002 0.00000
272 4S -0.00058 0.00001 -0.00002 0.00001 0.00000
273 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
274 5PY 0.00001 0.00000 0.00000 0.00000 0.00000
275 5PZ 0.00000 0.00000 0.00000 0.00000 0.00000
276 6PX 0.00001 0.00000 0.00000 0.00000 0.00000
277 6PY 0.00003 0.00000 0.00000 0.00000 0.00000
278 6PZ -0.00001 0.00000 0.00000 0.00000 0.00000
279 7PX 0.00005 0.00000 0.00000 0.00000 0.00000
280 7PY 0.00006 0.00000 0.00000 0.00000 0.00000
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282 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
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288 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00001 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
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293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
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256 8D-2 0.00000
257 9D 0 0.00000 0.00000
258 9D+1 0.00000 0.00000 0.00000
259 9D-1 0.00000 0.00000 0.00000 0.00000
260 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
261 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
262 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
263 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
264 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
265 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
266 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
267 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
268 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
269 8 H 1S 0.00001 -0.00004 -0.00001 0.00001 0.00006
270 2S 0.00003 -0.00010 -0.00002 0.00002 0.00016
271 3S 0.00005 -0.00018 -0.00005 0.00005 0.00028
272 4S 0.00003 -0.00010 -0.00004 0.00003 0.00013
273 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
274 5PY 0.00000 0.00000 0.00000 0.00000 0.00000
275 5PZ 0.00000 0.00000 0.00000 0.00000 0.00000
276 6PX 0.00000 0.00001 0.00000 0.00000 -0.00001
277 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
278 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
279 7PX 0.00000 0.00002 0.00000 0.00000 -0.00002
280 7PY 0.00000 0.00001 0.00000 0.00000 -0.00001
281 7PZ 0.00000 0.00000 0.00000 0.00000 0.00001
282 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
261 262 263 264 265
261 9D-2 0.00000
262 10F 0 0.00000 0.00000
263 10F+1 0.00000 0.00000 0.00000
264 10F-1 0.00000 0.00000 0.00000 0.00000
265 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
266 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
267 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
268 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
269 8 H 1S 0.00000 0.00000 -0.00001 0.00000 0.00000
270 2S 0.00000 -0.00001 -0.00003 0.00000 0.00001
271 3S 0.00002 -0.00002 -0.00006 0.00000 0.00001
272 4S 0.00001 -0.00001 -0.00003 0.00000 0.00000
273 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
274 5PY 0.00000 0.00000 0.00000 0.00000 0.00000
275 5PZ 0.00000 0.00000 0.00000 0.00000 0.00000
276 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
277 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
278 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
279 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
280 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
281 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
282 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
266 267 268 269 270
266 10F-2 0.00000
267 10F+3 0.00000 0.00000
268 10F-3 0.00000 0.00000 0.00000
269 8 H 1S 0.00000 0.00001 -0.00001 0.00484
270 2S -0.00001 0.00004 -0.00001 0.01265 0.03304
271 3S -0.00002 0.00006 -0.00002 0.02198 0.05746
272 4S -0.00001 0.00003 -0.00001 0.01037 0.02715
273 5PX 0.00000 0.00000 0.00000 -0.00017 -0.00046
274 5PY 0.00000 0.00000 0.00000 -0.00010 -0.00026
275 5PZ 0.00000 0.00000 0.00000 0.00008 0.00020
276 6PX 0.00000 0.00000 0.00000 -0.00067 -0.00175
277 6PY 0.00000 0.00000 0.00000 -0.00039 -0.00101
278 6PZ 0.00000 0.00000 0.00000 0.00030 0.00077
279 7PX 0.00000 0.00000 0.00000 -0.00143 -0.00373
280 7PY 0.00000 0.00000 0.00000 -0.00082 -0.00215
281 7PZ 0.00000 0.00000 0.00000 0.00063 0.00165
282 8D 0 0.00000 0.00000 0.00000 -0.00002 -0.00005
283 8D+1 0.00000 0.00000 0.00000 -0.00003 -0.00008
284 8D-1 0.00000 0.00000 0.00000 -0.00002 -0.00005
285 8D+2 0.00000 0.00000 0.00000 0.00002 0.00006
286 8D-2 0.00000 0.00000 0.00000 0.00004 0.00011
287 9D 0 0.00000 0.00000 0.00000 -0.00003 -0.00009
288 9D+1 0.00000 0.00000 0.00000 -0.00005 -0.00013
289 9D-1 0.00000 0.00000 0.00000 -0.00003 -0.00007
290 9D+2 0.00000 0.00000 0.00000 0.00004 0.00009
291 9D-2 0.00000 0.00000 0.00000 0.00006 0.00016
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00001
293 10F+1 0.00000 0.00000 0.00000 0.00000 -0.00001
294 10F-1 0.00000 0.00000 0.00000 0.00000 -0.00001
295 10F+2 0.00000 0.00000 0.00000 -0.00001 -0.00002
296 10F-2 0.00000 0.00000 0.00000 -0.00001 -0.00003
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00001 0.00002
271 272 273 274 275
271 3S 0.10091
272 4S 0.04838 0.02389
273 5PX -0.00078 -0.00036 0.00001
274 5PY -0.00045 -0.00021 0.00000 0.00000
275 5PZ 0.00033 0.00015 0.00000 0.00000 0.00000
276 6PX -0.00300 -0.00138 0.00003 0.00001 -0.00001
277 6PY -0.00173 -0.00080 0.00001 0.00001 -0.00001
278 6PZ 0.00130 0.00056 -0.00001 -0.00001 0.00001
279 7PX -0.00666 -0.00327 0.00005 0.00003 -0.00002
280 7PY -0.00384 -0.00189 0.00003 0.00002 -0.00001
281 7PZ 0.00287 0.00132 -0.00002 -0.00001 0.00001
282 8D 0 -0.00009 -0.00004 0.00000 0.00000 0.00000
283 8D+1 -0.00014 -0.00006 0.00000 0.00000 0.00000
284 8D-1 -0.00008 -0.00004 0.00000 0.00000 0.00000
285 8D+2 0.00011 0.00005 0.00000 0.00000 0.00000
286 8D-2 0.00019 0.00009 0.00000 0.00000 0.00000
287 9D 0 -0.00016 -0.00008 0.00000 0.00000 0.00000
288 9D+1 -0.00021 -0.00008 0.00000 0.00000 0.00000
289 9D-1 -0.00012 -0.00005 0.00000 0.00000 0.00000
290 9D+2 0.00016 0.00007 0.00000 0.00000 0.00000
291 9D-2 0.00027 0.00013 0.00000 0.00000 0.00000
292 10F 0 0.00002 0.00001 0.00000 0.00000 0.00000
293 10F+1 -0.00002 -0.00001 0.00000 0.00000 0.00000
294 10F-1 -0.00001 0.00000 0.00000 0.00000 0.00000
295 10F+2 -0.00003 -0.00002 0.00000 0.00000 0.00000
296 10F-2 -0.00005 -0.00003 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00004 0.00002 0.00000 0.00000 0.00000
276 277 278 279 280
276 6PX 0.00010
277 6PY 0.00005 0.00004
278 6PZ -0.00004 -0.00002 0.00003
279 7PX 0.00020 0.00011 -0.00007 0.00047
280 7PY 0.00011 0.00007 -0.00004 0.00027 0.00016
281 7PZ -0.00008 -0.00005 0.00005 -0.00017 -0.00010
282 8D 0 0.00000 0.00000 0.00000 0.00001 0.00000
283 8D+1 0.00000 0.00000 0.00000 0.00001 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 -0.00001 0.00000
286 8D-2 -0.00001 0.00000 0.00000 -0.00001 -0.00001
287 9D 0 0.00001 0.00000 0.00000 0.00002 0.00001
288 9D+1 0.00001 0.00000 0.00000 0.00001 0.00001
289 9D-1 0.00000 0.00000 0.00000 0.00001 0.00000
290 9D+2 -0.00001 0.00000 0.00000 -0.00001 0.00000
291 9D-2 -0.00001 -0.00001 0.00000 -0.00002 -0.00001
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
281 282 283 284 285
281 7PZ 0.00010
282 8D 0 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00001 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
288 9D+1 -0.00001 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00001 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
286 287 288 289 290
286 8D-2 0.00000
287 9D 0 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
291 292 293 294 295
291 9D-2 0.00000
292 10F 0 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
296 297 298
296 10F-2 0.00000
297 10F+3 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000
Beta Density Matrix:
1 2 3 4 5
1 1 Si 1S 1.07533
2 2S -0.15124 0.28865
3 3S 0.15265 -0.30723 0.35654
4 4S -0.00096 -0.00148 0.03149 0.03088
5 5S 0.03435 -0.07134 0.15667 0.08076 0.24334
6 6S 0.00518 -0.01138 0.03141 0.01860 0.05884
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 0.00006 -0.00018 0.00051 -0.00412 0.01365
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 -0.00005 0.00014 -0.00012 -0.00040 0.00124
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 0.00023 -0.00039 0.00036 0.00440 -0.01341
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 -0.00163 0.00302 -0.00831 0.00081 -0.03269
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 -0.00067 0.00141 -0.00378 -0.00096 -0.01071
22 12D 0 0.00036 -0.00062 0.00207 0.00064 0.00644
23 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
24 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
25 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
26 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
27 13D 0 -0.00006 0.00031 0.00001 -0.00077 0.00415
28 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
29 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
30 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
31 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
32 14D 0 -0.00019 0.00035 -0.00088 -0.00117 0.00044
33 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
34 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
35 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
36 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
37 15F 0 -0.00107 0.00213 -0.00457 -0.00216 -0.00739
38 15F+1 0.00000 0.00000 0.00000 0.00000 0.00000
39 15F-1 0.00000 0.00000 0.00000 0.00000 0.00000
40 15F+2 0.00000 0.00000 0.00000 0.00000 0.00000
41 15F-2 0.00000 0.00000 0.00000 0.00000 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
43 15F-3 -0.00101 0.00209 -0.00409 -0.00191 -0.00561
44 16F 0 -0.00056 0.00131 -0.00297 -0.00156 -0.00479
45 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
46 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
47 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
48 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
50 16F-3 -0.00060 0.00143 -0.00317 -0.00183 -0.00442
51 17G 0 0.00013 -0.00025 0.00059 0.00029 0.00105
52 17G+1 0.00000 0.00000 0.00000 0.00000 0.00000
53 17G-1 0.00000 0.00000 0.00000 0.00000 0.00000
54 17G+2 0.00000 0.00000 0.00000 0.00000 0.00000
55 17G-2 0.00000 0.00000 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
57 17G-3 -0.00029 0.00067 -0.00143 -0.00075 -0.00203
58 17G+4 0.00000 0.00000 0.00000 0.00000 0.00000
59 17G-4 0.00000 0.00000 0.00000 0.00000 0.00000
60 2 Si 1S 0.00040 -0.00084 0.00205 0.00091 0.00391
61 2S -0.00084 0.00178 -0.00433 -0.00173 -0.00885
62 3S 0.00205 -0.00433 0.01037 0.00355 0.02274
63 4S 0.00091 -0.00173 0.00355 0.00061 0.00790
64 5S 0.00391 -0.00885 0.02274 0.00790 0.05410
65 6S 0.00049 -0.00123 0.00176 -0.00171 0.00771
66 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
67 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
68 7PZ -0.00355 0.00769 -0.01879 -0.00674 -0.04309
69 8PX 0.00000 0.00000 0.00000 0.00000 0.00000
70 8PY 0.00000 0.00000 0.00000 0.00000 0.00000
71 8PZ -0.00033 0.00073 -0.00176 -0.00061 -0.00407
72 9PX 0.00000 0.00000 0.00000 0.00000 0.00000
73 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
74 9PZ 0.00415 -0.00894 0.02170 0.00869 0.04696
75 10PX 0.00000 0.00000 0.00000 0.00000 0.00000
76 10PY 0.00000 0.00000 0.00000 0.00000 0.00000
77 10PZ 0.00385 -0.00897 0.02273 0.00791 0.05500
78 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
79 11PY 0.00000 0.00000 0.00000 0.00000 0.00000
80 11PZ 0.00062 -0.00139 0.00298 0.00012 0.00868
81 12D 0 0.00029 -0.00082 0.00232 0.00068 0.00657
82 12D+1 0.00000 0.00000 0.00000 0.00000 0.00000
83 12D-1 0.00000 0.00000 0.00000 0.00000 0.00000
84 12D+2 0.00000 0.00000 0.00000 0.00000 0.00000
85 12D-2 0.00000 0.00000 0.00000 0.00000 0.00000
86 13D 0 0.00082 -0.00194 0.00502 0.00206 0.01145
87 13D+1 0.00000 0.00000 0.00000 0.00000 0.00000
88 13D-1 0.00000 0.00000 0.00000 0.00000 0.00000
89 13D+2 0.00000 0.00000 0.00000 0.00000 0.00000
90 13D-2 0.00000 0.00000 0.00000 0.00000 0.00000
91 14D 0 0.00073 -0.00154 0.00371 0.00161 0.00758
92 14D+1 0.00000 0.00000 0.00000 0.00000 0.00000
93 14D-1 0.00000 0.00000 0.00000 0.00000 0.00000
94 14D+2 0.00000 0.00000 0.00000 0.00000 0.00000
95 14D-2 0.00000 0.00000 0.00000 0.00000 0.00000
96 15F 0 0.00021 -0.00048 0.00124 0.00046 0.00294
97 15F+1 0.00000 0.00000 0.00000 0.00000 0.00000
98 15F-1 0.00000 0.00000 0.00000 0.00000 0.00000
99 15F+2 0.00000 0.00000 0.00000 0.00000 0.00000
100 15F-2 0.00000 0.00000 0.00000 0.00000 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00024 -0.00047 0.00098 0.00041 0.00165
103 16F 0 0.00014 -0.00032 0.00082 0.00037 0.00170
104 16F+1 0.00000 0.00000 0.00000 0.00000 0.00000
105 16F-1 0.00000 0.00000 0.00000 0.00000 0.00000
106 16F+2 0.00000 0.00000 0.00000 0.00000 0.00000
107 16F-2 0.00000 0.00000 0.00000 0.00000 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000 0.00000
109 16F-3 -0.00008 0.00017 -0.00034 -0.00013 -0.00066
110 17G 0 0.00005 -0.00009 0.00021 0.00007 0.00047
111 17G+1 0.00000 0.00000 0.00000 0.00000 0.00000
112 17G-1 0.00000 0.00000 0.00000 0.00000 0.00000
113 17G+2 0.00000 0.00000 0.00000 0.00000 0.00000
114 17G-2 0.00000 0.00000 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000 0.00000
116 17G-3 -0.00003 0.00007 -0.00015 -0.00007 -0.00027
117 17G+4 0.00000 0.00000 0.00000 0.00000 0.00000
118 17G-4 0.00000 0.00000 0.00000 0.00000 0.00000
119 3 H 1S 0.00154 -0.00329 0.00819 0.00527 0.01215
120 2S 0.00403 -0.00846 0.02095 0.01346 0.03089
121 3S 0.00424 -0.00888 0.02598 0.01937 0.03987
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271 3S 0.00002 -0.00002 -0.00006 0.00000 0.00001
272 4S 0.00001 -0.00001 -0.00003 0.00000 0.00000
273 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
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275 5PZ 0.00000 0.00000 0.00000 0.00000 0.00000
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278 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
279 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
280 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
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290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
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298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
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271 3S -0.00002 0.00006 -0.00002 0.02198 0.05746
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278 6PZ 0.00000 0.00000 0.00000 0.00030 0.00077
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280 7PY 0.00000 0.00000 0.00000 -0.00082 -0.00215
281 7PZ 0.00000 0.00000 0.00000 0.00063 0.00165
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295 10F+2 0.00000 0.00000 0.00000 -0.00001 -0.00002
296 10F-2 0.00000 0.00000 0.00000 -0.00001 -0.00003
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00001 0.00002
271 272 273 274 275
271 3S 0.10091
272 4S 0.04838 0.02389
273 5PX -0.00078 -0.00036 0.00001
274 5PY -0.00045 -0.00021 0.00000 0.00000
275 5PZ 0.00033 0.00015 0.00000 0.00000 0.00000
276 6PX -0.00300 -0.00138 0.00003 0.00001 -0.00001
277 6PY -0.00173 -0.00080 0.00001 0.00001 -0.00001
278 6PZ 0.00130 0.00056 -0.00001 -0.00001 0.00001
279 7PX -0.00666 -0.00327 0.00005 0.00003 -0.00002
280 7PY -0.00384 -0.00189 0.00003 0.00002 -0.00001
281 7PZ 0.00287 0.00132 -0.00002 -0.00001 0.00001
282 8D 0 -0.00009 -0.00004 0.00000 0.00000 0.00000
283 8D+1 -0.00014 -0.00006 0.00000 0.00000 0.00000
284 8D-1 -0.00008 -0.00004 0.00000 0.00000 0.00000
285 8D+2 0.00011 0.00005 0.00000 0.00000 0.00000
286 8D-2 0.00019 0.00009 0.00000 0.00000 0.00000
287 9D 0 -0.00016 -0.00008 0.00000 0.00000 0.00000
288 9D+1 -0.00021 -0.00008 0.00000 0.00000 0.00000
289 9D-1 -0.00012 -0.00005 0.00000 0.00000 0.00000
290 9D+2 0.00016 0.00007 0.00000 0.00000 0.00000
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295 10F+2 -0.00003 -0.00002 0.00000 0.00000 0.00000
296 10F-2 -0.00005 -0.00003 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00004 0.00002 0.00000 0.00000 0.00000
276 277 278 279 280
276 6PX 0.00010
277 6PY 0.00005 0.00004
278 6PZ -0.00004 -0.00002 0.00003
279 7PX 0.00020 0.00011 -0.00007 0.00047
280 7PY 0.00011 0.00007 -0.00004 0.00027 0.00016
281 7PZ -0.00008 -0.00005 0.00005 -0.00017 -0.00010
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298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
281 282 283 284 285
281 7PZ 0.00010
282 8D 0 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000
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286 8D-2 0.00001 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
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290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00001 0.00000 0.00000 0.00000 0.00000
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295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
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297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
286 287 288 289 290
286 8D-2 0.00000
287 9D 0 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000
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297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
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298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
296 297 298
296 10F-2 0.00000
297 10F+3 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000
Full Mulliken population analysis:
1 2 3 4 5
1 1 Si 1S 2.15065
2 2S -0.07092 0.57730
3 3S -0.08467 0.56033 0.71308
4 4S -0.00018 -0.00142 -0.04476 0.06176
5 5S 0.00383 -0.04255 -0.15056 0.14567 0.48668
6 6S 0.00030 -0.00369 -0.01726 0.02371 0.10232
7 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
8 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
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12 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000
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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 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
20 11PY 0.00000 0.00000 0.00000 0.00000 0.00000
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62 3S 0.00000 0.00000 0.00000 -0.00002 -0.00110
63 4S 0.00000 0.00000 -0.00002 0.00003 0.00145
64 5S 0.00002 -0.00022 -0.00110 0.00145 0.02014
65 6S 0.00001 -0.00010 -0.00026 -0.00068 0.00499
66 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
67 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
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71 8PZ 0.00000 0.00000 0.00000 -0.00001 -0.00028
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73 9PY 0.00000 0.00000 0.00000 0.00000 0.00000
74 9PZ 0.00000 -0.00004 -0.00031 0.00109 0.01306
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77 10PZ 0.00007 -0.00092 -0.00420 0.00403 0.04080
78 11PX 0.00000 0.00000 0.00000 0.00000 0.00000
79 11PY 0.00000 0.00000 0.00000 0.00000 0.00000
80 11PZ 0.00002 -0.00027 -0.00098 0.00010 0.00959
81 12D 0 0.00001 -0.00020 -0.00094 0.00057 0.00601
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116 17G-3 0.00000 0.00000 0.00000 0.00000 0.00000
117 17G+4 0.00000 0.00000 0.00000 0.00000 0.00000
118 17G-4 0.00000 0.00000 0.00000 0.00000 0.00000
119 3 H 1S 0.00000 0.00000 -0.00001 0.00039 0.00200
120 2S 0.00000 -0.00009 -0.00073 0.00340 0.01360
121 3S 0.00009 -0.00107 -0.00566 0.01161 0.03443
122 4S 0.00005 -0.00061 -0.00250 0.00464 0.00906
123 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
124 5PY 0.00000 0.00000 0.00000 0.00003 0.00008
125 5PZ 0.00000 0.00000 0.00000 0.00000 0.00001
126 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
127 6PY 0.00000 -0.00002 -0.00014 0.00040 0.00093
128 6PZ 0.00000 0.00000 -0.00002 0.00005 0.00016
129 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
130 7PY 0.00000 0.00007 -0.00031 0.00113 0.00141
131 7PZ 0.00000 0.00001 -0.00008 0.00017 0.00044
132 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
133 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
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135 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
136 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
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138 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
139 9D-1 0.00000 0.00000 -0.00001 0.00003 0.00005
140 9D+2 0.00000 0.00001 -0.00002 0.00005 0.00006
141 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
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147 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
148 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
149 4 H 1S 0.00000 0.00000 -0.00001 0.00039 0.00200
150 2S 0.00000 -0.00009 -0.00073 0.00340 0.01360
151 3S 0.00009 -0.00107 -0.00566 0.01161 0.03443
152 4S 0.00005 -0.00061 -0.00250 0.00464 0.00906
153 5PX 0.00000 0.00000 0.00000 0.00002 0.00006
154 5PY 0.00000 0.00000 0.00000 0.00001 0.00002
155 5PZ 0.00000 0.00000 0.00000 0.00000 0.00001
156 6PX 0.00000 -0.00001 -0.00011 0.00030 0.00070
157 6PY 0.00000 0.00000 -0.00004 0.00010 0.00023
158 6PZ 0.00000 0.00000 -0.00002 0.00005 0.00016
159 7PX 0.00000 0.00005 -0.00023 0.00085 0.00106
160 7PY 0.00000 0.00002 -0.00008 0.00028 0.00035
161 7PZ 0.00000 0.00001 -0.00008 0.00017 0.00044
162 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
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165 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
166 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
167 9D 0 0.00000 0.00000 0.00000 0.00001 0.00001
168 9D+1 0.00000 0.00000 -0.00001 0.00002 0.00003
169 9D-1 0.00000 0.00000 0.00000 0.00001 0.00001
170 9D+2 0.00000 0.00000 0.00000 0.00001 0.00001
171 9D-2 0.00000 0.00001 -0.00001 0.00004 0.00004
172 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
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175 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
176 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
177 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
178 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
179 5 H 1S 0.00000 0.00000 -0.00001 0.00039 0.00200
180 2S 0.00000 -0.00009 -0.00073 0.00340 0.01360
181 3S 0.00009 -0.00107 -0.00566 0.01161 0.03443
182 4S 0.00005 -0.00061 -0.00250 0.00464 0.00906
183 5PX 0.00000 0.00000 0.00000 0.00002 0.00006
184 5PY 0.00000 0.00000 0.00000 0.00001 0.00002
185 5PZ 0.00000 0.00000 0.00000 0.00000 0.00001
186 6PX 0.00000 -0.00001 -0.00011 0.00030 0.00070
187 6PY 0.00000 0.00000 -0.00004 0.00010 0.00023
188 6PZ 0.00000 0.00000 -0.00002 0.00005 0.00016
189 7PX 0.00000 0.00005 -0.00023 0.00085 0.00106
190 7PY 0.00000 0.00002 -0.00008 0.00028 0.00035
191 7PZ 0.00000 0.00001 -0.00008 0.00017 0.00044
192 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
193 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
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195 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
196 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
197 9D 0 0.00000 0.00000 0.00000 0.00001 0.00001
198 9D+1 0.00000 0.00000 -0.00001 0.00002 0.00003
199 9D-1 0.00000 0.00000 0.00000 0.00001 0.00001
200 9D+2 0.00000 0.00000 0.00000 0.00001 0.00001
201 9D-2 0.00000 0.00001 -0.00001 0.00004 0.00004
202 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
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260 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
261 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
262 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
263 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
264 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
265 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
266 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
267 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
268 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
269 8 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
270 2S 0.00000 0.00000 0.00000 0.00000 0.00000
271 3S 0.00000 0.00001 0.00000 0.00000 0.00002
272 4S 0.00000 0.00000 0.00000 0.00000 0.00001
273 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
274 5PY 0.00000 0.00000 0.00000 0.00000 0.00000
275 5PZ 0.00000 0.00000 0.00000 0.00000 0.00000
276 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
277 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
278 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
279 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
280 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
281 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
282 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
261 262 263 264 265
261 9D-2 0.00000
262 10F 0 0.00000 0.00000
263 10F+1 0.00000 0.00000 0.00000
264 10F-1 0.00000 0.00000 0.00000 0.00000
265 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
266 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
267 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
268 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
269 8 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000
270 2S 0.00000 0.00000 0.00000 0.00000 0.00000
271 3S 0.00000 0.00000 0.00000 0.00000 0.00000
272 4S 0.00000 0.00000 0.00000 0.00000 0.00000
273 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
274 5PY 0.00000 0.00000 0.00000 0.00000 0.00000
275 5PZ 0.00000 0.00000 0.00000 0.00000 0.00000
276 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
277 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
278 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
279 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
280 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
281 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
282 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
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295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
266 267 268 269 270
266 10F-2 0.00000
267 10F+3 0.00000 0.00000
268 10F-3 0.00000 0.00000 0.00000
269 8 H 1S 0.00000 0.00000 0.00000 0.00969
270 2S 0.00000 0.00000 0.00000 0.01802 0.06607
271 3S 0.00000 0.00000 0.00000 0.01687 0.09158
272 4S 0.00000 0.00000 0.00000 0.00391 0.02545
273 5PX 0.00000 0.00000 0.00000 0.00000 0.00000
274 5PY 0.00000 0.00000 0.00000 0.00000 0.00000
275 5PZ 0.00000 0.00000 0.00000 0.00000 0.00000
276 6PX 0.00000 0.00000 0.00000 0.00000 0.00000
277 6PY 0.00000 0.00000 0.00000 0.00000 0.00000
278 6PZ 0.00000 0.00000 0.00000 0.00000 0.00000
279 7PX 0.00000 0.00000 0.00000 0.00000 0.00000
280 7PY 0.00000 0.00000 0.00000 0.00000 0.00000
281 7PZ 0.00000 0.00000 0.00000 0.00000 0.00000
282 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
271 272 273 274 275
271 3S 0.20182
272 4S 0.07925 0.04778
273 5PX 0.00000 0.00000 0.00001
274 5PY 0.00000 0.00000 0.00000 0.00000
275 5PZ 0.00000 0.00000 0.00000 0.00000 0.00000
276 6PX 0.00000 0.00000 0.00004 0.00000 0.00000
277 6PY 0.00000 0.00000 0.00000 0.00001 0.00000
278 6PZ 0.00000 0.00000 0.00000 0.00000 0.00001
279 7PX 0.00000 0.00000 0.00003 0.00000 0.00000
280 7PY 0.00000 0.00000 0.00000 0.00001 0.00000
281 7PZ 0.00000 0.00000 0.00000 0.00000 0.00001
282 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
276 277 278 279 280
276 6PX 0.00019
277 6PY 0.00000 0.00007
278 6PZ 0.00000 0.00000 0.00005
279 7PX 0.00028 0.00000 0.00000 0.00094
280 7PY 0.00000 0.00010 0.00000 0.00000 0.00033
281 7PZ 0.00000 0.00000 0.00007 0.00000 0.00000
282 8D 0 0.00000 0.00000 0.00000 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
281 282 283 284 285
281 7PZ 0.00020
282 8D 0 0.00000 0.00000
283 8D+1 0.00000 0.00000 0.00000
284 8D-1 0.00000 0.00000 0.00000 0.00000
285 8D+2 0.00000 0.00000 0.00000 0.00000 0.00000
286 8D-2 0.00000 0.00000 0.00000 0.00000 0.00000
287 9D 0 0.00000 0.00000 0.00000 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
286 287 288 289 290
286 8D-2 0.00000
287 9D 0 0.00000 0.00000
288 9D+1 0.00000 0.00000 0.00000
289 9D-1 0.00000 0.00000 0.00000 0.00000
290 9D+2 0.00000 0.00000 0.00000 0.00000 0.00000
291 9D-2 0.00000 0.00000 0.00000 0.00000 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
291 292 293 294 295
291 9D-2 0.00000
292 10F 0 0.00000 0.00000
293 10F+1 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00000 0.00000 0.00000 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000 0.00000 0.00000
296 297 298
296 10F-2 0.00000
297 10F+3 0.00000 0.00000
298 10F-3 0.00000 0.00000 0.00000
Gross orbital populations:
Total Alpha Beta Spin
1 1 Si 1S 1.99956 0.99978 0.99978 0.00000
2 2S 1.01214 0.50607 0.50607 0.00000
3 3S 0.93948 0.46974 0.46974 0.00000
4 4S 0.25749 0.12875 0.12875 0.00000
5 5S 0.82192 0.41096 0.41096 0.00000
6 6S 0.18418 0.09209 0.09209 0.00000
7 7PX 2.13070 1.06535 1.06535 0.00000
8 7PY 2.13070 1.06535 1.06535 0.00000
9 7PZ 2.13071 1.06535 1.06535 0.00000
10 8PX -0.13616 -0.06808 -0.06808 0.00000
11 8PY -0.13616 -0.06808 -0.06808 0.00000
12 8PZ -0.13637 -0.06819 -0.06819 0.00000
13 9PX 0.26023 0.13012 0.13012 0.00000
14 9PY 0.26023 0.13012 0.13012 0.00000
15 9PZ 0.26266 0.13133 0.13133 0.00000
16 10PX 0.38806 0.19403 0.19403 0.00000
17 10PY 0.38806 0.19403 0.19403 0.00000
18 10PZ 0.44208 0.22104 0.22104 0.00000
19 11PX 0.05375 0.02688 0.02688 0.00000
20 11PY 0.05375 0.02688 0.02688 0.00000
21 11PZ 0.05534 0.02767 0.02767 0.00000
22 12D 0 0.01667 0.00833 0.00833 0.00000
23 12D+1 0.00650 0.00325 0.00325 0.00000
24 12D-1 0.00650 0.00325 0.00325 0.00000
25 12D+2 0.01648 0.00824 0.00824 0.00000
26 12D-2 0.01648 0.00824 0.00824 0.00000
27 13D 0 0.03116 0.01558 0.01558 0.00000
28 13D+1 0.01369 0.00684 0.00684 0.00000
29 13D-1 0.01369 0.00684 0.00684 0.00000
30 13D+2 0.02639 0.01319 0.01319 0.00000
31 13D-2 0.02639 0.01319 0.01319 0.00000
32 14D 0 0.00920 0.00460 0.00460 0.00000
33 14D+1 0.00559 0.00279 0.00279 0.00000
34 14D-1 0.00559 0.00279 0.00279 0.00000
35 14D+2 0.01030 0.00515 0.00515 0.00000
36 14D-2 0.01030 0.00515 0.00515 0.00000
37 15F 0 0.00391 0.00195 0.00195 0.00000
38 15F+1 0.00030 0.00015 0.00015 0.00000
39 15F-1 0.00030 0.00015 0.00015 0.00000
40 15F+2 0.00021 0.00010 0.00010 0.00000
41 15F-2 0.00021 0.00010 0.00010 0.00000
42 15F+3 0.00000 0.00000 0.00000 0.00000
43 15F-3 0.00342 0.00171 0.00171 0.00000
44 16F 0 0.00187 0.00093 0.00093 0.00000
45 16F+1 0.00036 0.00018 0.00018 0.00000
46 16F-1 0.00036 0.00018 0.00018 0.00000
47 16F+2 0.00175 0.00088 0.00088 0.00000
48 16F-2 0.00175 0.00088 0.00088 0.00000
49 16F+3 0.00000 0.00000 0.00000 0.00000
50 16F-3 0.00304 0.00152 0.00152 0.00000
51 17G 0 0.00022 0.00011 0.00011 0.00000
52 17G+1 0.00041 0.00021 0.00021 0.00000
53 17G-1 0.00041 0.00021 0.00021 0.00000
54 17G+2 0.00001 0.00000 0.00000 0.00000
55 17G-2 0.00001 0.00000 0.00000 0.00000
56 17G+3 0.00000 0.00000 0.00000 0.00000
57 17G-3 0.00080 0.00040 0.00040 0.00000
58 17G+4 0.00031 0.00015 0.00015 0.00000
59 17G-4 0.00031 0.00015 0.00015 0.00000
60 2 Si 1S 1.99956 0.99978 0.99978 0.00000
61 2S 1.01214 0.50607 0.50607 0.00000
62 3S 0.93948 0.46974 0.46974 0.00000
63 4S 0.25749 0.12875 0.12875 0.00000
64 5S 0.82192 0.41096 0.41096 0.00000
65 6S 0.18418 0.09209 0.09209 0.00000
66 7PX 2.13070 1.06535 1.06535 0.00000
67 7PY 2.13070 1.06535 1.06535 0.00000
68 7PZ 2.13071 1.06535 1.06535 0.00000
69 8PX -0.13616 -0.06808 -0.06808 0.00000
70 8PY -0.13616 -0.06808 -0.06808 0.00000
71 8PZ -0.13637 -0.06819 -0.06819 0.00000
72 9PX 0.26023 0.13012 0.13012 0.00000
73 9PY 0.26023 0.13012 0.13012 0.00000
74 9PZ 0.26266 0.13133 0.13133 0.00000
75 10PX 0.38806 0.19403 0.19403 0.00000
76 10PY 0.38806 0.19403 0.19403 0.00000
77 10PZ 0.44208 0.22104 0.22104 0.00000
78 11PX 0.05375 0.02688 0.02688 0.00000
79 11PY 0.05375 0.02688 0.02688 0.00000
80 11PZ 0.05534 0.02767 0.02767 0.00000
81 12D 0 0.01667 0.00833 0.00833 0.00000
82 12D+1 0.00650 0.00325 0.00325 0.00000
83 12D-1 0.00650 0.00325 0.00325 0.00000
84 12D+2 0.01648 0.00824 0.00824 0.00000
85 12D-2 0.01648 0.00824 0.00824 0.00000
86 13D 0 0.03116 0.01558 0.01558 0.00000
87 13D+1 0.01369 0.00684 0.00684 0.00000
88 13D-1 0.01369 0.00684 0.00684 0.00000
89 13D+2 0.02639 0.01319 0.01319 0.00000
90 13D-2 0.02639 0.01319 0.01319 0.00000
91 14D 0 0.00920 0.00460 0.00460 0.00000
92 14D+1 0.00559 0.00279 0.00279 0.00000
93 14D-1 0.00559 0.00279 0.00279 0.00000
94 14D+2 0.01030 0.00515 0.00515 0.00000
95 14D-2 0.01030 0.00515 0.00515 0.00000
96 15F 0 0.00391 0.00195 0.00195 0.00000
97 15F+1 0.00030 0.00015 0.00015 0.00000
98 15F-1 0.00030 0.00015 0.00015 0.00000
99 15F+2 0.00021 0.00010 0.00010 0.00000
100 15F-2 0.00021 0.00010 0.00010 0.00000
101 15F+3 0.00000 0.00000 0.00000 0.00000
102 15F-3 0.00342 0.00171 0.00171 0.00000
103 16F 0 0.00187 0.00093 0.00093 0.00000
104 16F+1 0.00036 0.00018 0.00018 0.00000
105 16F-1 0.00036 0.00018 0.00018 0.00000
106 16F+2 0.00175 0.00088 0.00088 0.00000
107 16F-2 0.00175 0.00088 0.00088 0.00000
108 16F+3 0.00000 0.00000 0.00000 0.00000
109 16F-3 0.00304 0.00152 0.00152 0.00000
110 17G 0 0.00022 0.00011 0.00011 0.00000
111 17G+1 0.00041 0.00021 0.00021 0.00000
112 17G-1 0.00041 0.00021 0.00021 0.00000
113 17G+2 0.00001 0.00000 0.00000 0.00000
114 17G-2 0.00001 0.00000 0.00000 0.00000
115 17G+3 0.00000 0.00000 0.00000 0.00000
116 17G-3 0.00080 0.00040 0.00040 0.00000
117 17G+4 0.00031 0.00015 0.00015 0.00000
118 17G-4 0.00031 0.00015 0.00015 0.00000
119 3 H 1S 0.06183 0.03092 0.03092 0.00000
120 2S 0.28366 0.14183 0.14183 0.00000
121 3S 0.57501 0.28751 0.28751 0.00000
122 4S 0.19502 0.09751 0.09751 0.00000
123 5PX 0.00002 0.00001 0.00001 0.00000
124 5PY 0.00046 0.00023 0.00023 0.00000
125 5PZ 0.00010 0.00005 0.00005 0.00000
126 6PX 0.00032 0.00016 0.00016 0.00000
127 6PY 0.00400 0.00200 0.00200 0.00000
128 6PZ 0.00101 0.00050 0.00050 0.00000
129 7PX 0.00125 0.00063 0.00063 0.00000
130 7PY 0.00803 0.00402 0.00402 0.00000
131 7PZ 0.00268 0.00134 0.00134 0.00000
132 8D 0 0.00001 0.00000 0.00000 0.00000
133 8D+1 0.00000 0.00000 0.00000 0.00000
134 8D-1 0.00002 0.00001 0.00001 0.00000
135 8D+2 0.00003 0.00002 0.00002 0.00000
136 8D-2 0.00000 0.00000 0.00000 0.00000
137 9D 0 0.00020 0.00010 0.00010 0.00000
138 9D+1 0.00000 0.00000 0.00000 0.00000
139 9D-1 0.00018 0.00009 0.00009 0.00000
140 9D+2 0.00021 0.00010 0.00010 0.00000
141 9D-2 0.00019 0.00009 0.00009 0.00000
142 10F 0 0.00000 0.00000 0.00000 0.00000
143 10F+1 0.00000 0.00000 0.00000 0.00000
144 10F-1 0.00001 0.00000 0.00000 0.00000
145 10F+2 0.00000 0.00000 0.00000 0.00000
146 10F-2 0.00000 0.00000 0.00000 0.00000
147 10F+3 0.00001 0.00000 0.00000 0.00000
148 10F-3 0.00001 0.00000 0.00000 0.00000
149 4 H 1S 0.06183 0.03092 0.03092 0.00000
150 2S 0.28366 0.14183 0.14183 0.00000
151 3S 0.57501 0.28751 0.28751 0.00000
152 4S 0.19502 0.09751 0.09751 0.00000
153 5PX 0.00035 0.00018 0.00018 0.00000
154 5PY 0.00013 0.00007 0.00007 0.00000
155 5PZ 0.00010 0.00005 0.00005 0.00000
156 6PX 0.00308 0.00154 0.00154 0.00000
157 6PY 0.00124 0.00062 0.00062 0.00000
158 6PZ 0.00101 0.00050 0.00050 0.00000
159 7PX 0.00634 0.00317 0.00317 0.00000
160 7PY 0.00295 0.00147 0.00147 0.00000
161 7PZ 0.00268 0.00134 0.00134 0.00000
162 8D 0 0.00001 0.00000 0.00000 0.00000
163 8D+1 0.00002 0.00001 0.00001 0.00000
164 8D-1 0.00001 0.00000 0.00000 0.00000
165 8D+2 0.00001 0.00001 0.00001 0.00000
166 8D-2 0.00003 0.00001 0.00001 0.00000
167 9D 0 0.00020 0.00010 0.00010 0.00000
168 9D+1 0.00014 0.00007 0.00007 0.00000
169 9D-1 0.00005 0.00002 0.00002 0.00000
170 9D+2 0.00019 0.00010 0.00010 0.00000
171 9D-2 0.00020 0.00010 0.00010 0.00000
172 10F 0 0.00000 0.00000 0.00000 0.00000
173 10F+1 0.00001 0.00000 0.00000 0.00000
174 10F-1 0.00000 0.00000 0.00000 0.00000
175 10F+2 0.00000 0.00000 0.00000 0.00000
176 10F-2 0.00000 0.00000 0.00000 0.00000
177 10F+3 0.00001 0.00000 0.00000 0.00000
178 10F-3 0.00001 0.00000 0.00000 0.00000
179 5 H 1S 0.06183 0.03092 0.03092 0.00000
180 2S 0.28366 0.14183 0.14183 0.00000
181 3S 0.57501 0.28751 0.28751 0.00000
182 4S 0.19502 0.09751 0.09751 0.00000
183 5PX 0.00035 0.00018 0.00018 0.00000
184 5PY 0.00013 0.00007 0.00007 0.00000
185 5PZ 0.00010 0.00005 0.00005 0.00000
186 6PX 0.00308 0.00154 0.00154 0.00000
187 6PY 0.00124 0.00062 0.00062 0.00000
188 6PZ 0.00101 0.00050 0.00050 0.00000
189 7PX 0.00634 0.00317 0.00317 0.00000
190 7PY 0.00295 0.00147 0.00147 0.00000
191 7PZ 0.00268 0.00134 0.00134 0.00000
192 8D 0 0.00001 0.00000 0.00000 0.00000
193 8D+1 0.00002 0.00001 0.00001 0.00000
194 8D-1 0.00001 0.00000 0.00000 0.00000
195 8D+2 0.00001 0.00001 0.00001 0.00000
196 8D-2 0.00003 0.00001 0.00001 0.00000
197 9D 0 0.00020 0.00010 0.00010 0.00000
198 9D+1 0.00014 0.00007 0.00007 0.00000
199 9D-1 0.00005 0.00002 0.00002 0.00000
200 9D+2 0.00019 0.00010 0.00010 0.00000
201 9D-2 0.00020 0.00010 0.00010 0.00000
202 10F 0 0.00000 0.00000 0.00000 0.00000
203 10F+1 0.00001 0.00000 0.00000 0.00000
204 10F-1 0.00000 0.00000 0.00000 0.00000
205 10F+2 0.00000 0.00000 0.00000 0.00000
206 10F-2 0.00000 0.00000 0.00000 0.00000
207 10F+3 0.00001 0.00000 0.00000 0.00000
208 10F-3 0.00001 0.00000 0.00000 0.00000
209 6 H 1S 0.06183 0.03092 0.03092 0.00000
210 2S 0.28366 0.14183 0.14183 0.00000
211 3S 0.57501 0.28751 0.28751 0.00000
212 4S 0.19502 0.09751 0.09751 0.00000
213 5PX 0.00002 0.00001 0.00001 0.00000
214 5PY 0.00046 0.00023 0.00023 0.00000
215 5PZ 0.00010 0.00005 0.00005 0.00000
216 6PX 0.00032 0.00016 0.00016 0.00000
217 6PY 0.00400 0.00200 0.00200 0.00000
218 6PZ 0.00101 0.00050 0.00050 0.00000
219 7PX 0.00125 0.00063 0.00063 0.00000
220 7PY 0.00803 0.00402 0.00402 0.00000
221 7PZ 0.00268 0.00134 0.00134 0.00000
222 8D 0 0.00001 0.00000 0.00000 0.00000
223 8D+1 0.00000 0.00000 0.00000 0.00000
224 8D-1 0.00002 0.00001 0.00001 0.00000
225 8D+2 0.00003 0.00002 0.00002 0.00000
226 8D-2 0.00000 0.00000 0.00000 0.00000
227 9D 0 0.00020 0.00010 0.00010 0.00000
228 9D+1 0.00000 0.00000 0.00000 0.00000
229 9D-1 0.00018 0.00009 0.00009 0.00000
230 9D+2 0.00021 0.00010 0.00010 0.00000
231 9D-2 0.00019 0.00009 0.00009 0.00000
232 10F 0 0.00000 0.00000 0.00000 0.00000
233 10F+1 0.00000 0.00000 0.00000 0.00000
234 10F-1 0.00001 0.00000 0.00000 0.00000
235 10F+2 0.00000 0.00000 0.00000 0.00000
236 10F-2 0.00000 0.00000 0.00000 0.00000
237 10F+3 0.00001 0.00000 0.00000 0.00000
238 10F-3 0.00001 0.00000 0.00000 0.00000
239 7 H 1S 0.06183 0.03092 0.03092 0.00000
240 2S 0.28366 0.14183 0.14183 0.00000
241 3S 0.57501 0.28751 0.28751 0.00000
242 4S 0.19502 0.09751 0.09751 0.00000
243 5PX 0.00035 0.00018 0.00018 0.00000
244 5PY 0.00013 0.00007 0.00007 0.00000
245 5PZ 0.00010 0.00005 0.00005 0.00000
246 6PX 0.00308 0.00154 0.00154 0.00000
247 6PY 0.00124 0.00062 0.00062 0.00000
248 6PZ 0.00101 0.00050 0.00050 0.00000
249 7PX 0.00634 0.00317 0.00317 0.00000
250 7PY 0.00295 0.00147 0.00147 0.00000
251 7PZ 0.00268 0.00134 0.00134 0.00000
252 8D 0 0.00001 0.00000 0.00000 0.00000
253 8D+1 0.00002 0.00001 0.00001 0.00000
254 8D-1 0.00001 0.00000 0.00000 0.00000
255 8D+2 0.00001 0.00001 0.00001 0.00000
256 8D-2 0.00003 0.00001 0.00001 0.00000
257 9D 0 0.00020 0.00010 0.00010 0.00000
258 9D+1 0.00014 0.00007 0.00007 0.00000
259 9D-1 0.00005 0.00002 0.00002 0.00000
260 9D+2 0.00019 0.00010 0.00010 0.00000
261 9D-2 0.00020 0.00010 0.00010 0.00000
262 10F 0 0.00000 0.00000 0.00000 0.00000
263 10F+1 0.00001 0.00000 0.00000 0.00000
264 10F-1 0.00000 0.00000 0.00000 0.00000
265 10F+2 0.00000 0.00000 0.00000 0.00000
266 10F-2 0.00000 0.00000 0.00000 0.00000
267 10F+3 0.00001 0.00000 0.00000 0.00000
268 10F-3 0.00001 0.00000 0.00000 0.00000
269 8 H 1S 0.06183 0.03092 0.03092 0.00000
270 2S 0.28366 0.14183 0.14183 0.00000
271 3S 0.57501 0.28751 0.28751 0.00000
272 4S 0.19502 0.09751 0.09751 0.00000
273 5PX 0.00035 0.00018 0.00018 0.00000
274 5PY 0.00013 0.00007 0.00007 0.00000
275 5PZ 0.00010 0.00005 0.00005 0.00000
276 6PX 0.00308 0.00154 0.00154 0.00000
277 6PY 0.00124 0.00062 0.00062 0.00000
278 6PZ 0.00101 0.00050 0.00050 0.00000
279 7PX 0.00634 0.00317 0.00317 0.00000
280 7PY 0.00295 0.00147 0.00147 0.00000
281 7PZ 0.00268 0.00134 0.00134 0.00000
282 8D 0 0.00001 0.00000 0.00000 0.00000
283 8D+1 0.00002 0.00001 0.00001 0.00000
284 8D-1 0.00001 0.00000 0.00000 0.00000
285 8D+2 0.00001 0.00001 0.00001 0.00000
286 8D-2 0.00003 0.00001 0.00001 0.00000
287 9D 0 0.00020 0.00010 0.00010 0.00000
288 9D+1 0.00014 0.00007 0.00007 0.00000
289 9D-1 0.00005 0.00002 0.00002 0.00000
290 9D+2 0.00019 0.00010 0.00010 0.00000
291 9D-2 0.00020 0.00010 0.00010 0.00000
292 10F 0 0.00000 0.00000 0.00000 0.00000
293 10F+1 0.00001 0.00000 0.00000 0.00000
294 10F-1 0.00000 0.00000 0.00000 0.00000
295 10F+2 0.00000 0.00000 0.00000 0.00000
296 10F-2 0.00000 0.00000 0.00000 0.00000
297 10F+3 0.00001 0.00000 0.00000 0.00000
298 10F-3 0.00001 0.00000 0.00000 0.00000
Condensed to atoms (all electrons):
1 2 3 4 5 6
1 Si 12.068741 0.428010 0.396470 0.396470 0.396470 -0.029653
2 Si 0.428010 12.068741 -0.029653 -0.029653 -0.029653 0.396470
3 H 0.396470 -0.029653 0.798463 -0.016518 -0.016518 0.000834
4 H 0.396470 -0.029653 -0.016518 0.798463 -0.016518 0.000594
5 H 0.396470 -0.029653 -0.016518 -0.016518 0.798463 0.000594
6 H -0.029653 0.396470 0.000834 0.000594 0.000594 0.798463
7 H -0.029653 0.396470 0.000594 0.000594 0.000834 -0.016518
8 H -0.029653 0.396470 0.000594 0.000834 0.000594 -0.016518
7 8
1 Si -0.029653 -0.029653
2 Si 0.396470 0.396470
3 H 0.000594 0.000594
4 H 0.000594 0.000834
5 H 0.000834 0.000594
6 H -0.016518 -0.016518
7 H 0.798463 -0.016518
8 H -0.016518 0.798463
Atomic-Atomic Spin Densities.
1 2 3 4 5 6
1 Si 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
2 Si 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
3 H 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
4 H 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
5 H 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
6 H 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
7 H 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
8 H 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
7 8
1 Si 0.000000 0.000000
2 Si 0.000000 0.000000
3 H 0.000000 0.000000
4 H 0.000000 0.000000
5 H 0.000000 0.000000
6 H 0.000000 0.000000
7 H 0.000000 0.000000
8 H 0.000000 0.000000
Mulliken charges and spin densities:
1 2
1 Si 0.402797 0.000000
2 Si 0.402797 0.000000
3 H -0.134266 0.000000
4 H -0.134266 0.000000
5 H -0.134266 0.000000
6 H -0.134266 0.000000
7 H -0.134266 0.000000
8 H -0.134266 0.000000
Sum of Mulliken charges = 0.00000 0.00000
Mulliken charges and spin densities with hydrogens summed into heavy atoms:
1 2
1 Si 0.000000 0.000000
2 Si 0.000000 0.000000
Electronic spatial extent (au): <R**2>= 313.4953
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= -31.7898 YY= -31.7898 ZZ= -32.9147
XY= 0.0000 XZ= 0.0000 YZ= 0.0000
Traceless Quadrupole moment (field-independent basis, Debye-Ang):
XX= 0.3750 YY= 0.3750 ZZ= -0.7499
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= 0.0000
Hexadecapole moment (field-independent basis, Debye-Ang**3):
XXXX= -84.5719 YYYY= -84.5719 ZZZZ= -360.4559 XXXY= 0.0000
XXXZ= 0.0000 YYYX= 0.0000 YYYZ= -2.7320 ZZZX= 0.0000
ZZZY= 0.0000 XXYY= -28.1906 XXZZ= -79.9002 YYZZ= -79.9002
XXYZ= 2.7320 YYXZ= 0.0000 ZZXY= 0.0000
N-N= 9.044373104296D+01 E-N=-1.567200515193D+03 KE= 5.814222159296D+02
Symmetry AG KE= 2.657872122226D+02
Symmetry BG KE= 2.608815006856D+01
Symmetry AU KE= 2.602006585382D+01
Symmetry BU KE= 2.635267877846D+02
Orbital energies and kinetic energies (alpha):
1 2
1 (A1G)--O -68.771137 92.240162
2 (A2U)--O -68.771136 92.240198
3 (A1G)--O -6.121560 13.234075
4 (A2U)--O -6.121419 13.238099
5 (A1G)--O -4.227910 12.190119
6 (EU)--O -4.227601 12.195372
7 (EU)--O -4.227601 12.195372
8 (EG)--O -4.227523 12.197007
9 (EG)--O -4.227523 12.197007
10 (A2U)--O -4.227227 12.206140
11 (A1G)--O -0.755829 1.091498
12 (A2U)--O -0.678697 1.068924
13 (EU)--O -0.499279 0.814661
14 (EU)--O -0.499279 0.814661
15 (EG)--O -0.473248 0.847068
16 (EG)--O -0.473248 0.847068
17 (A1G)--O -0.404878 1.093677
18 (A2U)--V 0.092046 0.359585
19 (EU)--V 0.118783 0.393523
20 (EU)--V 0.118783 0.393523
21 (A1G)--V 0.120945 0.414254
22 (EG)--V 0.136635 0.258092
23 (EG)--V 0.136635 0.258092
24 (A1G)--V 0.168957 0.385714
25 (EU)--V 0.186410 0.527294
26 (EU)--V 0.186410 0.527294
27 (A2U)--V 0.187082 0.566611
28 (EG)--V 0.219207 0.502878
29 (EG)--V 0.219207 0.502878
30 (A2U)--V 0.246995 1.085419
31 (EU)--V 0.270888 0.467597
32 (EU)--V 0.270888 0.467597
33 (EG)--V 0.336080 0.530669
34 (EG)--V 0.336080 0.530669
35 (A1G)--V 0.339312 0.491208
36 (EU)--V 0.343454 0.573679
37 (EU)--V 0.343454 0.573679
38 (A1G)--V 0.362897 0.740741
39 (A2U)--V 0.397727 0.764634
40 (EG)--V 0.429479 0.684110
41 (EG)--V 0.429479 0.684110
42 (A2U)--V 0.462776 1.122003
43 (EG)--V 0.521734 0.914808
44 (EG)--V 0.521734 0.914808
45 (A1G)--V 0.525741 1.210099
46 (A2U)--V 0.561761 1.173202
47 (EU)--V 0.641562 0.916826
48 (EU)--V 0.641562 0.916826
49 (A1U)--V 0.654272 0.805721
50 (A1G)--V 0.679726 1.041204
51 (A2G)--V 0.687404 0.832114
52 (EG)--V 0.741416 1.306341
53 (EG)--V 0.741416 1.306341
54 (EU)--V 0.760439 1.408263
55 (EU)--V 0.760439 1.408263
56 (A2U)--V 0.809244 1.059651
57 (EG)--V 0.813940 1.122756
58 (EG)--V 0.813940 1.122756
59 (EU)--V 0.830007 1.099358
60 (EU)--V 0.830007 1.099358
61 (EU)--V 0.838294 1.080527
62 (EU)--V 0.838294 1.080527
63 (A1G)--V 0.889859 1.520062
64 (EG)--V 0.890827 1.267954
65 (EG)--V 0.890827 1.267954
66 (A1G)--V 0.934508 1.400576
67 (A2U)--V 0.954630 1.198776
68 (A1U)--V 0.955164 1.036812
69 (EU)--V 0.972378 1.488974
70 (EU)--V 0.972378 1.488974
71 (A2U)--V 0.973640 1.835759
72 (EU)--V 1.032653 1.375607
73 (EU)--V 1.032653 1.375607
74 (EG)--V 1.050413 1.432689
75 (EG)--V 1.050413 1.432689
76 (A1G)--V 1.050983 1.248716
77 (EG)--V 1.081048 1.269065
78 (EG)--V 1.081048 1.269065
79 (EG)--V 1.192660 1.730157
80 (EG)--V 1.192660 1.730157
81 (A2U)--V 1.204064 1.529500
82 (A2G)--V 1.227620 1.342463
83 (EU)--V 1.236714 1.437078
84 (EU)--V 1.236714 1.437078
85 (A1G)--V 1.238073 2.372638
86 (EG)--V 1.259139 1.588836
87 (EG)--V 1.259139 1.588836
88 (A2U)--V 1.269142 2.903583
89 (EU)--V 1.352330 1.646739
90 (EU)--V 1.352330 1.646739
91 (A2U)--V 1.442575 2.402543
92 (A1G)--V 1.448734 2.461607
93 (EU)--V 1.476518 2.691169
94 (EU)--V 1.476518 2.691169
95 (EG)--V 1.493227 2.679163
96 (EG)--V 1.493227 2.679163
97 (A1G)--V 1.640786 3.219634
98 (A2U)--V 1.704768 2.820769
99 (A1G)--V 1.873169 2.547245
100 (EU)--V 1.897908 2.395656
101 (EU)--V 1.897908 2.395656
102 (EG)--V 1.905274 2.408587
103 (EG)--V 1.905274 2.408587
104 (EU)--V 1.953158 2.353112
105 (EU)--V 1.953158 2.353112
106 (A1U)--V 1.959508 2.400555
107 (A2G)--V 2.020138 2.397441
108 (EG)--V 2.026335 2.456840
109 (EG)--V 2.026335 2.456840
110 (A2U)--V 2.118931 3.111182
111 (EG)--V 2.143449 2.644444
112 (EG)--V 2.143449 2.644444
113 (EU)--V 2.220353 2.924058
114 (EU)--V 2.220353 2.924058
115 (A1G)--V 2.236534 2.903152
116 (A2U)--V 2.243009 2.791839
117 (EU)--V 2.252217 3.201260
118 (EU)--V 2.252217 3.201260
119 (EG)--V 2.281044 2.887854
120 (EG)--V 2.281044 2.887854
121 (A1G)--V 2.281044 3.010373
122 (A1U)--V 2.287141 2.468364
123 (EU)--V 2.368716 2.894222
124 (EU)--V 2.368716 2.894222
125 (A2U)--V 2.408079 2.923789
126 (EG)--V 2.415046 2.965760
127 (EG)--V 2.415046 2.965760
128 (EG)--V 2.442066 3.170004
129 (EG)--V 2.442066 3.170004
130 (A2G)--V 2.452624 2.673158
131 (A1U)--V 2.464049 2.797730
132 (EU)--V 2.472533 3.896821
133 (EU)--V 2.472533 3.896821
134 (A1G)--V 2.484101 3.198408
135 (A2U)--V 2.500664 3.030045
136 (A2G)--V 2.561274 2.938995
137 (EU)--V 2.566764 3.044060
138 (EU)--V 2.566764 3.044060
139 (EG)--V 2.578065 3.662534
140 (EG)--V 2.578065 3.662534
141 (EU)--V 2.579789 2.911300
142 (EU)--V 2.579789 2.911300
143 (A1G)--V 2.586465 2.814756
144 (EG)--V 2.636463 2.984394
145 (EG)--V 2.636463 2.984394
146 (A2U)--V 2.653803 2.985909
147 (EG)--V 2.688136 3.183057
148 (EG)--V 2.688136 3.183057
149 (A2U)--V 2.734183 3.274010
150 (A1G)--V 2.737159 3.230598
151 (EU)--V 2.746315 3.022524
152 (EU)--V 2.746315 3.022524
153 (A1U)--V 2.810890 3.023495
154 (EG)--V 2.844718 3.124870
155 (EG)--V 2.844718 3.124870
156 (EU)--V 2.854811 3.209682
157 (EU)--V 2.854811 3.209682
158 (A1G)--V 2.872055 3.660639
159 (EU)--V 2.970126 3.268133
160 (EU)--V 2.970126 3.268133
161 (A1G)--V 2.982842 3.926851
162 (A2G)--V 3.005143 3.223385
163 (EG)--V 3.033098 3.438242
164 (EG)--V 3.033098 3.438242
165 (A2U)--V 3.054336 3.727047
166 (A2U)--V 3.107843 4.058985
167 (EG)--V 3.145745 3.874899
168 (EG)--V 3.145745 3.874899
169 (EU)--V 3.177185 4.097054
170 (EU)--V 3.177185 4.097054
171 (EU)--V 3.222938 3.531682
172 (EU)--V 3.222938 3.531682
173 (EG)--V 3.313584 3.871165
174 (EG)--V 3.313584 3.871165
175 (A1G)--V 3.428566 4.814883
176 (EG)--V 3.478314 3.804382
177 (EG)--V 3.478314 3.804382
178 (A2U)--V 3.500785 4.504403
179 (EU)--V 3.508359 3.858702
180 (EU)--V 3.508359 3.858702
181 (A2U)--V 3.632300 4.261734
182 (EU)--V 3.649992 4.350940
183 (EU)--V 3.649992 4.350940
184 (A1G)--V 3.683178 4.319860
185 (EG)--V 3.740937 4.873470
186 (EG)--V 3.740937 4.873470
187 (EG)--V 3.769938 4.324479
188 (EG)--V 3.769938 4.324479
189 (A1U)--V 3.799256 4.294094
190 (A1G)--V 3.839218 4.930089
191 (EU)--V 3.845976 4.655640
192 (EU)--V 3.845976 4.655640
193 (A2G)--V 3.954117 4.417116
194 (A2U)--V 4.130756 5.423930
195 (A2G)--V 6.078212 6.293514
196 (A1U)--V 6.079570 6.294253
197 (EG)--V 6.113195 6.336833
198 (EG)--V 6.113195 6.336833
199 (EU)--V 6.115860 6.348626
200 (EU)--V 6.115860 6.348626
201 (EG)--V 6.139559 6.374256
202 (EG)--V 6.139559 6.374256
203 (EU)--V 6.163605 6.381696
204 (EU)--V 6.163605 6.381696
205 (A1G)--V 6.212968 6.438888
206 (A2U)--V 6.227914 6.537546
207 (A2U)--V 6.269543 6.879409
208 (A1U)--V 6.316765 6.576833
209 (A1G)--V 6.349179 6.650891
210 (EG)--V 6.373028 6.788344
211 (EG)--V 6.373028 6.788344
212 (A2G)--V 6.391646 6.660174
213 (EU)--V 6.405465 6.742691
214 (EU)--V 6.405465 6.742691
215 (EU)--V 6.489787 6.904613
216 (EU)--V 6.489787 6.904613
217 (A2U)--V 6.520110 7.019423
218 (EG)--V 6.542897 6.936716
219 (EG)--V 6.542897 6.936716
220 (A1G)--V 6.564949 7.171475
221 (EU)--V 6.661848 7.288990
222 (EU)--V 6.661848 7.288990
223 (A2U)--V 6.667733 7.478969
224 (EG)--V 6.686427 7.147980
225 (EG)--V 6.686427 7.147980
226 (A1G)--V 6.709556 7.569773
227 (EG)--V 6.794154 7.356132
228 (EG)--V 6.794154 7.356132
229 (EU)--V 6.801560 7.292558
230 (EU)--V 6.801560 7.292558
231 (EG)--V 6.873614 7.387600
232 (EG)--V 6.873614 7.387600
233 (EU)--V 6.982638 7.379564
234 (EU)--V 6.982638 7.379564
235 (A1U)--V 7.048401 7.519466
236 (A2G)--V 7.089823 7.569489
237 (A1G)--V 7.258120 9.460472
238 (A2U)--V 7.593510 9.506998
239 (EG)--V 7.600454 9.717705
240 (EG)--V 7.600454 9.717705
241 (EU)--V 7.688775 9.810745
242 (EU)--V 7.688775 9.810745
243 (A2U)--V 7.908907 9.979915
244 (A1G)--V 7.962622 9.516766
245 (EG)--V 8.011758 9.274992
246 (EG)--V 8.011758 9.274992
247 (EU)--V 8.044040 9.360613
248 (EU)--V 8.044040 9.360613
249 (EG)--V 8.213396 9.008490
250 (EG)--V 8.213396 9.008490
251 (EU)--V 8.221736 8.957237
252 (EU)--V 8.221736 8.957237
253 (A1G)--V 8.226466 9.257272
254 (A2U)--V 8.232758 9.325213
255 (A1U)--V 8.306800 8.791254
256 (EG)--V 8.338109 9.155157
257 (EG)--V 8.338109 9.155157
258 (A2G)--V 8.354982 8.825229
259 (EU)--V 8.374859 9.129953
260 (EU)--V 8.374859 9.129953
261 (A1U)--V 8.416612 9.134217
262 (A2U)--V 8.444352 10.123263
263 (EG)--V 8.445009 8.966170
264 (EG)--V 8.445009 8.966170
265 (EU)--V 8.487050 9.114595
266 (EU)--V 8.487050 9.114595
267 (EG)--V 8.490240 8.994644
268 (EG)--V 8.490240 8.994644
269 (A2G)--V 8.512695 9.232107
270 (A1G)--V 8.525513 9.003994
271 (EU)--V 8.545708 9.023606
272 (EU)--V 8.545708 9.023606
273 (A1G)--V 8.649687 11.744935
274 (A2U)--V 8.662889 10.299738
275 (A1U)--V 8.869321 9.385365
276 (EG)--V 8.949901 9.492832
277 (EG)--V 8.949901 9.492832
278 (EU)--V 9.024476 9.574612
279 (EU)--V 9.024476 9.574612
280 (A2U)--V 9.064794 9.643597
281 (A2G)--V 9.079509 9.600722
282 (EU)--V 9.116236 9.631558
283 (EU)--V 9.116236 9.631558
284 (EG)--V 9.125826 9.630750
285 (EG)--V 9.125826 9.630750
286 (A1G)--V 9.154793 10.001619
287 (EG)--V 9.342376 10.137446
288 (EG)--V 9.342376 10.137446
289 (EU)--V 9.382627 10.225044
290 (EU)--V 9.382627 10.225044
291 (A1G)--V 9.498566 10.427377
292 (A2U)--V 9.521501 10.484174
293 (EG)--V 10.457152 14.316862
294 (EG)--V 10.457152 14.316862
295 (EU)--V 10.484522 14.462798
296 (EU)--V 10.484522 14.462798
297 (A1G)--V 13.127289 19.690561
298 (A2U)--V 13.403476 20.057730
Total kinetic energy from orbitals= 5.814222159295D+02
Isotropic Fermi Contact Couplings
Atom a.u. MegaHertz Gauss 10(-4) cm-1
1 Si(29) 0.00000 0.00000 0.00000 0.00000
2 Si(29) 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
6 H(1) 0.00000 0.00000 0.00000 0.00000
7 H(1) 0.00000 0.00000 0.00000 0.00000
8 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
6 Atom 0.000000 0.000000 0.000000
7 Atom 0.000000 0.000000 0.000000
8 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
6 Atom 0.000000 0.000000 0.000000
7 Atom 0.000000 0.000000 0.000000
8 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 Si(29) 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 Si(29) 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
Baa 0.0000 0.000 0.000 0.000 1.0000 0.0000 0.0000
6 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
7 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
8 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 Sat Mar 30 21:39:53 2019, MaxMem= 33554432 cpu: 0.8
(Enter /share/apps/gaussian/g09d01/nehalem/g09/l9999.exe)
1\1\GINC-COMPUTE-7-0\SP\ROCCSD(T)-FC\CC-pVQZ\H6Si2\LOOS\30-Mar-2019\0\
\#p ROCCSD(T) cc-pVQZ pop=full gfprint\\G2\\0,1\Si\Si,1,2.35421744\H,1
,1.48548901,2,110.49912192\H,1,1.48548901,2,110.49912192,3,120.,0\H,1,
1.48548901,2,110.49912192,3,-120.,0\H,2,1.48548901,1,110.49912192,3,18
0.,0\H,2,1.48548901,1,110.49912192,6,120.,0\H,2,1.48548901,1,110.49912
192,6,-120.,0\\Version=ES64L-G09RevD.01\State=1-A1G\HF=-581.3805126\MP
2=-581.6633379\MP3=-581.7031514\PUHF=-581.3805126\PMP2-0=-581.6633379\
MP4SDQ=-581.708942\CCSD=-581.7098042\CCSD(T)=-581.7202193\RMSD=1.483e-
09\PG=D03D [C3(Si1.Si1),3SGD(H2)]\\@
THE WORLD IS MADE UP OF THE WILLS, THE WON'TS, AND THE CANT'S:
THE WILLS DO EVERYTHING,
THE WON'TS DO NOTHING,
THE CAN'TS CAN'T DO ANYTHING.
-- FROM WALT DISNEY'S "BLACK HOLE"
Job cpu time: 0 days 1 hours 11 minutes 21.4 seconds.
File lengths (MBytes): RWF= 3316 Int= 0 D2E= 0 Chk= 8 Scr= 1
Normal termination of Gaussian 09 at Sat Mar 30 21:39:54 2019.
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