Entering Gaussian System, Link 0=g09
Initial command:
/usr/common/software/g09/c1/g09/l1.exe /global/cscratch1/sd/lucchese/Gau-49025.inp -scrdir=/global/cscratch1/sd/lucchese/
Entering Link 1 = /usr/common/software/g09/c1/g09/l1.exe PID= 49027.
Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2011,
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 C.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, 2010.
******************************************
Gaussian 09: EM64L-G09RevC.01 23-Sep-2011
11-Oct-2017
******************************************
%mem=16gb
%nprocshared=8
Will use up to 8 processors via shared memory.
-----------------------------------------------------
# rhf/6-311G(2d,2p) 6D 10F scf=tight Gfinput PUNCH=MO
-----------------------------------------------------
1/38=1/1;
2/12=2,17=6,18=5,40=1/2;
3/5=4,6=6,7=202,8=22,11=1,16=1,24=10,25=1,30=1,116=1/1,2,3;
4//1;
5/5=2,32=2,38=5/2;
6/7=2,8=2,9=2,10=2,28=1/1;
99/5=1,9=1,10=32/99;
----------------
SiH4 triple zeta
----------------
Charge = 0 Multiplicity = 1
Symbolic Z-Matrix:
SI
H 1 R
H 1 R 2 T
H 1 R 2 T 3 T 1
H 1 R 2 T 3 T -1
Variables:
R 1.462
T 109.47122
5 tetrahedral angles replaced.
5 tetrahedral angles replaced.
Input orientation:
---------------------------------------------------------------------
Center Atomic Atomic Coordinates (Angstroms)
Number Number Type X Y Z
---------------------------------------------------------------------
1 14 0 0.000000 0.000000 0.000000
2 1 0 0.000000 0.000000 1.462000
3 1 0 1.378387 0.000000 -0.487333
4 1 0 -0.689193 1.193718 -0.487333
5 1 0 -0.689193 -1.193718 -0.487333
---------------------------------------------------------------------
Distance matrix (angstroms):
1 2 3 4 5
1 Si 0.000000
2 H 1.462000 0.000000
3 H 1.462000 2.387436 0.000000
4 H 1.462000 2.387436 2.387436 0.000000
5 H 1.462000 2.387436 2.387436 2.387436 0.000000
Stoichiometry H4Si
Framework group TD[O(Si),4C3(H)]
Deg. of freedom 1
Full point group TD NOp 24
Largest Abelian subgroup D2 NOp 4
Largest concise Abelian subgroup D2 NOp 4
Standard orientation:
---------------------------------------------------------------------
Center Atomic Atomic Coordinates (Angstroms)
Number Number Type X Y Z
---------------------------------------------------------------------
1 14 0 0.000000 0.000000 0.000000
2 1 0 0.844086 0.844086 0.844086
3 1 0 -0.844086 -0.844086 0.844086
4 1 0 0.844086 -0.844086 -0.844086
5 1 0 -0.844086 0.844086 -0.844086
---------------------------------------------------------------------
Rotational constants (GHZ): 87.9768839 87.9768839 87.9768839
Standard basis: 6-311G(2d,2p) (6D, 10F)
AO basis set in the form of general basis input (Overlap normalization):
1 0
S 6 1.00 0.000000000000
0.6937923000D+05 0.7570004081D-03
0.1035494000D+05 0.5932003198D-02
0.2333879600D+04 0.3108801676D-01
0.6571429500D+03 0.1249670674D+00
0.2143011300D+03 0.3868972086D+00
0.7762916800D+02 0.5548882991D+00
S 3 1.00 0.000000000000
0.7762916800D+02 0.1778809451D+00
0.3063080700D+02 0.6277648062D+00
0.1280129500D+02 0.2476229236D+00
S 1 1.00 0.000000000000
0.3926866000D+01 0.1000000000D+01
S 1 1.00 0.000000000000
0.1452343000D+01 0.1000000000D+01
S 1 1.00 0.000000000000
0.2562340000D+00 0.1000000000D+01
S 1 1.00 0.000000000000
0.9427900000D-01 0.1000000000D+01
P 4 1.00 0.000000000000
0.3354831900D+03 0.8865998148D-02
0.7890036600D+02 0.6829898573D-01
0.2498815000D+02 0.2909579392D+00
0.9219711000D+01 0.7321168470D+00
P 2 1.00 0.000000000000
0.3621140000D+01 0.6198794404D+00
0.1451310000D+01 0.4391483120D+00
P 1 1.00 0.000000000000
0.5049770000D+00 0.1000000000D+01
P 1 1.00 0.000000000000
0.1863170000D+00 0.1000000000D+01
P 1 1.00 0.000000000000
0.6543200000D-01 0.1000000000D+01
D 1 1.00 0.000000000000
0.9000000000D+00 0.1000000000D+01
D 1 1.00 0.000000000000
0.2250000000D+00 0.1000000000D+01
****
2 0
S 3 1.00 0.000000000000
0.3386500000D+02 0.2549381454D-01
0.5094790000D+01 0.1903731086D+00
0.1158790000D+01 0.8521614860D+00
S 1 1.00 0.000000000000
0.3258400000D+00 0.1000000000D+01
S 1 1.00 0.000000000000
0.1027410000D+00 0.1000000000D+01
P 1 1.00 0.000000000000
0.1500000000D+01 0.1000000000D+01
P 1 1.00 0.000000000000
0.3750000000D+00 0.1000000000D+01
****
3 0
S 3 1.00 0.000000000000
0.3386500000D+02 0.2549381454D-01
0.5094790000D+01 0.1903731086D+00
0.1158790000D+01 0.8521614860D+00
S 1 1.00 0.000000000000
0.3258400000D+00 0.1000000000D+01
S 1 1.00 0.000000000000
0.1027410000D+00 0.1000000000D+01
P 1 1.00 0.000000000000
0.1500000000D+01 0.1000000000D+01
P 1 1.00 0.000000000000
0.3750000000D+00 0.1000000000D+01
****
4 0
S 3 1.00 0.000000000000
0.3386500000D+02 0.2549381454D-01
0.5094790000D+01 0.1903731086D+00
0.1158790000D+01 0.8521614860D+00
S 1 1.00 0.000000000000
0.3258400000D+00 0.1000000000D+01
S 1 1.00 0.000000000000
0.1027410000D+00 0.1000000000D+01
P 1 1.00 0.000000000000
0.1500000000D+01 0.1000000000D+01
P 1 1.00 0.000000000000
0.3750000000D+00 0.1000000000D+01
****
5 0
S 3 1.00 0.000000000000
0.3386500000D+02 0.2549381454D-01
0.5094790000D+01 0.1903731086D+00
0.1158790000D+01 0.8521614860D+00
S 1 1.00 0.000000000000
0.3258400000D+00 0.1000000000D+01
S 1 1.00 0.000000000000
0.1027410000D+00 0.1000000000D+01
P 1 1.00 0.000000000000
0.1500000000D+01 0.1000000000D+01
P 1 1.00 0.000000000000
0.3750000000D+00 0.1000000000D+01
****
There are 21 symmetry adapted basis functions of A symmetry.
There are 16 symmetry adapted basis functions of B1 symmetry.
There are 16 symmetry adapted basis functions of B2 symmetry.
There are 16 symmetry adapted basis functions of B3 symmetry.
Integral buffers will be 131072 words long.
Raffenetti 1 integral format.
Two-electron integral symmetry is turned on.
69 basis functions, 96 primitive gaussians, 69 cartesian basis functions
9 alpha electrons 9 beta electrons
nuclear repulsion energy 21.5993467154 Hartrees.
NAtoms= 5 NActive= 5 NUniq= 2 SFac= 4.00D+00 NAtFMM= 60 NAOKFM=F Big=F
One-electron integrals computed using PRISM.
NBasis= 69 RedAO= T NBF= 21 16 16 16
NBsUse= 69 1.00D-06 NBFU= 21 16 16 16
Harris functional with IExCor= 205 diagonalized for initial guess.
ExpMin= 6.54D-02 ExpMax= 6.94D+04 ExpMxC= 2.33D+03 IAcc=2 IRadAn= 4 AccDes= 0.00D+00
HarFok: IExCor= 205 AccDes= 0.00D+00 IRadAn= 4 IDoV= 1
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
Omega= 0.000000 0.000000 1.000000 0.000000 0.000000 ICntrl= 500 IOpCl= 0
NMat0= 1 NMatS0= 1 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0
I1Cent= 4 NGrid= 0.
Petite list used in FoFCou.
Initial guess orbital symmetries:
Occupied (A1) (A1) (T2) (T2) (T2) (A1) (T2) (T2) (T2)
Virtual (T2) (T2) (T2) (A1) (T2) (T2) (T2) (E) (E) (A1)
(T2) (T2) (T2) (A1) (T2) (T2) (T2) (T1) (T1) (T1)
(T2) (T2) (T2) (A1) (E) (E) (T2) (T2) (T2) (A1)
(T2) (T2) (T2) (E) (E) (T2) (T2) (T2) (A1) (T2)
(T2) (T2) (A1) (T1) (T1) (T1) (E) (E) (T2) (T2)
(T2) (A1) (T2) (T2) (T2) (A1) (T2) (T2) (T2) (A1)
The electronic state of the initial guess is 1-A1.
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.
Keep R1 ints in memory in canonical form, NReq=3771807.
SCF Done: E(RHF) = -291.256990676 A.U. after 9 cycles
Convg = 0.2201D-08 -V/T = 2.0000
**********************************************************************
Population analysis using the SCF density.
**********************************************************************
Orbital symmetries:
Occupied (A1) (A1) (T2) (T2) (T2) (A1) (T2) (T2) (T2)
Virtual (T2) (T2) (T2) (A1) (T2) (T2) (T2) (A1) (E) (E)
(T2) (T2) (T2) (A1) (T2) (T2) (T2) (T1) (T1) (T1)
(T2) (T2) (T2) (A1) (T2) (T2) (T2) (E) (E) (A1)
(T2) (T2) (T2) (E) (E) (T2) (T2) (T2) (A1) (T2)
(T2) (T2) (A1) (T1) (T1) (T1) (E) (E) (T2) (T2)
(T2) (A1) (T2) (T2) (T2) (A1) (T2) (T2) (T2) (A1)
The electronic state is 1-A1.
Alpha occ. eigenvalues -- -68.76864 -6.11723 -4.22409 -4.22409 -4.22409
Alpha occ. eigenvalues -- -0.73428 -0.48893 -0.48893 -0.48893
Alpha virt. eigenvalues -- 0.13991 0.13991 0.13991 0.16271 0.26447
Alpha virt. eigenvalues -- 0.26447 0.26447 0.37997 0.41638 0.41638
Alpha virt. eigenvalues -- 0.46474 0.46474 0.46474 0.53479 0.84037
Alpha virt. eigenvalues -- 0.84037 0.84037 0.84052 0.84052 0.84052
Alpha virt. eigenvalues -- 0.99542 0.99542 0.99542 1.09205 1.27085
Alpha virt. eigenvalues -- 1.27085 1.27085 1.27970 1.27970 1.41777
Alpha virt. eigenvalues -- 1.53007 1.53007 1.53007 2.01862 2.01862
Alpha virt. eigenvalues -- 2.07642 2.07642 2.07642 2.77581 3.08136
Alpha virt. eigenvalues -- 3.08136 3.08136 3.24331 4.15792 4.15792
Alpha virt. eigenvalues -- 4.15792 4.18282 4.18282 4.25544 4.25544
Alpha virt. eigenvalues -- 4.25544 4.45169 4.46850 4.46850 4.46850
Alpha virt. eigenvalues -- 9.19169 12.23074 12.23074 12.23074 147.89411
Condensed to atoms (all electrons):
1 2 3 4 5
1 Si 11.516636 0.393928 0.393928 0.393928 0.393928
2 H 0.393928 0.906781 -0.024599 -0.024599 -0.024599
3 H 0.393928 -0.024599 0.906781 -0.024599 -0.024599
4 H 0.393928 -0.024599 -0.024599 0.906781 -0.024599
5 H 0.393928 -0.024599 -0.024599 -0.024599 0.906781
Mulliken atomic charges:
1
1 Si 0.907653
2 H -0.226913
3 H -0.226913
4 H -0.226913
5 H -0.226913
Sum of Mulliken atomic charges = 0.00000
Mulliken charges with hydrogens summed into heavy atoms:
1
1 Si 0.000000
Sum of Mulliken charges with hydrogens summed into heavy atoms = 0.00000
Electronic spatial extent (au): <R**2>= 67.7688
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= -16.6950 YY= -16.6950 ZZ= -16.6950
XY= 0.0000 XZ= 0.0000 YZ= 0.0000
Traceless Quadrupole moment (field-independent basis, Debye-Ang):
XX= 0.0000 YY= 0.0000 ZZ= 0.0000
XY= 0.0000 XZ= 0.0000 YZ= 0.0000
Octapole moment (field-independent basis, Debye-Ang**2):
XXX= 0.0000 YYY= 0.0000 ZZZ= 0.0000 XYY= 0.0000
XXY= 0.0000 XXZ= 0.0000 XZZ= 0.0000 YZZ= 0.0000
YYZ= 0.0000 XYZ= -1.4878
Hexadecapole moment (field-independent basis, Debye-Ang**3):
XXXX= -42.3573 YYYY= -42.3573 ZZZZ= -42.3573 XXXY= 0.0000
XXXZ= 0.0000 YYYX= 0.0000 YYYZ= 0.0000 ZZZX= 0.0000
ZZZY= 0.0000 XXYY= -14.0233 XXZZ= -14.0233 YYZZ= -14.0233
XXYZ= 0.0000 YYXZ= 0.0000 ZZXY= 0.0000
N-N= 2.159934671537D+01 E-N=-7.374653433061D+02 KE= 2.912710606482D+02
Symmetry A KE= 2.130318595799D+02
Symmetry B1 KE= 2.607973368943D+01
Symmetry B2 KE= 2.607973368943D+01
Symmetry B3 KE= 2.607973368943D+01
1\1\GINC-NID00122\SP\RHF\6-311G(2d,2p)\H4Si1\LUCCHESE\11-Oct-2017\0\\#
rhf/6-311G(2d,2p) 6D 10F scf=tight Gfinput PUNCH=MO\\SiH4 triple zeta
\\0,1\Si\H,1,1.462\H,1,1.462,2,109.47122063\H,1,1.462,2,109.47122063,3
,109.47122063,1\H,1,1.462,2,109.47122063,3,109.47122063,-1\\Version=EM
64L-G09RevC.01\State=1-A1\HF=-291.2569907\RMSD=2.201e-09\Dipole=0.,0.,
0.\Quadrupole=0.,0.,0.,0.,0.,0.\PG=TD [O(Si1),4C3(H1)]\\@
THE FIRST AND LAST THING REQUIRED OF GENIUS IS THE LOVE OF TRUTH.
-- GOETHE
Job cpu time: 0 days 0 hours 0 minutes 17.3 seconds.
File lengths (MBytes): RWF= 5 Int= 0 D2E= 0 Chk= 1 Scr= 1
Normal termination of Gaussian 09 at Wed Oct 11 16:58:04 2017.
(5D15.8)
1 Alpha MO OE=-0.68768638D+02
0.41779891D+00 0.64739283D+00 0.11017544D-01-0.14416884D-02-0.16767861D-02
-0.11743179D-02 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.80785330D-03 0.80785330D-03 0.80785330D-03 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.58722292D-03 0.58722292D-03 0.58722292D-03
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.17990219D-04-0.49188339D-04
0.13137048D-03-0.23865770D-05-0.23865770D-05-0.23865770D-05-0.66703467D-05
-0.66703467D-05-0.66703467D-05 0.17990219D-04-0.49188339D-04 0.13137048D-03
0.23865770D-05 0.23865770D-05-0.23865770D-05 0.66703467D-05 0.66703467D-05
-0.66703467D-05 0.17990219D-04-0.49188339D-04 0.13137048D-03-0.23865770D-05
0.23865770D-05 0.23865770D-05-0.66703467D-05 0.66703467D-05 0.66703467D-05
0.17990219D-04-0.49188339D-04 0.13137048D-03 0.23865770D-05-0.23865770D-05
0.23865770D-05 0.66703467D-05-0.66703467D-05 0.66703467D-05
2 Alpha MO OE=-0.61172275D+01
-0.11680439D+00-0.30849750D+00 0.55231183D+00 0.56189628D+00 0.31804126D-01
0.21449100D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.42949926D-03 0.42949926D-03 0.42949926D-03 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.10581538D-01-0.10581538D-01-0.10581538D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.59654535D-04 0.12168302D-02
-0.24040317D-02-0.59821452D-04-0.59821452D-04-0.59821452D-04 0.66065835D-04
0.66065835D-04 0.66065835D-04 0.59654535D-04 0.12168302D-02-0.24040317D-02
0.59821452D-04 0.59821452D-04-0.59821452D-04-0.66065835D-04-0.66065835D-04
0.66065835D-04 0.59654535D-04 0.12168302D-02-0.24040317D-02-0.59821452D-04
0.59821452D-04 0.59821452D-04 0.66065835D-04-0.66065835D-04-0.66065835D-04
0.59654535D-04 0.12168302D-02-0.24040317D-02 0.59821452D-04-0.59821452D-04
0.59821452D-04-0.66065835D-04 0.66065835D-04-0.66065835D-04
3 Alpha MO OE=-0.42240926D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.40018508D+00 0.00000000D+00 0.00000000D+00
0.69793047D+00 0.00000000D+00 0.00000000D+00 0.45660691D-01 0.00000000D+00
0.00000000D+00-0.45876123D-02 0.00000000D+00 0.00000000D+00 0.14803179D-02
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.22828245D-03 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.38236393D-03 0.00000000D+00 0.51278799D-03 0.84408276D-03
-0.34521326D-03-0.13746486D-03-0.11808343D-03-0.13746486D-03-0.69295975D-04
0.16449568D-03-0.69295975D-04-0.51278799D-03-0.84408276D-03 0.34521326D-03
-0.13746486D-03-0.11808343D-03 0.13746486D-03-0.69295975D-04 0.16449568D-03
0.69295975D-04-0.51278799D-03-0.84408276D-03 0.34521326D-03 0.13746486D-03
-0.11808343D-03-0.13746486D-03 0.69295975D-04 0.16449568D-03-0.69295975D-04
0.51278799D-03 0.84408276D-03-0.34521326D-03 0.13746486D-03-0.11808343D-03
0.13746486D-03 0.69295975D-04 0.16449568D-03 0.69295975D-04
4 Alpha MO OE=-0.42240926D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.40018508D+00 0.00000000D+00 0.00000000D+00 0.69793047D+00
0.00000000D+00 0.00000000D+00 0.45660691D-01 0.00000000D+00 0.00000000D+00
-0.45876123D-02 0.00000000D+00 0.00000000D+00 0.14803179D-02 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.22828245D-03 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.38236393D-03 0.51278799D-03 0.84408276D-03
-0.34521326D-03-0.11808343D-03-0.13746486D-03-0.13746486D-03 0.16449568D-03
-0.69295975D-04-0.69295975D-04-0.51278799D-03-0.84408276D-03 0.34521326D-03
-0.11808343D-03-0.13746486D-03 0.13746486D-03 0.16449568D-03-0.69295975D-04
0.69295975D-04 0.51278799D-03 0.84408276D-03-0.34521326D-03-0.11808343D-03
0.13746486D-03 0.13746486D-03 0.16449568D-03 0.69295975D-04 0.69295975D-04
-0.51278799D-03-0.84408276D-03 0.34521326D-03-0.11808343D-03 0.13746486D-03
-0.13746486D-03 0.16449568D-03 0.69295975D-04-0.69295975D-04
5 Alpha MO OE=-0.42240926D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.40018508D+00 0.00000000D+00
0.00000000D+00 0.69793047D+00 0.00000000D+00 0.00000000D+00 0.45660691D-01
0.00000000D+00 0.00000000D+00-0.45876123D-02 0.00000000D+00 0.00000000D+00
0.14803179D-02 0.00000000D+00 0.00000000D+00 0.00000000D+00-0.22828245D-03
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.38236393D-03 0.00000000D+00 0.00000000D+00 0.51278799D-03 0.84408276D-03
-0.34521326D-03-0.13746486D-03-0.13746486D-03-0.11808343D-03-0.69295975D-04
-0.69295975D-04 0.16449568D-03 0.51278799D-03 0.84408276D-03-0.34521326D-03
0.13746486D-03 0.13746486D-03-0.11808343D-03 0.69295975D-04 0.69295975D-04
0.16449568D-03-0.51278799D-03-0.84408276D-03 0.34521326D-03 0.13746486D-03
-0.13746486D-03-0.11808343D-03 0.69295975D-04-0.69295975D-04 0.16449568D-03
-0.51278799D-03-0.84408276D-03 0.34521326D-03-0.13746486D-03 0.13746486D-03
-0.11808343D-03-0.69295975D-04 0.69295975D-04 0.16449568D-03
6 Alpha MO OE=-0.73427654D+00
0.24644149D-01 0.68279800D-01-0.14832534D+00-0.26628194D+00 0.42210450D+00
0.20677535D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.59841893D-02 0.59841893D-02 0.59841893D-02 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.20208382D-02-0.20208382D-02-0.20208382D-02
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.73700153D-01 0.14384787D+00
0.43878578D-01-0.34759983D-02-0.34759983D-02-0.34759983D-02-0.13516164D-01
-0.13516164D-01-0.13516164D-01 0.73700153D-01 0.14384787D+00 0.43878578D-01
0.34759983D-02 0.34759983D-02-0.34759983D-02 0.13516164D-01 0.13516164D-01
-0.13516164D-01 0.73700153D-01 0.14384787D+00 0.43878578D-01-0.34759983D-02
0.34759983D-02 0.34759983D-02-0.13516164D-01 0.13516164D-01 0.13516164D-01
0.73700153D-01 0.14384787D+00 0.43878578D-01 0.34759983D-02-0.34759983D-02
0.34759983D-02 0.13516164D-01-0.13516164D-01 0.13516164D-01
7 Alpha MO OE=-0.48892541D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.66034671D-01 0.00000000D+00 0.00000000D+00-0.12441652D+00
0.00000000D+00 0.00000000D+00 0.14617822D+00 0.00000000D+00 0.00000000D+00
0.24072966D+00 0.00000000D+00 0.00000000D+00 0.46145494D-01 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.41529425D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.54563010D-01 0.96494787D-01 0.18708028D+00
0.12555766D+00-0.22248211D-02-0.40414873D-02-0.40414873D-02-0.10733949D-01
-0.14196031D-01-0.14196031D-01-0.96494787D-01-0.18708028D+00-0.12555766D+00
-0.22248211D-02-0.40414873D-02 0.40414873D-02-0.10733949D-01-0.14196031D-01
0.14196031D-01 0.96494787D-01 0.18708028D+00 0.12555766D+00-0.22248211D-02
0.40414873D-02 0.40414873D-02-0.10733949D-01 0.14196031D-01 0.14196031D-01
-0.96494787D-01-0.18708028D+00-0.12555766D+00-0.22248211D-02 0.40414873D-02
-0.40414873D-02-0.10733949D-01 0.14196031D-01-0.14196031D-01
8 Alpha MO OE=-0.48892541D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.66034671D-01 0.00000000D+00 0.00000000D+00
-0.12441652D+00 0.00000000D+00 0.00000000D+00 0.14617822D+00 0.00000000D+00
0.00000000D+00 0.24072966D+00 0.00000000D+00 0.00000000D+00 0.46145494D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.41529425D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.54563010D-01 0.00000000D+00 0.96494787D-01 0.18708028D+00
0.12555766D+00-0.40414873D-02-0.22248211D-02-0.40414873D-02-0.14196031D-01
-0.10733949D-01-0.14196031D-01-0.96494787D-01-0.18708028D+00-0.12555766D+00
-0.40414873D-02-0.22248211D-02 0.40414873D-02-0.14196031D-01-0.10733949D-01
0.14196031D-01-0.96494787D-01-0.18708028D+00-0.12555766D+00 0.40414873D-02
-0.22248211D-02-0.40414873D-02 0.14196031D-01-0.10733949D-01-0.14196031D-01
0.96494787D-01 0.18708028D+00 0.12555766D+00 0.40414873D-02-0.22248211D-02
0.40414873D-02 0.14196031D-01-0.10733949D-01 0.14196031D-01
9 Alpha MO OE=-0.48892541D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.66034671D-01 0.00000000D+00
0.00000000D+00-0.12441652D+00 0.00000000D+00 0.00000000D+00 0.14617822D+00
0.00000000D+00 0.00000000D+00 0.24072966D+00 0.00000000D+00 0.00000000D+00
0.46145494D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.41529425D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.54563010D-01 0.00000000D+00 0.00000000D+00 0.96494787D-01 0.18708028D+00
0.12555766D+00-0.40414873D-02-0.40414873D-02-0.22248211D-02-0.14196031D-01
-0.14196031D-01-0.10733949D-01 0.96494787D-01 0.18708028D+00 0.12555766D+00
0.40414873D-02 0.40414873D-02-0.22248211D-02 0.14196031D-01 0.14196031D-01
-0.10733949D-01-0.96494787D-01-0.18708028D+00-0.12555766D+00 0.40414873D-02
-0.40414873D-02-0.22248211D-02 0.14196031D-01-0.14196031D-01-0.10733949D-01
-0.96494787D-01-0.18708028D+00-0.12555766D+00-0.40414873D-02 0.40414873D-02
-0.22248211D-02-0.14196031D-01 0.14196031D-01-0.10733949D-01
10 Alpha MO OE= 0.13991261D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.18657615D-01 0.00000000D+00 0.00000000D+00
-0.39126588D-01 0.00000000D+00 0.00000000D+00 0.73566536D-01 0.00000000D+00
0.00000000D+00 0.40502886D-01 0.00000000D+00 0.00000000D+00 0.18762818D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.50833195D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.62057830D-01 0.00000000D+00-0.42219789D-01-0.37006187D-01
-0.92548413D+00-0.33578569D-02 0.40351042D-02-0.33578569D-02 0.11545659D-01
0.18834290D-01 0.11545659D-01 0.42219789D-01 0.37006187D-01 0.92548413D+00
-0.33578569D-02 0.40351042D-02 0.33578569D-02 0.11545659D-01 0.18834290D-01
-0.11545659D-01 0.42219789D-01 0.37006187D-01 0.92548413D+00 0.33578569D-02
0.40351042D-02-0.33578569D-02-0.11545659D-01 0.18834290D-01 0.11545659D-01
-0.42219789D-01-0.37006187D-01-0.92548413D+00 0.33578569D-02 0.40351042D-02
0.33578569D-02-0.11545659D-01 0.18834290D-01-0.11545659D-01
11 Alpha MO OE= 0.13991261D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.18657615D-01 0.00000000D+00
0.00000000D+00-0.39126588D-01 0.00000000D+00 0.00000000D+00 0.73566536D-01
0.00000000D+00 0.00000000D+00 0.40502886D-01 0.00000000D+00 0.00000000D+00
0.18762818D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00-0.50833195D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.62057830D-01 0.00000000D+00 0.00000000D+00-0.42219789D-01-0.37006187D-01
-0.92548413D+00-0.33578569D-02-0.33578569D-02 0.40351042D-02 0.11545659D-01
0.11545659D-01 0.18834290D-01-0.42219789D-01-0.37006187D-01-0.92548413D+00
0.33578569D-02 0.33578569D-02 0.40351042D-02-0.11545659D-01-0.11545659D-01
0.18834290D-01 0.42219789D-01 0.37006187D-01 0.92548413D+00 0.33578569D-02
-0.33578569D-02 0.40351042D-02-0.11545659D-01 0.11545659D-01 0.18834290D-01
0.42219789D-01 0.37006187D-01 0.92548413D+00-0.33578569D-02 0.33578569D-02
0.40351042D-02 0.11545659D-01-0.11545659D-01 0.18834290D-01
12 Alpha MO OE= 0.13991261D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.18657615D-01 0.00000000D+00 0.00000000D+00-0.39126588D-01
0.00000000D+00 0.00000000D+00 0.73566536D-01 0.00000000D+00 0.00000000D+00
0.40502886D-01 0.00000000D+00 0.00000000D+00 0.18762818D+01 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.50833195D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.62057830D-01-0.42219789D-01-0.37006187D-01
-0.92548413D+00 0.40351042D-02-0.33578569D-02-0.33578569D-02 0.18834290D-01
0.11545659D-01 0.11545659D-01 0.42219789D-01 0.37006187D-01 0.92548413D+00
0.40351042D-02-0.33578569D-02 0.33578569D-02 0.18834290D-01 0.11545659D-01
-0.11545659D-01-0.42219789D-01-0.37006187D-01-0.92548413D+00 0.40351042D-02
0.33578569D-02 0.33578569D-02 0.18834290D-01-0.11545659D-01-0.11545659D-01
0.42219789D-01 0.37006187D-01 0.92548413D+00 0.40351042D-02 0.33578569D-02
-0.33578569D-02 0.18834290D-01-0.11545659D-01 0.11545659D-01
13 Alpha MO OE= 0.16271464D+00
0.16736264D-01 0.46388975D-01-0.10118257D+00-0.17991272D+00 0.13082860D+00
0.31884177D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.24983301D-01 0.24983301D-01 0.24983301D-01 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.45035929D-01 0.45035929D-01 0.45035929D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.24697921D-01 0.63858483D-01
-0.12737622D+01-0.89839551D-02-0.89839551D-02-0.89839551D-02 0.34018548D-01
0.34018548D-01 0.34018548D-01-0.24697921D-01 0.63858483D-01-0.12737622D+01
0.89839551D-02 0.89839551D-02-0.89839551D-02-0.34018548D-01-0.34018548D-01
0.34018548D-01-0.24697921D-01 0.63858483D-01-0.12737622D+01-0.89839551D-02
0.89839551D-02 0.89839551D-02 0.34018548D-01-0.34018548D-01-0.34018548D-01
-0.24697921D-01 0.63858483D-01-0.12737622D+01 0.89839551D-02-0.89839551D-02
0.89839551D-02-0.34018548D-01 0.34018548D-01-0.34018548D-01
14 Alpha MO OE= 0.26446601D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.63996760D-01 0.00000000D+00 0.00000000D+00-0.10375115D+00
0.00000000D+00 0.00000000D+00-0.96129050D-02 0.00000000D+00 0.00000000D+00
0.14587888D+01 0.00000000D+00 0.00000000D+00-0.38472687D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.69528421D-03 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.15978368D+00 0.17807274D-02 0.18781282D-01
-0.77722753D+00-0.68059015D-02-0.83608482D-02-0.83608482D-02 0.67659496D-01
0.54616713D-01 0.54616713D-01-0.17807274D-02-0.18781282D-01 0.77722753D+00
-0.68059015D-02-0.83608482D-02 0.83608482D-02 0.67659496D-01 0.54616713D-01
-0.54616713D-01 0.17807274D-02 0.18781282D-01-0.77722753D+00-0.68059015D-02
0.83608482D-02 0.83608482D-02 0.67659496D-01-0.54616713D-01-0.54616713D-01
-0.17807274D-02-0.18781282D-01 0.77722753D+00-0.68059015D-02 0.83608482D-02
-0.83608482D-02 0.67659496D-01-0.54616713D-01 0.54616713D-01
15 Alpha MO OE= 0.26446601D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.63996760D-01 0.00000000D+00 0.00000000D+00
-0.10375115D+00 0.00000000D+00 0.00000000D+00-0.96129050D-02 0.00000000D+00
0.00000000D+00 0.14587888D+01 0.00000000D+00 0.00000000D+00-0.38472687D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.69528421D-03 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.15978368D+00 0.00000000D+00 0.17807274D-02 0.18781282D-01
-0.77722753D+00-0.83608482D-02-0.68059015D-02-0.83608482D-02 0.54616713D-01
0.67659496D-01 0.54616713D-01-0.17807274D-02-0.18781282D-01 0.77722753D+00
-0.83608482D-02-0.68059015D-02 0.83608482D-02 0.54616713D-01 0.67659496D-01
-0.54616713D-01-0.17807274D-02-0.18781282D-01 0.77722753D+00 0.83608482D-02
-0.68059015D-02-0.83608482D-02-0.54616713D-01 0.67659496D-01 0.54616713D-01
0.17807274D-02 0.18781282D-01-0.77722753D+00 0.83608482D-02-0.68059015D-02
0.83608482D-02-0.54616713D-01 0.67659496D-01-0.54616713D-01
16 Alpha MO OE= 0.26446601D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.63996760D-01 0.00000000D+00
0.00000000D+00-0.10375115D+00 0.00000000D+00 0.00000000D+00-0.96129050D-02
0.00000000D+00 0.00000000D+00 0.14587888D+01 0.00000000D+00 0.00000000D+00
-0.38472687D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.69528421D-03
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.15978368D+00 0.00000000D+00 0.00000000D+00 0.17807274D-02 0.18781282D-01
-0.77722753D+00-0.83608482D-02-0.83608482D-02-0.68059015D-02 0.54616713D-01
0.54616713D-01 0.67659496D-01 0.17807274D-02 0.18781282D-01-0.77722753D+00
0.83608482D-02 0.83608482D-02-0.68059015D-02-0.54616713D-01-0.54616713D-01
0.67659496D-01-0.17807274D-02-0.18781282D-01 0.77722753D+00 0.83608482D-02
-0.83608482D-02-0.68059015D-02-0.54616713D-01 0.54616713D-01 0.67659496D-01
-0.17807274D-02-0.18781282D-01 0.77722753D+00-0.83608482D-02 0.83608482D-02
-0.68059015D-02 0.54616713D-01-0.54616713D-01 0.67659496D-01
17 Alpha MO OE= 0.37996854D+00
-0.25610986D-02-0.54979111D-02 0.23419892D-02-0.38942413D+00-0.21955908D+01
0.11113661D+02 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.30894123D+00-0.30894123D+00-0.30894123D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.17374303D+01-0.17374303D+01-0.17374303D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.48103019D-01-0.19264804D+00
-0.16222894D+01 0.61817605D-02 0.61817605D-02 0.61817605D-02-0.27048588D-01
-0.27048588D-01-0.27048588D-01-0.48103019D-01-0.19264804D+00-0.16222894D+01
-0.61817605D-02-0.61817605D-02 0.61817605D-02 0.27048588D-01 0.27048588D-01
-0.27048588D-01-0.48103019D-01-0.19264804D+00-0.16222894D+01 0.61817605D-02
-0.61817605D-02-0.61817605D-02-0.27048588D-01 0.27048588D-01 0.27048588D-01
-0.48103019D-01-0.19264804D+00-0.16222894D+01-0.61817605D-02 0.61817605D-02
-0.61817605D-02 0.27048588D-01-0.27048588D-01 0.27048588D-01
18 Alpha MO OE= 0.41638355D+00
0.59638238D-15 0.13085151D-14-0.10123380D-15 0.83986540D-15-0.12365166D-12
0.38846570D-12 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.68078262D-01-0.15790028D-01 0.83868290D-01 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.57631442D+00-0.13366999D+00 0.70998441D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.69683217D-14-0.12292643D-12
-0.23186203D-13 0.31534919D-02 0.73141885D-03-0.38849108D-02-0.73216423D-01
-0.16981769D-01 0.90198192D-01-0.69683217D-14-0.12292643D-12-0.23186203D-13
-0.31534919D-02-0.73141885D-03-0.38849108D-02 0.73216423D-01 0.16981769D-01
0.90198192D-01-0.69683217D-14-0.12292643D-12-0.23186203D-13 0.31534919D-02
-0.73141885D-03 0.38849108D-02-0.73216423D-01 0.16981769D-01-0.90198192D-01
-0.69683217D-14-0.12292643D-12-0.23186203D-13-0.31534919D-02 0.73141885D-03
0.38849108D-02 0.73216423D-01-0.16981769D-01-0.90198192D-01
19 Alpha MO OE= 0.41638355D+00
0.72057807D-15 0.23677417D-14-0.76585867D-14-0.84980838D-13-0.41146804D-12
0.21652701D-11 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.57537756D-01 0.87726383D-01-0.30188626D-01 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.48708409D+00 0.74264498D+00-0.25556088D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.16258979D-13-0.11159161D-12
-0.28361803D-12 0.26652392D-02-0.40636237D-02 0.13983845D-02-0.61880380D-01
0.94347472D-01-0.32467093D-01-0.16258979D-13-0.11159161D-12-0.28361803D-12
-0.26652392D-02 0.40636237D-02 0.13983845D-02 0.61880380D-01-0.94347472D-01
-0.32467093D-01-0.16258979D-13-0.11159161D-12-0.28361803D-12 0.26652392D-02
0.40636237D-02-0.13983845D-02-0.61880380D-01-0.94347472D-01 0.32467093D-01
-0.16258979D-13-0.11159161D-12-0.28361803D-12-0.26652392D-02-0.40636237D-02
-0.13983845D-02 0.61880380D-01 0.94347472D-01 0.32467093D-01
20 Alpha MO OE= 0.46474160D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.38892228D-01 0.00000000D+00 0.00000000D+00
0.63235144D-01 0.00000000D+00 0.00000000D+00-0.29722824D-01 0.00000000D+00
0.00000000D+00-0.23205079D+00 0.00000000D+00 0.00000000D+00 0.19731014D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.85031974D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.76132547D+00 0.00000000D+00 0.41358539D-01 0.33563396D+00
-0.16039457D+01-0.10302915D-01-0.57150503D-02-0.10302915D-01 0.10016727D+00
0.15283520D-01 0.10016727D+00-0.41358539D-01-0.33563396D+00 0.16039457D+01
-0.10302915D-01-0.57150503D-02 0.10302915D-01 0.10016727D+00 0.15283520D-01
-0.10016727D+00-0.41358539D-01-0.33563396D+00 0.16039457D+01 0.10302915D-01
-0.57150503D-02-0.10302915D-01-0.10016727D+00 0.15283520D-01 0.10016727D+00
0.41358539D-01 0.33563396D+00-0.16039457D+01 0.10302915D-01-0.57150503D-02
0.10302915D-01-0.10016727D+00 0.15283520D-01-0.10016727D+00
21 Alpha MO OE= 0.46474160D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.38892228D-01 0.00000000D+00 0.00000000D+00 0.63235144D-01
0.00000000D+00 0.00000000D+00-0.29722824D-01 0.00000000D+00 0.00000000D+00
-0.23205079D+00 0.00000000D+00 0.00000000D+00 0.19731014D+01 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.85031974D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.76132547D+00 0.41358539D-01 0.33563396D+00
-0.16039457D+01-0.57150503D-02-0.10302915D-01-0.10302915D-01 0.15283520D-01
0.10016727D+00 0.10016727D+00-0.41358539D-01-0.33563396D+00 0.16039457D+01
-0.57150503D-02-0.10302915D-01 0.10302915D-01 0.15283520D-01 0.10016727D+00
-0.10016727D+00 0.41358539D-01 0.33563396D+00-0.16039457D+01-0.57150503D-02
0.10302915D-01 0.10302915D-01 0.15283520D-01-0.10016727D+00-0.10016727D+00
-0.41358539D-01-0.33563396D+00 0.16039457D+01-0.57150503D-02 0.10302915D-01
-0.10302915D-01 0.15283520D-01-0.10016727D+00 0.10016727D+00
22 Alpha MO OE= 0.46474160D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.38892228D-01 0.00000000D+00
0.00000000D+00 0.63235144D-01 0.00000000D+00 0.00000000D+00-0.29722824D-01
0.00000000D+00 0.00000000D+00-0.23205079D+00 0.00000000D+00 0.00000000D+00
0.19731014D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.85031974D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.76132547D+00 0.00000000D+00 0.00000000D+00 0.41358539D-01 0.33563396D+00
-0.16039457D+01-0.10302915D-01-0.10302915D-01-0.57150503D-02 0.10016727D+00
0.10016727D+00 0.15283520D-01 0.41358539D-01 0.33563396D+00-0.16039457D+01
0.10302915D-01 0.10302915D-01-0.57150503D-02-0.10016727D+00-0.10016727D+00
0.15283520D-01-0.41358539D-01-0.33563396D+00 0.16039457D+01 0.10302915D-01
-0.10302915D-01-0.57150503D-02-0.10016727D+00 0.10016727D+00 0.15283520D-01
-0.41358539D-01-0.33563396D+00 0.16039457D+01-0.10302915D-01 0.10302915D-01
-0.57150503D-02 0.10016727D+00-0.10016727D+00 0.15283520D-01
23 Alpha MO OE= 0.53479081D+00
-0.22616001D-01-0.63252336D-01 0.14603833D+00 0.83623576D-01-0.23711021D+01
0.81992750D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.12795196D+00-0.12795196D+00-0.12795196D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.10467663D+01-0.10467663D+01-0.10467663D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.71042321D-01 0.68735449D+00
-0.18437231D+01-0.70546218D-02-0.70546218D-02-0.70546218D-02 0.73368420D-01
0.73368420D-01 0.73368420D-01 0.71042321D-01 0.68735449D+00-0.18437231D+01
0.70546218D-02 0.70546218D-02-0.70546218D-02-0.73368420D-01-0.73368420D-01
0.73368420D-01 0.71042321D-01 0.68735449D+00-0.18437231D+01-0.70546218D-02
0.70546218D-02 0.70546218D-02 0.73368420D-01-0.73368420D-01-0.73368420D-01
0.71042321D-01 0.68735449D+00-0.18437231D+01 0.70546218D-02-0.70546218D-02
0.70546218D-02-0.73368420D-01 0.73368420D-01-0.73368420D-01
24 Alpha MO OE= 0.84037169D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.47362982D-01 0.00000000D+00 0.00000000D+00-0.85993746D-01
0.00000000D+00 0.00000000D+00 0.47168087D-01 0.00000000D+00 0.00000000D+00
0.12411076D+01 0.00000000D+00 0.00000000D+00-0.16343294D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.44899251D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.15923873D+01-0.12437717D-01-0.12194195D+01
0.43590254D+00-0.21193064D-02 0.65708486D-02 0.65708486D-02 0.84946754D-01
-0.29621270D-01-0.29621270D-01 0.12437717D-01 0.12194195D+01-0.43590254D+00
-0.21193064D-02 0.65708486D-02-0.65708486D-02 0.84946754D-01-0.29621270D-01
0.29621270D-01-0.12437717D-01-0.12194195D+01 0.43590254D+00-0.21193064D-02
-0.65708486D-02-0.65708486D-02 0.84946754D-01 0.29621270D-01 0.29621270D-01
0.12437717D-01 0.12194195D+01-0.43590254D+00-0.21193064D-02-0.65708486D-02
0.65708486D-02 0.84946754D-01 0.29621270D-01-0.29621270D-01
25 Alpha MO OE= 0.84037169D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.47362982D-01 0.00000000D+00 0.00000000D+00
-0.85993746D-01 0.00000000D+00 0.00000000D+00 0.47168087D-01 0.00000000D+00
0.00000000D+00 0.12411076D+01 0.00000000D+00 0.00000000D+00-0.16343294D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.44899251D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.15923873D+01 0.00000000D+00-0.12437717D-01-0.12194195D+01
0.43590254D+00 0.65708486D-02-0.21193064D-02 0.65708486D-02-0.29621270D-01
0.84946754D-01-0.29621270D-01 0.12437717D-01 0.12194195D+01-0.43590254D+00
0.65708486D-02-0.21193064D-02-0.65708486D-02-0.29621270D-01 0.84946754D-01
0.29621270D-01 0.12437717D-01 0.12194195D+01-0.43590254D+00-0.65708486D-02
-0.21193064D-02 0.65708486D-02 0.29621270D-01 0.84946754D-01-0.29621270D-01
-0.12437717D-01-0.12194195D+01 0.43590254D+00-0.65708486D-02-0.21193064D-02
-0.65708486D-02 0.29621270D-01 0.84946754D-01 0.29621270D-01
26 Alpha MO OE= 0.84037169D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.47362982D-01 0.00000000D+00
0.00000000D+00-0.85993746D-01 0.00000000D+00 0.00000000D+00 0.47168087D-01
0.00000000D+00 0.00000000D+00 0.12411076D+01 0.00000000D+00 0.00000000D+00
-0.16343294D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.44899251D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.15923873D+01 0.00000000D+00 0.00000000D+00-0.12437717D-01-0.12194195D+01
0.43590254D+00 0.65708486D-02 0.65708486D-02-0.21193064D-02-0.29621270D-01
-0.29621270D-01 0.84946754D-01-0.12437717D-01-0.12194195D+01 0.43590254D+00
-0.65708486D-02-0.65708486D-02-0.21193064D-02 0.29621270D-01 0.29621270D-01
0.84946754D-01 0.12437717D-01 0.12194195D+01-0.43590254D+00-0.65708486D-02
0.65708486D-02-0.21193064D-02 0.29621270D-01-0.29621270D-01 0.84946754D-01
0.12437717D-01 0.12194195D+01-0.43590254D+00 0.65708486D-02-0.65708486D-02
-0.21193064D-02-0.29621270D-01 0.29621270D-01 0.84946754D-01
27 Alpha MO OE= 0.84052437D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.16707200D-11 0.00000000D+00 0.00000000D+00-0.30344984D-11
0.00000000D+00 0.00000000D+00 0.16834420D-11 0.00000000D+00 0.00000000D+00
0.43631143D-10 0.00000000D+00 0.00000000D+00-0.57619272D-11 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.15856345D-11 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.56066491D-10-0.43947064D-12-0.42937263D-10
0.15383641D-10-0.74166422D-13-0.24499747D-01 0.24499747D-01 0.29758783D-11
0.38878308D+00-0.38878308D+00 0.43947064D-12 0.42937263D-10-0.15383641D-10
-0.74166422D-13-0.24499747D-01-0.24499747D-01 0.29758783D-11 0.38878308D+00
0.38878308D+00-0.43947064D-12-0.42937263D-10 0.15383641D-10-0.74166422D-13
0.24499747D-01-0.24499747D-01 0.29758783D-11-0.38878308D+00 0.38878308D+00
0.43947064D-12 0.42937263D-10-0.15383641D-10-0.74166422D-13 0.24499747D-01
0.24499747D-01 0.29758783D-11-0.38878308D+00-0.38878308D+00
28 Alpha MO OE= 0.84052437D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.30621535D-11 0.00000000D+00 0.00000000D+00
-0.55606627D-11 0.00000000D+00 0.00000000D+00 0.30801685D-11 0.00000000D+00
0.00000000D+00 0.79953158D-10 0.00000000D+00 0.00000000D+00-0.10533795D-10
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.29076845D-11 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.10276054D-09 0.00000000D+00-0.80544834D-12-0.78691586D-10
0.28184143D-10-0.24499747D-01-0.13561460D-12 0.24499747D-01 0.38878308D+00
0.54458331D-11-0.38878308D+00 0.80544834D-12 0.78691586D-10-0.28184143D-10
-0.24499747D-01-0.13561460D-12-0.24499747D-01 0.38878308D+00 0.54458331D-11
0.38878308D+00 0.80544834D-12 0.78691586D-10-0.28184143D-10 0.24499747D-01
-0.13561460D-12 0.24499747D-01-0.38878308D+00 0.54458331D-11-0.38878308D+00
-0.80544834D-12-0.78691586D-10 0.28184143D-10 0.24499747D-01-0.13561460D-12
-0.24499747D-01-0.38878308D+00 0.54458331D-11 0.38878308D+00
29 Alpha MO OE= 0.84052437D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.96460964D-12 0.00000000D+00
0.00000000D+00-0.17516005D-11 0.00000000D+00 0.00000000D+00 0.97074475D-12
0.00000000D+00 0.00000000D+00 0.25172000D-10 0.00000000D+00 0.00000000D+00
-0.33137931D-11 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.91652647D-12
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.32368646D-10 0.00000000D+00 0.00000000D+00-0.25341244D-12-0.24785789D-10
0.88797667D-11-0.24499747D-01 0.24499747D-01-0.42665461D-13 0.38878308D+00
-0.38878308D+00 0.17127230D-11-0.25341244D-12-0.24785789D-10 0.88797667D-11
0.24499747D-01-0.24499747D-01-0.42665461D-13-0.38878308D+00 0.38878308D+00
0.17127230D-11 0.25341244D-12 0.24785789D-10-0.88797667D-11 0.24499747D-01
0.24499747D-01-0.42665461D-13-0.38878308D+00-0.38878308D+00 0.17127230D-11
0.25341244D-12 0.24785789D-10-0.88797667D-11-0.24499747D-01-0.24499747D-01
-0.42665461D-13 0.38878308D+00 0.38878308D+00 0.17127230D-11
30 Alpha MO OE= 0.99541526D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.66168629D-01 0.00000000D+00 0.00000000D+00 0.14542984D+00
0.00000000D+00 0.00000000D+00-0.59625468D+00 0.00000000D+00 0.00000000D+00
0.20635342D+01 0.00000000D+00 0.00000000D+00-0.26972501D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.70109116D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.16438393D+01 0.25790889D-01-0.80613930D+00
-0.39246830D+00-0.32941904D-01 0.16899941D-02 0.16899941D-02 0.77498593D+00
0.19350432D+00 0.19350432D+00-0.25790889D-01 0.80613930D+00 0.39246830D+00
-0.32941904D-01 0.16899941D-02-0.16899941D-02 0.77498593D+00 0.19350432D+00
-0.19350432D+00 0.25790889D-01-0.80613930D+00-0.39246830D+00-0.32941904D-01
-0.16899941D-02-0.16899941D-02 0.77498593D+00-0.19350432D+00-0.19350432D+00
-0.25790889D-01 0.80613930D+00 0.39246830D+00-0.32941904D-01-0.16899941D-02
0.16899941D-02 0.77498593D+00-0.19350432D+00 0.19350432D+00
31 Alpha MO OE= 0.99541526D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.66168629D-01 0.00000000D+00 0.00000000D+00
0.14542984D+00 0.00000000D+00 0.00000000D+00-0.59625468D+00 0.00000000D+00
0.00000000D+00 0.20635342D+01 0.00000000D+00 0.00000000D+00-0.26972501D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.70109116D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.16438393D+01 0.00000000D+00 0.25790889D-01-0.80613930D+00
-0.39246830D+00 0.16899941D-02-0.32941904D-01 0.16899941D-02 0.19350432D+00
0.77498593D+00 0.19350432D+00-0.25790889D-01 0.80613930D+00 0.39246830D+00
0.16899941D-02-0.32941904D-01-0.16899941D-02 0.19350432D+00 0.77498593D+00
-0.19350432D+00-0.25790889D-01 0.80613930D+00 0.39246830D+00-0.16899941D-02
-0.32941904D-01 0.16899941D-02-0.19350432D+00 0.77498593D+00 0.19350432D+00
0.25790889D-01-0.80613930D+00-0.39246830D+00-0.16899941D-02-0.32941904D-01
-0.16899941D-02-0.19350432D+00 0.77498593D+00-0.19350432D+00
32 Alpha MO OE= 0.99541526D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.66168629D-01 0.00000000D+00
0.00000000D+00 0.14542984D+00 0.00000000D+00 0.00000000D+00-0.59625468D+00
0.00000000D+00 0.00000000D+00 0.20635342D+01 0.00000000D+00 0.00000000D+00
-0.26972501D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00-0.70109116D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.16438393D+01 0.00000000D+00 0.00000000D+00 0.25790889D-01-0.80613930D+00
-0.39246830D+00 0.16899941D-02 0.16899941D-02-0.32941904D-01 0.19350432D+00
0.19350432D+00 0.77498593D+00 0.25790889D-01-0.80613930D+00-0.39246830D+00
-0.16899941D-02-0.16899941D-02-0.32941904D-01-0.19350432D+00-0.19350432D+00
0.77498593D+00-0.25790889D-01 0.80613930D+00 0.39246830D+00-0.16899941D-02
0.16899941D-02-0.32941904D-01-0.19350432D+00 0.19350432D+00 0.77498593D+00
-0.25790889D-01 0.80613930D+00 0.39246830D+00 0.16899941D-02-0.16899941D-02
-0.32941904D-01 0.19350432D+00-0.19350432D+00 0.77498593D+00
33 Alpha MO OE= 0.10920476D+01
0.20891159D-01 0.62054632D-01-0.16063954D+00-0.13718219D+01 0.42507321D+00
0.10080611D+02 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.75209655D+00-0.75209655D+00-0.75209655D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.36981521D+01-0.36981521D+01-0.36981521D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.50759422D-01 0.76825295D+00
-0.10810057D+01 0.15724192D-01 0.15724192D-01 0.15724192D-01-0.23472487D+00
-0.23472487D+00-0.23472487D+00 0.50759422D-01 0.76825295D+00-0.10810057D+01
-0.15724192D-01-0.15724192D-01 0.15724192D-01 0.23472487D+00 0.23472487D+00
-0.23472487D+00 0.50759422D-01 0.76825295D+00-0.10810057D+01 0.15724192D-01
-0.15724192D-01-0.15724192D-01-0.23472487D+00 0.23472487D+00 0.23472487D+00
0.50759422D-01 0.76825295D+00-0.10810057D+01-0.15724192D-01 0.15724192D-01
-0.15724192D-01 0.23472487D+00-0.23472487D+00 0.23472487D+00
34 Alpha MO OE= 0.12708538D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.54068136D-01 0.00000000D+00 0.00000000D+00 0.15443973D+00
0.00000000D+00 0.00000000D+00-0.10409596D+01 0.00000000D+00 0.00000000D+00
0.41651430D+01 0.00000000D+00 0.00000000D+00 0.15410136D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.12272502D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.12872861D+01-0.35988839D-01-0.11576682D+01
-0.67879674D+00 0.18802093D-01-0.20598475D-01-0.20598475D-01-0.23019561D-01
0.66625758D+00 0.66625758D+00 0.35988839D-01 0.11576682D+01 0.67879674D+00
0.18802093D-01-0.20598475D-01 0.20598475D-01-0.23019561D-01 0.66625758D+00
-0.66625758D+00-0.35988839D-01-0.11576682D+01-0.67879674D+00 0.18802093D-01
0.20598475D-01 0.20598475D-01-0.23019561D-01-0.66625758D+00-0.66625758D+00
0.35988839D-01 0.11576682D+01 0.67879674D+00 0.18802093D-01 0.20598475D-01
-0.20598475D-01-0.23019561D-01-0.66625758D+00 0.66625758D+00
35 Alpha MO OE= 0.12708538D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.54068136D-01 0.00000000D+00 0.00000000D+00
0.15443973D+00 0.00000000D+00 0.00000000D+00-0.10409596D+01 0.00000000D+00
0.00000000D+00 0.41651430D+01 0.00000000D+00 0.00000000D+00 0.15410136D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.12272502D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.12872861D+01 0.00000000D+00-0.35988839D-01-0.11576682D+01
-0.67879674D+00-0.20598475D-01 0.18802093D-01-0.20598475D-01 0.66625758D+00
-0.23019561D-01 0.66625758D+00 0.35988839D-01 0.11576682D+01 0.67879674D+00
-0.20598475D-01 0.18802093D-01 0.20598475D-01 0.66625758D+00-0.23019561D-01
-0.66625758D+00 0.35988839D-01 0.11576682D+01 0.67879674D+00 0.20598475D-01
0.18802093D-01-0.20598475D-01-0.66625758D+00-0.23019561D-01 0.66625758D+00
-0.35988839D-01-0.11576682D+01-0.67879674D+00 0.20598475D-01 0.18802093D-01
0.20598475D-01-0.66625758D+00-0.23019561D-01-0.66625758D+00
36 Alpha MO OE= 0.12708538D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.54068136D-01 0.00000000D+00
0.00000000D+00 0.15443973D+00 0.00000000D+00 0.00000000D+00-0.10409596D+01
0.00000000D+00 0.00000000D+00 0.41651430D+01 0.00000000D+00 0.00000000D+00
0.15410136D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00-0.12272502D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.12872861D+01 0.00000000D+00 0.00000000D+00-0.35988839D-01-0.11576682D+01
-0.67879674D+00-0.20598475D-01-0.20598475D-01 0.18802093D-01 0.66625758D+00
0.66625758D+00-0.23019561D-01-0.35988839D-01-0.11576682D+01-0.67879674D+00
0.20598475D-01 0.20598475D-01 0.18802093D-01-0.66625758D+00-0.66625758D+00
-0.23019561D-01 0.35988839D-01 0.11576682D+01 0.67879674D+00 0.20598475D-01
-0.20598475D-01 0.18802093D-01-0.66625758D+00 0.66625758D+00-0.23019561D-01
0.35988839D-01 0.11576682D+01 0.67879674D+00-0.20598475D-01 0.20598475D-01
0.18802093D-01 0.66625758D+00-0.66625758D+00-0.23019561D-01
37 Alpha MO OE= 0.12797008D+01
0.21871797D-14 0.74771962D-14-0.25973913D-13-0.33001991D-12 0.15434951D-11
0.99661746D-12 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.54408641D-01-0.11910136D+00 0.17351000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.43346802D+00-0.94886820D+00 0.13823362D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.23835897D-13-0.21036322D-12
-0.29192595D-12-0.14149023D-01-0.30972429D-01 0.45121452D-01 0.21187452D+00
0.46379660D+00-0.67567112D+00-0.23835897D-13-0.21036322D-12-0.29192595D-12
0.14149023D-01 0.30972429D-01 0.45121452D-01-0.21187452D+00-0.46379660D+00
-0.67567112D+00-0.23835897D-13-0.21036322D-12-0.29192595D-12-0.14149023D-01
0.30972429D-01-0.45121452D-01 0.21187452D+00-0.46379660D+00 0.67567112D+00
-0.23835897D-13-0.21036322D-12-0.29192595D-12 0.14149023D-01-0.30972429D-01
-0.45121452D-01-0.21187452D+00 0.46379660D+00 0.67567112D+00
38 Alpha MO OE= 0.12797008D+01
-0.11279012D-14-0.38783075D-14 0.13926597D-13 0.14596909D-12-0.17248477D-12
-0.12214965D-11 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.16893924D+00-0.13158889D+00-0.37350356D-01 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.13459215D+01-0.10483551D+01-0.29756643D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.61161401D-14-0.34196193D-13
0.19124608D-12 0.43932822D-01-0.34219824D-01-0.97129983D-02-0.65787199D+00
0.51242471D+00 0.14544728D+00-0.61161401D-14-0.34196193D-13 0.19124608D-12
-0.43932822D-01 0.34219824D-01-0.97129983D-02 0.65787199D+00-0.51242471D+00
0.14544728D+00-0.61161401D-14-0.34196193D-13 0.19124608D-12 0.43932822D-01
0.34219824D-01 0.97129983D-02-0.65787199D+00-0.51242471D+00-0.14544728D+00
-0.61161401D-14-0.34196193D-13 0.19124608D-12-0.43932822D-01-0.34219824D-01
0.97129983D-02 0.65787199D+00 0.51242471D+00-0.14544728D+00
39 Alpha MO OE= 0.14177662D+01
0.20181831D-01 0.57637023D-01-0.13101866D+00-0.10808007D+01 0.32038059D+01
0.59930287D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.48939849D+00-0.48939849D+00-0.48939849D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.11313173D+01-0.11313173D+01-0.11313173D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.93744957D-01-0.31984692D+00
-0.12512909D+01-0.30626684D-01-0.30626684D-01-0.30626684D-01 0.58611967D+00
0.58611967D+00 0.58611967D+00-0.93744957D-01-0.31984692D+00-0.12512909D+01
0.30626684D-01 0.30626684D-01-0.30626684D-01-0.58611967D+00-0.58611967D+00
0.58611967D+00-0.93744957D-01-0.31984692D+00-0.12512909D+01-0.30626684D-01
0.30626684D-01 0.30626684D-01 0.58611967D+00-0.58611967D+00-0.58611967D+00
-0.93744957D-01-0.31984692D+00-0.12512909D+01 0.30626684D-01-0.30626684D-01
0.30626684D-01-0.58611967D+00 0.58611967D+00-0.58611967D+00
40 Alpha MO OE= 0.15300675D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.14742867D+00 0.00000000D+00 0.00000000D+00
-0.36768699D+00 0.00000000D+00 0.00000000D+00 0.16129020D+01 0.00000000D+00
0.00000000D+00 0.21484831D+00 0.00000000D+00 0.00000000D+00 0.94044226D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.24584189D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.11198945D+01 0.00000000D+00-0.42678948D-01-0.45443440D+00
-0.79270978D+00-0.26811069D-01-0.16779281D-01-0.26811069D-01 0.43765773D+00
0.40824660D+00 0.43765773D+00 0.42678948D-01 0.45443440D+00 0.79270978D+00
-0.26811069D-01-0.16779281D-01 0.26811069D-01 0.43765773D+00 0.40824660D+00
-0.43765773D+00 0.42678948D-01 0.45443440D+00 0.79270978D+00 0.26811069D-01
-0.16779281D-01-0.26811069D-01-0.43765773D+00 0.40824660D+00 0.43765773D+00
-0.42678948D-01-0.45443440D+00-0.79270978D+00 0.26811069D-01-0.16779281D-01
0.26811069D-01-0.43765773D+00 0.40824660D+00-0.43765773D+00
41 Alpha MO OE= 0.15300675D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.14742867D+00 0.00000000D+00
0.00000000D+00-0.36768699D+00 0.00000000D+00 0.00000000D+00 0.16129020D+01
0.00000000D+00 0.00000000D+00 0.21484831D+00 0.00000000D+00 0.00000000D+00
0.94044226D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00-0.24584189D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.11198945D+01 0.00000000D+00 0.00000000D+00-0.42678948D-01-0.45443440D+00
-0.79270978D+00-0.26811069D-01-0.26811069D-01-0.16779281D-01 0.43765773D+00
0.43765773D+00 0.40824660D+00-0.42678948D-01-0.45443440D+00-0.79270978D+00
0.26811069D-01 0.26811069D-01-0.16779281D-01-0.43765773D+00-0.43765773D+00
0.40824660D+00 0.42678948D-01 0.45443440D+00 0.79270978D+00 0.26811069D-01
-0.26811069D-01-0.16779281D-01-0.43765773D+00 0.43765773D+00 0.40824660D+00
0.42678948D-01 0.45443440D+00 0.79270978D+00-0.26811069D-01 0.26811069D-01
-0.16779281D-01 0.43765773D+00-0.43765773D+00 0.40824660D+00
42 Alpha MO OE= 0.15300675D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.14742867D+00 0.00000000D+00 0.00000000D+00-0.36768699D+00
0.00000000D+00 0.00000000D+00 0.16129020D+01 0.00000000D+00 0.00000000D+00
0.21484831D+00 0.00000000D+00 0.00000000D+00 0.94044226D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.24584189D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.11198945D+01-0.42678948D-01-0.45443440D+00
-0.79270978D+00-0.16779281D-01-0.26811069D-01-0.26811069D-01 0.40824660D+00
0.43765773D+00 0.43765773D+00 0.42678948D-01 0.45443440D+00 0.79270978D+00
-0.16779281D-01-0.26811069D-01 0.26811069D-01 0.40824660D+00 0.43765773D+00
-0.43765773D+00-0.42678948D-01-0.45443440D+00-0.79270978D+00-0.16779281D-01
0.26811069D-01 0.26811069D-01 0.40824660D+00-0.43765773D+00-0.43765773D+00
0.42678948D-01 0.45443440D+00 0.79270978D+00-0.16779281D-01 0.26811069D-01
-0.26811069D-01 0.40824660D+00-0.43765773D+00 0.43765773D+00
43 Alpha MO OE= 0.20186247D+01
0.53302018D-14 0.14639309D-13-0.29803875D-13-0.26775222D-13-0.46741661D-12
0.16209083D-11 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.98143463D+00 0.53270949D-02-0.98676173D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.99355540D+00-0.53928848D-02 0.99894828D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.12301361D-13 0.60589183D-13
-0.30000514D-12 0.92674941D-02 0.50302709D-04-0.93177968D-02 0.22077683D+00
0.11983469D-02-0.22197518D+00-0.12301361D-13 0.60589183D-13-0.30000514D-12
-0.92674941D-02-0.50302709D-04-0.93177968D-02-0.22077683D+00-0.11983469D-02
-0.22197518D+00-0.12301361D-13 0.60589183D-13-0.30000514D-12 0.92674941D-02
-0.50302709D-04 0.93177968D-02 0.22077683D+00-0.11983469D-02 0.22197518D+00
-0.12301361D-13 0.60589183D-13-0.30000514D-12-0.92674941D-02 0.50302709D-04
0.93177968D-02-0.22077683D+00 0.11983469D-02 0.22197518D+00
44 Alpha MO OE= 0.20186247D+01
-0.10447266D-14-0.27200672D-14 0.50340954D-14-0.90062263D-13 0.19231767D-12
0.52829947D-12 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.57278275D+00-0.11363387D+01 0.56355595D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.57985664D+00 0.11503725D+01-0.57051589D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.11905777D-13-0.81919284D-14
-0.78098278D-13 0.54086748D-02-0.10730223D-01 0.53215479D-02 0.12884930D+00
-0.25562299D+00 0.12677370D+00 0.11905777D-13-0.81919284D-14-0.78098278D-13
-0.54086748D-02 0.10730223D-01 0.53215479D-02-0.12884930D+00 0.25562299D+00
0.12677370D+00 0.11905777D-13-0.81919284D-14-0.78098278D-13 0.54086748D-02
0.10730223D-01-0.53215479D-02 0.12884930D+00 0.25562299D+00-0.12677370D+00
0.11905777D-13-0.81919284D-14-0.78098278D-13-0.54086748D-02-0.10730223D-01
-0.53215479D-02-0.12884930D+00-0.25562299D+00-0.12677370D+00
45 Alpha MO OE= 0.20764170D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.25938760D-01 0.00000000D+00 0.00000000D+00-0.57699141D-01
0.00000000D+00 0.00000000D+00 0.28180807D+00 0.00000000D+00 0.00000000D+00
0.57197367D+00 0.00000000D+00 0.00000000D+00-0.66230868D-01 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.10965555D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.39963283D+00-0.16377247D+00 0.46784293D-01
-0.24145762D+00-0.52242503D-01-0.49571029D-01-0.49571029D-01 0.19218044D+00
0.29127647D+00 0.29127647D+00 0.16377247D+00-0.46784293D-01 0.24145762D+00
-0.52242503D-01-0.49571029D-01 0.49571029D-01 0.19218044D+00 0.29127647D+00
-0.29127647D+00-0.16377247D+00 0.46784293D-01-0.24145762D+00-0.52242503D-01
0.49571029D-01 0.49571029D-01 0.19218044D+00-0.29127647D+00-0.29127647D+00
0.16377247D+00-0.46784293D-01 0.24145762D+00-0.52242503D-01 0.49571029D-01
-0.49571029D-01 0.19218044D+00-0.29127647D+00 0.29127647D+00
46 Alpha MO OE= 0.20764170D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.25938760D-01 0.00000000D+00 0.00000000D+00
-0.57699141D-01 0.00000000D+00 0.00000000D+00 0.28180807D+00 0.00000000D+00
0.00000000D+00 0.57197367D+00 0.00000000D+00 0.00000000D+00-0.66230868D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.10965555D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.39963283D+00 0.00000000D+00-0.16377247D+00 0.46784293D-01
-0.24145762D+00-0.49571029D-01-0.52242503D-01-0.49571029D-01 0.29127647D+00
0.19218044D+00 0.29127647D+00 0.16377247D+00-0.46784293D-01 0.24145762D+00
-0.49571029D-01-0.52242503D-01 0.49571029D-01 0.29127647D+00 0.19218044D+00
-0.29127647D+00 0.16377247D+00-0.46784293D-01 0.24145762D+00 0.49571029D-01
-0.52242503D-01-0.49571029D-01-0.29127647D+00 0.19218044D+00 0.29127647D+00
-0.16377247D+00 0.46784293D-01-0.24145762D+00 0.49571029D-01-0.52242503D-01
0.49571029D-01-0.29127647D+00 0.19218044D+00-0.29127647D+00
47 Alpha MO OE= 0.20764170D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.25938760D-01 0.00000000D+00
0.00000000D+00-0.57699141D-01 0.00000000D+00 0.00000000D+00 0.28180807D+00
0.00000000D+00 0.00000000D+00 0.57197367D+00 0.00000000D+00 0.00000000D+00
-0.66230868D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.10965555D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.39963283D+00 0.00000000D+00 0.00000000D+00-0.16377247D+00 0.46784293D-01
-0.24145762D+00-0.49571029D-01-0.49571029D-01-0.52242503D-01 0.29127647D+00
0.29127647D+00 0.19218044D+00-0.16377247D+00 0.46784293D-01-0.24145762D+00
0.49571029D-01 0.49571029D-01-0.52242503D-01-0.29127647D+00-0.29127647D+00
0.19218044D+00 0.16377247D+00-0.46784293D-01 0.24145762D+00 0.49571029D-01
-0.49571029D-01-0.52242503D-01-0.29127647D+00 0.29127647D+00 0.19218044D+00
0.16377247D+00-0.46784293D-01 0.24145762D+00-0.49571029D-01 0.49571029D-01
-0.52242503D-01 0.29127647D+00-0.29127647D+00 0.19218044D+00
48 Alpha MO OE= 0.27758137D+01
-0.38484266D-01-0.10280047D+00 0.21729098D+00-0.22857036D+01 0.81690615D+01
0.45166088D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.22134332D+01-0.22134332D+01-0.22134332D+01 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.21443535D+01-0.21443535D+01-0.21443535D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.45676894D+00-0.91954581D+00
-0.40203833D+00 0.20943995D-01 0.20943995D-01 0.20943995D-01 0.30816398D+00
0.30816398D+00 0.30816398D+00 0.45676894D+00-0.91954581D+00-0.40203833D+00
-0.20943995D-01-0.20943995D-01 0.20943995D-01-0.30816398D+00-0.30816398D+00
0.30816398D+00 0.45676894D+00-0.91954581D+00-0.40203833D+00 0.20943995D-01
-0.20943995D-01-0.20943995D-01 0.30816398D+00-0.30816398D+00-0.30816398D+00
0.45676894D+00-0.91954581D+00-0.40203833D+00-0.20943995D-01 0.20943995D-01
-0.20943995D-01-0.30816398D+00 0.30816398D+00-0.30816398D+00
49 Alpha MO OE= 0.30813621D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.15380902D-01 0.00000000D+00 0.00000000D+00-0.52594778D-01
0.00000000D+00 0.00000000D+00 0.17455939D+00 0.00000000D+00 0.00000000D+00
0.22895731D+01 0.00000000D+00 0.00000000D+00-0.34356602D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.36601074D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.95132033D+00 0.84637039D+00-0.19632176D+01
0.33989874D+00-0.16974143D-01 0.17081472D-01 0.17081472D-01 0.26053363D+00
0.42016078D+00 0.42016078D+00-0.84637039D+00 0.19632176D+01-0.33989874D+00
-0.16974143D-01 0.17081472D-01-0.17081472D-01 0.26053363D+00 0.42016078D+00
-0.42016078D+00 0.84637039D+00-0.19632176D+01 0.33989874D+00-0.16974143D-01
-0.17081472D-01-0.17081472D-01 0.26053363D+00-0.42016078D+00-0.42016078D+00
-0.84637039D+00 0.19632176D+01-0.33989874D+00-0.16974143D-01-0.17081472D-01
0.17081472D-01 0.26053363D+00-0.42016078D+00 0.42016078D+00
50 Alpha MO OE= 0.30813621D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.15380902D-01 0.00000000D+00 0.00000000D+00
-0.52594778D-01 0.00000000D+00 0.00000000D+00 0.17455939D+00 0.00000000D+00
0.00000000D+00 0.22895731D+01 0.00000000D+00 0.00000000D+00-0.34356602D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.36601074D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.95132033D+00 0.00000000D+00 0.84637039D+00-0.19632176D+01
0.33989874D+00 0.17081472D-01-0.16974143D-01 0.17081472D-01 0.42016078D+00
0.26053363D+00 0.42016078D+00-0.84637039D+00 0.19632176D+01-0.33989874D+00
0.17081472D-01-0.16974143D-01-0.17081472D-01 0.42016078D+00 0.26053363D+00
-0.42016078D+00-0.84637039D+00 0.19632176D+01-0.33989874D+00-0.17081472D-01
-0.16974143D-01 0.17081472D-01-0.42016078D+00 0.26053363D+00 0.42016078D+00
0.84637039D+00-0.19632176D+01 0.33989874D+00-0.17081472D-01-0.16974143D-01
-0.17081472D-01-0.42016078D+00 0.26053363D+00-0.42016078D+00
51 Alpha MO OE= 0.30813621D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.15380902D-01 0.00000000D+00
0.00000000D+00-0.52594778D-01 0.00000000D+00 0.00000000D+00 0.17455939D+00
0.00000000D+00 0.00000000D+00 0.22895731D+01 0.00000000D+00 0.00000000D+00
-0.34356602D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.36601074D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.95132033D+00 0.00000000D+00 0.00000000D+00 0.84637039D+00-0.19632176D+01
0.33989874D+00 0.17081472D-01 0.17081472D-01-0.16974143D-01 0.42016078D+00
0.42016078D+00 0.26053363D+00 0.84637039D+00-0.19632176D+01 0.33989874D+00
-0.17081472D-01-0.17081472D-01-0.16974143D-01-0.42016078D+00-0.42016078D+00
0.26053363D+00-0.84637039D+00 0.19632176D+01-0.33989874D+00-0.17081472D-01
0.17081472D-01-0.16974143D-01-0.42016078D+00 0.42016078D+00 0.26053363D+00
-0.84637039D+00 0.19632176D+01-0.33989874D+00 0.17081472D-01-0.17081472D-01
-0.16974143D-01 0.42016078D+00-0.42016078D+00 0.26053363D+00
52 Alpha MO OE= 0.32433069D+01
-0.33144050D-01-0.93000240D-01 0.23972438D+00-0.15217224D+01 0.31823393D+01
0.57637474D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.15145004D+01-0.15145004D+01-0.15145004D+01 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.25256770D+01-0.25256770D+01-0.25256770D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.69355614D+00 0.12704185D+01
-0.86790825D+00-0.50690780D-01-0.50690780D-01-0.50690780D-01-0.11954734D+00
-0.11954734D+00-0.11954734D+00-0.69355614D+00 0.12704185D+01-0.86790825D+00
0.50690780D-01 0.50690780D-01-0.50690780D-01 0.11954734D+00 0.11954734D+00
-0.11954734D+00-0.69355614D+00 0.12704185D+01-0.86790825D+00-0.50690780D-01
0.50690780D-01 0.50690780D-01-0.11954734D+00 0.11954734D+00 0.11954734D+00
-0.69355614D+00 0.12704185D+01-0.86790825D+00 0.50690780D-01-0.50690780D-01
0.50690780D-01 0.11954734D+00-0.11954734D+00 0.11954734D+00
53 Alpha MO OE= 0.41579219D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.13211238D-15 0.00000000D+00 0.00000000D+00
0.52114157D-15 0.00000000D+00 0.00000000D+00-0.23966490D-14 0.00000000D+00
0.00000000D+00-0.20932004D-15 0.00000000D+00 0.00000000D+00-0.47258673D-14
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.15558364D-15 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.29827875D-15 0.00000000D+00-0.81986360D-15 0.60048346D-15
0.29036518D-14 0.43954773D+00-0.13543414D-14-0.43954773D+00-0.25617406D+00
0.96528667D-15 0.25617406D+00 0.81986360D-15-0.60048346D-15-0.29036518D-14
0.43954773D+00-0.13543414D-14 0.43954773D+00-0.25617406D+00 0.96528667D-15
-0.25617406D+00 0.81986360D-15-0.60048346D-15-0.29036518D-14-0.43954773D+00
-0.13543414D-14-0.43954773D+00 0.25617406D+00 0.96528667D-15 0.25617406D+00
-0.81986360D-15 0.60048346D-15 0.29036518D-14-0.43954773D+00-0.13543414D-14
0.43954773D+00 0.25617406D+00 0.96528667D-15-0.25617406D+00
54 Alpha MO OE= 0.41579219D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.54901175D-16 0.00000000D+00
0.00000000D+00 0.11293696D-15 0.00000000D+00 0.00000000D+00 0.19579854D-14
0.00000000D+00 0.00000000D+00 0.33273973D-14 0.00000000D+00 0.00000000D+00
-0.11136231D-13 0.00000000D+00 0.00000000D+00 0.00000000D+00-0.78839337D-16
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.15575588D-13 0.00000000D+00 0.00000000D+00 0.23221197D-14-0.78683669D-14
0.14826152D-14 0.43954773D+00-0.43954773D+00-0.27033921D-13-0.25617406D+00
0.25617406D+00 0.21721395D-13 0.23221197D-14-0.78683669D-14 0.14826152D-14
-0.43954773D+00 0.43954773D+00-0.27033921D-13 0.25617406D+00-0.25617406D+00
0.21721395D-13-0.23221197D-14 0.78683669D-14-0.14826152D-14-0.43954773D+00
-0.43954773D+00-0.27033921D-13 0.25617406D+00 0.25617406D+00 0.21721395D-13
-0.23221197D-14 0.78683669D-14-0.14826152D-14 0.43954773D+00 0.43954773D+00
-0.27033921D-13-0.25617406D+00-0.25617406D+00 0.21721395D-13
55 Alpha MO OE= 0.41579219D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.91005110D-15 0.00000000D+00 0.00000000D+00-0.15678621D-15
0.00000000D+00 0.00000000D+00-0.11959034D-14 0.00000000D+00 0.00000000D+00
0.21968085D-13 0.00000000D+00 0.00000000D+00-0.27532891D-14 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.37747661D-14 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.81572931D-14 0.52829786D-14-0.15959694D-13
0.41641702D-14 0.69061415D-14 0.43954773D+00-0.43954773D+00-0.25426659D-14
-0.25617406D+00 0.25617406D+00-0.52829786D-14 0.15959694D-13-0.41641702D-14
0.69061415D-14 0.43954773D+00 0.43954773D+00-0.25426659D-14-0.25617406D+00
-0.25617406D+00 0.52829786D-14-0.15959694D-13 0.41641702D-14 0.69061415D-14
-0.43954773D+00 0.43954773D+00-0.25426659D-14 0.25617406D+00-0.25617406D+00
-0.52829786D-14 0.15959694D-13-0.41641702D-14 0.69061415D-14-0.43954773D+00
-0.43954773D+00-0.25426659D-14 0.25617406D+00 0.25617406D+00
56 Alpha MO OE= 0.41828199D+01
-0.14243920D-14-0.45556417D-14 0.17580396D-13-0.86750339D-13 0.17771769D-12
0.38696434D-12 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.59110425D-01-0.97332140D-01 0.38221715D-01 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.31645708D+00 0.52108313D+00-0.20462604D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.48494127D-14 0.86206024D-14
-0.62769049D-13-0.31223389D+00 0.51412914D+00-0.20189526D+00 0.25504230D+00
-0.41995660D+00 0.16491430D+00-0.48494127D-14 0.86206024D-14-0.62769049D-13
0.31223389D+00-0.51412914D+00-0.20189526D+00-0.25504230D+00 0.41995660D+00
0.16491430D+00-0.48494127D-14 0.86206024D-14-0.62769049D-13-0.31223389D+00
-0.51412914D+00 0.20189526D+00 0.25504230D+00 0.41995660D+00-0.16491430D+00
-0.48494127D-14 0.86206024D-14-0.62769049D-13 0.31223389D+00 0.51412914D+00
0.20189526D+00-0.25504230D+00-0.41995660D+00-0.16491430D+00
57 Alpha MO OE= 0.41828199D+01
0.14054076D-14 0.47506314D-14-0.20427927D-13 0.70596622D-13-0.21344527D-12
-0.10427794D-12 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.78262055D-01 0.12060102D-01-0.90322158D-01 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.41898838D+00-0.64565681D-01 0.48355406D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.91269631D-14 0.27550999D-13
0.14099268D-13-0.41339688D+00-0.63704036D-01 0.47710092D+00 0.33767537D+00
0.52035429D-01-0.38971080D+00-0.91269631D-14 0.27550999D-13 0.14099268D-13
0.41339688D+00 0.63704036D-01 0.47710092D+00-0.33767537D+00-0.52035429D-01
-0.38971080D+00-0.91269631D-14 0.27550999D-13 0.14099268D-13-0.41339688D+00
0.63704036D-01-0.47710092D+00 0.33767537D+00-0.52035429D-01 0.38971080D+00
-0.91269631D-14 0.27550999D-13 0.14099268D-13 0.41339688D+00-0.63704036D-01
-0.47710092D+00-0.33767537D+00 0.52035429D-01 0.38971080D+00
58 Alpha MO OE= 0.42554399D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.15321598D-02 0.00000000D+00 0.00000000D+00-0.54045828D-02
0.00000000D+00 0.00000000D+00-0.57297820D-01 0.00000000D+00 0.00000000D+00
0.68567056D+00 0.00000000D+00 0.00000000D+00 0.26800741D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.48149916D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.69633667D-01 0.59096077D-01-0.25745973D+00
-0.12989545D+00 0.57444442D+00-0.19577037D+00-0.19577037D+00-0.36683582D+00
0.21708482D+00 0.21708482D+00-0.59096077D-01 0.25745973D+00 0.12989545D+00
0.57444442D+00-0.19577037D+00 0.19577037D+00-0.36683582D+00 0.21708482D+00
-0.21708482D+00 0.59096077D-01-0.25745973D+00-0.12989545D+00 0.57444442D+00
0.19577037D+00 0.19577037D+00-0.36683582D+00-0.21708482D+00-0.21708482D+00
-0.59096077D-01 0.25745973D+00 0.12989545D+00 0.57444442D+00 0.19577037D+00
-0.19577037D+00-0.36683582D+00-0.21708482D+00 0.21708482D+00
59 Alpha MO OE= 0.42554399D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.15321598D-02 0.00000000D+00
0.00000000D+00-0.54045828D-02 0.00000000D+00 0.00000000D+00-0.57297820D-01
0.00000000D+00 0.00000000D+00 0.68567056D+00 0.00000000D+00 0.00000000D+00
0.26800741D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.48149916D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.69633667D-01 0.00000000D+00 0.00000000D+00 0.59096077D-01-0.25745973D+00
-0.12989545D+00-0.19577037D+00-0.19577037D+00 0.57444442D+00 0.21708482D+00
0.21708482D+00-0.36683582D+00 0.59096077D-01-0.25745973D+00-0.12989545D+00
0.19577037D+00 0.19577037D+00 0.57444442D+00-0.21708482D+00-0.21708482D+00
-0.36683582D+00-0.59096077D-01 0.25745973D+00 0.12989545D+00 0.19577037D+00
-0.19577037D+00 0.57444442D+00-0.21708482D+00 0.21708482D+00-0.36683582D+00
-0.59096077D-01 0.25745973D+00 0.12989545D+00-0.19577037D+00 0.19577037D+00
0.57444442D+00 0.21708482D+00-0.21708482D+00-0.36683582D+00
60 Alpha MO OE= 0.42554399D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.15321598D-02 0.00000000D+00 0.00000000D+00
-0.54045828D-02 0.00000000D+00 0.00000000D+00-0.57297820D-01 0.00000000D+00
0.00000000D+00 0.68567056D+00 0.00000000D+00 0.00000000D+00 0.26800741D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.48149916D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.69633667D-01 0.00000000D+00 0.59096077D-01-0.25745973D+00
-0.12989545D+00-0.19577037D+00 0.57444442D+00-0.19577037D+00 0.21708482D+00
-0.36683582D+00 0.21708482D+00-0.59096077D-01 0.25745973D+00 0.12989545D+00
-0.19577037D+00 0.57444442D+00 0.19577037D+00 0.21708482D+00-0.36683582D+00
-0.21708482D+00-0.59096077D-01 0.25745973D+00 0.12989545D+00 0.19577037D+00
0.57444442D+00-0.19577037D+00-0.21708482D+00-0.36683582D+00 0.21708482D+00
0.59096077D-01-0.25745973D+00-0.12989545D+00 0.19577037D+00 0.57444442D+00
0.19577037D+00-0.21708482D+00-0.36683582D+00-0.21708482D+00
61 Alpha MO OE= 0.44516927D+01
0.11781354D-02-0.36009817D-02 0.81252014D-01 0.42972087D+00-0.35001094D+00
-0.95471427D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.58177567D+00 0.58177567D+00 0.58177567D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.12435384D+01 0.12435384D+01 0.12435384D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.28999131D+00-0.82303508D+00
-0.15275276D+00-0.39157313D+00-0.39157313D+00-0.39157313D+00 0.48377188D+00
0.48377188D+00 0.48377188D+00 0.28999131D+00-0.82303508D+00-0.15275276D+00
0.39157313D+00 0.39157313D+00-0.39157313D+00-0.48377188D+00-0.48377188D+00
0.48377188D+00 0.28999131D+00-0.82303508D+00-0.15275276D+00-0.39157313D+00
0.39157313D+00 0.39157313D+00 0.48377188D+00-0.48377188D+00-0.48377188D+00
0.28999131D+00-0.82303508D+00-0.15275276D+00 0.39157313D+00-0.39157313D+00
0.39157313D+00-0.48377188D+00 0.48377188D+00-0.48377188D+00
62 Alpha MO OE= 0.44685013D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.53342168D-01 0.00000000D+00 0.00000000D+00 0.48843281D-02
0.00000000D+00 0.00000000D+00-0.23263351D-01 0.00000000D+00 0.00000000D+00
0.17172696D+01 0.00000000D+00 0.00000000D+00 0.22600268D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.55146931D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.71123592D+00 0.16360641D+00-0.71813675D+00
-0.47448907D+00-0.28463290D+00-0.43129837D+00-0.43129837D+00 0.35072872D+00
0.54785914D+00 0.54785914D+00-0.16360641D+00 0.71813675D+00 0.47448907D+00
-0.28463290D+00-0.43129837D+00 0.43129837D+00 0.35072872D+00 0.54785914D+00
-0.54785914D+00 0.16360641D+00-0.71813675D+00-0.47448907D+00-0.28463290D+00
0.43129837D+00 0.43129837D+00 0.35072872D+00-0.54785914D+00-0.54785914D+00
-0.16360641D+00 0.71813675D+00 0.47448907D+00-0.28463290D+00 0.43129837D+00
-0.43129837D+00 0.35072872D+00-0.54785914D+00 0.54785914D+00
63 Alpha MO OE= 0.44685013D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.53342168D-01 0.00000000D+00 0.00000000D+00
0.48843281D-02 0.00000000D+00 0.00000000D+00-0.23263351D-01 0.00000000D+00
0.00000000D+00 0.17172696D+01 0.00000000D+00 0.00000000D+00 0.22600268D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.55146931D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.71123592D+00 0.00000000D+00 0.16360641D+00-0.71813675D+00
-0.47448907D+00-0.43129837D+00-0.28463290D+00-0.43129837D+00 0.54785914D+00
0.35072872D+00 0.54785914D+00-0.16360641D+00 0.71813675D+00 0.47448907D+00
-0.43129837D+00-0.28463290D+00 0.43129837D+00 0.54785914D+00 0.35072872D+00
-0.54785914D+00-0.16360641D+00 0.71813675D+00 0.47448907D+00 0.43129837D+00
-0.28463290D+00-0.43129837D+00-0.54785914D+00 0.35072872D+00 0.54785914D+00
0.16360641D+00-0.71813675D+00-0.47448907D+00 0.43129837D+00-0.28463290D+00
0.43129837D+00-0.54785914D+00 0.35072872D+00-0.54785914D+00
64 Alpha MO OE= 0.44685013D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.53342168D-01 0.00000000D+00
0.00000000D+00 0.48843281D-02 0.00000000D+00 0.00000000D+00-0.23263351D-01
0.00000000D+00 0.00000000D+00 0.17172696D+01 0.00000000D+00 0.00000000D+00
0.22600268D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00-0.55146931D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.71123592D+00 0.00000000D+00 0.00000000D+00 0.16360641D+00-0.71813675D+00
-0.47448907D+00-0.43129837D+00-0.43129837D+00-0.28463290D+00 0.54785914D+00
0.54785914D+00 0.35072872D+00 0.16360641D+00-0.71813675D+00-0.47448907D+00
0.43129837D+00 0.43129837D+00-0.28463290D+00-0.54785914D+00-0.54785914D+00
0.35072872D+00-0.16360641D+00 0.71813675D+00 0.47448907D+00 0.43129837D+00
-0.43129837D+00-0.28463290D+00-0.54785914D+00 0.54785914D+00 0.35072872D+00
-0.16360641D+00 0.71813675D+00 0.47448907D+00-0.43129837D+00 0.43129837D+00
-0.28463290D+00 0.54785914D+00-0.54785914D+00 0.35072872D+00
65 Alpha MO OE= 0.91916866D+01
0.11088291D+00 0.44197589D+00-0.30507352D+01 0.18982920D+01 0.50265681D+01
0.34422482D+01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.22191688D+01-0.22191688D+01-0.22191688D+01 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.17423800D+01-0.17423800D+01-0.17423800D+01
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.74719192D-01 0.14071341D+00
-0.39213999D+00 0.26757049D-02 0.26757049D-02 0.26757049D-02 0.30064346D-01
0.30064346D-01 0.30064346D-01-0.74719192D-01 0.14071341D+00-0.39213999D+00
-0.26757049D-02-0.26757049D-02 0.26757049D-02-0.30064346D-01-0.30064346D-01
0.30064346D-01-0.74719192D-01 0.14071341D+00-0.39213999D+00 0.26757049D-02
-0.26757049D-02-0.26757049D-02 0.30064346D-01-0.30064346D-01-0.30064346D-01
-0.74719192D-01 0.14071341D+00-0.39213999D+00-0.26757049D-02 0.26757049D-02
-0.26757049D-02-0.30064346D-01 0.30064346D-01-0.30064346D-01
66 Alpha MO OE= 0.12230740D+02
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.11952770D+01 0.00000000D+00 0.00000000D+00 0.13703060D+01
0.00000000D+00 0.00000000D+00-0.99359731D+00 0.00000000D+00 0.00000000D+00
0.50394493D+00 0.00000000D+00 0.00000000D+00-0.20052785D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.28601225D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.64500013D-01-0.49038934D-02 0.28525271D-01
0.46505514D-01-0.18789246D-01-0.26433101D-01-0.26433101D-01-0.42702564D-01
-0.23372655D-01-0.23372655D-01 0.49038934D-02-0.28525271D-01-0.46505514D-01
-0.18789246D-01-0.26433101D-01 0.26433101D-01-0.42702564D-01-0.23372655D-01
0.23372655D-01-0.49038934D-02 0.28525271D-01 0.46505514D-01-0.18789246D-01
0.26433101D-01 0.26433101D-01-0.42702564D-01 0.23372655D-01 0.23372655D-01
0.49038934D-02-0.28525271D-01-0.46505514D-01-0.18789246D-01 0.26433101D-01
-0.26433101D-01-0.42702564D-01 0.23372655D-01-0.23372655D-01
67 Alpha MO OE= 0.12230740D+02
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.11952770D+01 0.00000000D+00 0.00000000D+00
0.13703060D+01 0.00000000D+00 0.00000000D+00-0.99359731D+00 0.00000000D+00
0.00000000D+00 0.50394493D+00 0.00000000D+00 0.00000000D+00-0.20052785D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.28601225D-01 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.64500013D-01 0.00000000D+00-0.49038934D-02 0.28525271D-01
0.46505514D-01-0.26433101D-01-0.18789246D-01-0.26433101D-01-0.23372655D-01
-0.42702564D-01-0.23372655D-01 0.49038934D-02-0.28525271D-01-0.46505514D-01
-0.26433101D-01-0.18789246D-01 0.26433101D-01-0.23372655D-01-0.42702564D-01
0.23372655D-01 0.49038934D-02-0.28525271D-01-0.46505514D-01 0.26433101D-01
-0.18789246D-01-0.26433101D-01 0.23372655D-01-0.42702564D-01-0.23372655D-01
-0.49038934D-02 0.28525271D-01 0.46505514D-01 0.26433101D-01-0.18789246D-01
0.26433101D-01 0.23372655D-01-0.42702564D-01 0.23372655D-01
68 Alpha MO OE= 0.12230740D+02
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.11952770D+01 0.00000000D+00
0.00000000D+00 0.13703060D+01 0.00000000D+00 0.00000000D+00-0.99359731D+00
0.00000000D+00 0.00000000D+00 0.50394493D+00 0.00000000D+00 0.00000000D+00
-0.20052785D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00-0.28601225D-01
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
-0.64500013D-01 0.00000000D+00 0.00000000D+00-0.49038934D-02 0.28525271D-01
0.46505514D-01-0.26433101D-01-0.26433101D-01-0.18789246D-01-0.23372655D-01
-0.23372655D-01-0.42702564D-01-0.49038934D-02 0.28525271D-01 0.46505514D-01
0.26433101D-01 0.26433101D-01-0.18789246D-01 0.23372655D-01 0.23372655D-01
-0.42702564D-01 0.49038934D-02-0.28525271D-01-0.46505514D-01 0.26433101D-01
-0.26433101D-01-0.18789246D-01 0.23372655D-01-0.23372655D-01-0.42702564D-01
0.49038934D-02-0.28525271D-01-0.46505514D-01-0.26433101D-01 0.26433101D-01
-0.18789246D-01-0.23372655D-01 0.23372655D-01-0.42702564D-01
69 Alpha MO OE= 0.14789411D+03
-0.15653127D+01 0.19247440D+01-0.16129325D+01 0.81480488D+00 0.11656418D+01
0.82218066D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00 0.00000000D+00
0.00000000D+00-0.54096889D+00-0.54096889D+00-0.54096889D+00 0.00000000D+00
0.00000000D+00 0.00000000D+00-0.41083015D+00-0.41083015D+00-0.41083015D+00
0.00000000D+00 0.00000000D+00 0.00000000D+00-0.14648226D-01 0.30595618D-01
-0.92277693D-01 0.25076528D-02 0.25076528D-02 0.25076528D-02 0.56536968D-02
0.56536968D-02 0.56536968D-02-0.14648226D-01 0.30595618D-01-0.92277693D-01
-0.25076528D-02-0.25076528D-02 0.25076528D-02-0.56536968D-02-0.56536968D-02
0.56536968D-02-0.14648226D-01 0.30595618D-01-0.92277693D-01 0.25076528D-02
-0.25076528D-02-0.25076528D-02 0.56536968D-02-0.56536968D-02-0.56536968D-02
-0.14648226D-01 0.30595618D-01-0.92277693D-01-0.25076528D-02 0.25076528D-02
-0.25076528D-02-0.56536968D-02 0.56536968D-02-0.56536968D-02