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|
Water
SP RMP2-FC STO-3G
Number of atoms I 3
Info1-9 I N= 9
12 12 0 0 0 110
1 2 1
Full Title C N= 1
Water
Route C N= 4
#P MP2/STO-3G Density Pop=(Full,NaturalOrbitals)
Charge I 0
Multiplicity I 1
Number of electrons I 10
Number of alpha electrons I 5
Number of beta electrons I 5
Number of basis functions I 7
Number of independent functions I 7
Number of point charges in /Mol/ I 0
Number of translation vectors I 0
Atomic numbers I N= 3
8 1 1
Nuclear charges R N= 3
8.00000000E+00 1.00000000E+00 1.00000000E+00
Current cartesian coordinates R N= 9
-1.23259516E-32 0.00000000E+00 2.25178583E-01 -9.86076132E-32 1.49411036E+00
-9.00714333E-01 -1.82975747E-16 -1.49411036E+00 -9.00714333E-01
Number of symbols in /Mol/ I 0
Force Field I 0
Atom Types C N= 3
Int Atom Types I N= 3
0 0 0
MM charges R N= 3
0.00000000E+00 0.00000000E+00 0.00000000E+00
Integer atomic weights I N= 3
16 1 1
Real atomic weights R N= 3
1.59949146E+01 1.00782504E+00 1.00782504E+00
Atom fragment info I N= 3
0 0 0
Atom residue num I N= 3
0 0 0
Nuclear spins I N= 3
0 1 1
Nuclear ZEff R N= 3
-5.60000000E+00 -1.00000000E+00 -1.00000000E+00
Nuclear ZNuc R N= 3
8.00000000E+00 1.00000000E+00 1.00000000E+00
Nuclear QMom R N= 3
0.00000000E+00 0.00000000E+00 0.00000000E+00
Nuclear GFac R N= 3
0.00000000E+00 2.79284600E+00 2.79284600E+00
MicOpt I N= 3
-1 -1 -1
Number of residues I 0
Number of secondary structures I 0
SymInf integers I N= 26
2 4 1 1 1 -1
-1 1 -1 1 1 1
-1 1 0 0 0 0
0 0 0 0 0 0
0 0
RotTr to input orientation R N= 12
2.33155031E-16 -1.00000000E+00 -2.07661063E-16 -6.01815023E-01 -3.06161700E-16
7.98635510E-01 -7.98635510E-01 -6.12323400E-17 -6.01815023E-01 1.79835613E-01
0.00000000E+00 1.35515854E-01
Number of contracted shells I 4
Number of primitive shells I 12
Pure/Cartesian d shells I 0
Pure/Cartesian f shells I 0
Highest angular momentum I 1
Largest degree of contraction I 3
Shell types I N= 4
0 -1 0 0
Number of primitives per shell I N= 4
3 3 3 3
Shell to atom map I N= 4
1 1 2 3
Primitive exponents R N= 12
1.30709321E+02 2.38088661E+01 6.44360831E+00 5.03315132E+00 1.16959612E+00
3.80388960E-01 3.42525091E+00 6.23913730E-01 1.68855404E-01 3.42525091E+00
6.23913730E-01 1.68855404E-01
Contraction coefficients R N= 12
1.54328967E-01 5.35328142E-01 4.44634542E-01 -9.99672292E-02 3.99512826E-01
7.00115469E-01 1.54328967E-01 5.35328142E-01 4.44634542E-01 1.54328967E-01
5.35328142E-01 4.44634542E-01
P(S=P) Contraction coefficients R N= 12
0.00000000E+00 0.00000000E+00 0.00000000E+00 1.55916275E-01 6.07683719E-01
3.91957393E-01 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00
Coordinates of each shell R N= 12
-8.32662098E-33 6.24996119E-18 2.25178583E-01 -8.32662098E-33 6.24996119E-18
2.25178583E-01 -1.08403510E-32 1.49411036E+00 -9.00714333E-01 -1.82975747E-16
-1.49411036E+00 -9.00714333E-01
Num ILSW I 100
ILSW I N= 100
0 0 0 0 2 0
0 0 0 0 0 -1
5 0 0 0 0 0
0 0 0 0 0 0
1 0 0 0 0 0
0 0 100000 0 -1 0
0 0 0 0 0 0
0 0 0 1 0 0
0 -2000000000 1 0 0 0
0 0 4 52 0 0
0 0 0 0 0 0
0 0 0 3 0 1
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0
Num RLSW I 52
RLSW R N= 52
1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00
0.00000000E+00 0.00000000E+00 1.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 1.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 1.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 1.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 1.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 1.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 1.00000000E+00 1.00000000E+00
0.00000000E+00 1.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00
MxBond I 2
NBond I N= 3
2 1 1
IBond I N= 6
2 3 1 0 1 0
RBond R N= 6
1.00000000E+00 1.00000000E+00 1.00000000E+00 0.00000000E+00 1.00000000E+00
0.00000000E+00
Virial Ratio R 2.006004929613248E+00
SCF Energy R -7.496432879135465E+01
MP2 Energy R -7.500228212745357E+01
Total Energy R -7.500228212745357E+01
Post-SCF wavefunction norm R 1.007309533593989E+00
RMS Density R 2.786553489831593E-10
Job Status I 1
Nuclear derivative order I 0
External E-field R N= 35
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
IOpCl I 0
IROHF I 0
Alpha Orbital Energies R N= 7
-2.02437548E+01 -1.25064474E+00 -6.03166236E-01 -4.45469870E-01 -3.88214643E-01
5.70748223E-01 7.08591552E-01
Alpha MO coefficients R N= 49
9.94202990E-01 2.59157124E-02 0.00000000E+00 0.00000000E+00 -3.99311323E-03
-5.62726393E-03 -5.62726393E-03 -2.34217947E-01 8.45881884E-01 0.00000000E+00
0.00000000E+00 -1.17047748E-01 1.56449280E-01 1.56449280E-01 0.00000000E+00
0.00000000E+00 0.00000000E+00 6.03305187E-01 0.00000000E+00 4.46376722E-01
-4.46376722E-01 -1.00458170E-01 5.21395179E-01 0.00000000E+00 0.00000000E+00
7.74266755E-01 -2.89064162E-01 -2.89064162E-01 0.00000000E+00 0.00000000E+00
1.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
-1.28350478E-01 8.32525362E-01 0.00000000E+00 0.00000000E+00 -7.32626229E-01
-7.75800555E-01 -7.75800555E-01 0.00000000E+00 0.00000000E+00 0.00000000E+00
9.76484497E-01 0.00000000E+00 -8.08915582E-01 8.08915582E-01
Orthonormal basis R N= 49
1.57252278E-01 4.28560439E-01 0.00000000E+00 0.00000000E+00 -1.95811808E-01
3.76796213E-01 3.76796213E-01 6.15697368E-01 2.96936683E-01 0.00000000E+00
0.00000000E+00 6.43206968E-01 -1.30213105E-01 -1.30213105E-01 7.53129753E-01
-2.92177617E-01 0.00000000E+00 0.00000000E+00 -6.50863973E-01 -1.60116329E-01
-1.60116329E-01 -3.14400013E-01 1.15062418E+00 0.00000000E+00 0.00000000E+00
-5.23703103E-01 -7.24820362E-01 -7.24820362E-01 0.00000000E+00 0.00000000E+00
1.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 6.86604997E-01 0.00000000E+00
3.73727127E-01 -3.73727127E-01 0.00000000E+00 0.00000000E+00 0.00000000E+00
-9.19822102E-01 0.00000000E+00 8.44940608E-01 -8.44940608E-01
Total SCF Density R N= 28
2.10677895E+00 -4.49467291E-01 1.97608144E+00 6.69751577E-33 -3.75432340E-32
2.00000000E+00 -3.01629295E-18 1.69079694E-17 -2.77333912E-31 7.27954298E-01
-1.08673406E-01 6.09173799E-01 -1.00235271E-31 1.38349321E-17 1.22641026E+00
-2.63980302E-02 -3.70497666E-02 -1.23259516E-32 5.38602783E-01 -4.84204673E-01
6.14636622E-01 -2.63980302E-02 -3.70497666E-02 7.08742220E-32 -5.38602783E-01
-4.84204673E-01 -1.82372089E-01 6.14636622E-01
Total MP2 Density R N= 28
2.10753003E+00 -4.54102226E-01 2.00352083E+00 6.69751577E-33 -3.75432340E-32
1.99897607E+00 -3.01440958E-18 1.68981944E-17 -2.77333912E-31 7.35132526E-01
-1.07729998E-01 6.03807334E-01 -1.00235271E-31 1.38204163E-17 1.20617908E+00
-2.22662991E-02 -5.96356874E-02 -1.23259516E-32 5.22931000E-01 -4.80694828E-01
6.38274664E-01 -2.22662991E-02 -5.96356874E-02 7.08742220E-32 -5.22931000E-01
-4.80694828E-01 -1.75154635E-01 6.38274664E-01
Grdnt Energy R 0.000000000000000E+00
Grdnt NVar I 2
Grdnt IGetFC I 0
Internal Forces R N= 2
0.00000000E+00 0.00000000E+00
Internal Force Constants R N= 3
0.00000000E+00 0.00000000E+00 0.00000000E+00
Mulliken Charges R N= 3
-3.19888666E-01 1.59944333E-01 1.59944333E-01
ONIOM Charges I N= 16
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0
ONIOM Multiplicities I N= 16
1 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0
Atom Layers I N= 3
1 1 1
Atom Modifiers I N= 3
0 0 0
Force Field I 0
Atom Modified Types C N= 3
Int Atom Modified Types I N= 3
0 0 0
Link Atoms I N= 3
0 0 0
Atom Modified MM Charges R N= 3
0.00000000E+00 0.00000000E+00 0.00000000E+00
Link Distances R N= 12
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00
Cartesian Gradient R N= 9
0.00000000E+00 0.00000000E+00 -0.00000000E+00 0.00000000E+00 0.00000000E+00
-0.00000000E+00 0.00000000E+00 0.00000000E+00 -0.00000000E+00
Nonadiabatic coupling R N= 9
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
Dipole Moment R N= 3
-3.46655153E-17 -1.66533454E-16 -6.29265633E-01
Quadrupole Moment R N= 6
-5.99929332E-01 6.95324593E-01 -9.53952616E-02 5.15638679E-17 3.47039506E-17
5.55111512E-17
QEq coupling tensors R N= 18
2.70886353E+00 1.14632391E-16 -2.30882791E+00 1.05353917E-16 1.11022302E-15
-4.00035628E-01 2.32130525E-01 3.30910868E-18 -2.20997475E-01 2.29488747E-18
2.73044571E-01 -1.11330504E-02 2.32130525E-01 -1.09024658E-16 -2.20997475E-01
-7.71655111E-17 -2.73044571E-01 -1.11330504E-02
ClPar MaxAn I 200
ClPar NIntPar I 4
ClPar NRealPar I 16
ClPar NBits I 30
ClPar LenBitVec I 1
ClPar Read BitMap I N= 200
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0
ClPar Default BitMap I N= 200
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 2016 2016 2016 2016
2016 2016 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480 480 480 480 480
480 480
ClPar Int Params I N= 800
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0 0 0 0 0
0 0
ClPar Real Params R N= 3200
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00
2.26000000E-01 4.43000000E-01 1.01000000E-01 1.47000000E-01 1.92000000E-01
2.40000000E-01 2.75000000E-01 3.03000000E-01 3.25000000E-01 4.13000000E-01
9.60000000E-02 1.35000000E-01 1.73000000E-01 2.11000000E-01 2.48000000E-01
2.86000000E-01 3.23000000E-01 3.60000000E-01 8.20000000E-02 1.04000000E-01
1.17000000E-01 1.23000000E-01 1.29000000E-01 1.34000000E-01 1.40000000E-01
1.44000000E-01 1.48000000E-01 1.52000000E-01 1.55000000E-01 1.76000000E-01
1.98000000E-01 2.19000000E-01 2.39000000E-01 2.60000000E-01 2.80000000E-01
3.00000000E-01 7.90000000E-02 9.90000000E-02 1.19000000E-01 1.26000000E-01
1.33000000E-01 1.40000000E-01 1.47000000E-01 1.53000000E-01 1.58000000E-01
1.63000000E-01 1.57000000E-01 1.70000000E-01 1.87000000E-01 2.03000000E-01
2.19000000E-01 2.34000000E-01 2.50000000E-01 2.65000000E-01 7.40000000E-02
9.20000000E-02 1.05000000E-01 1.06000000E-01 1.07000000E-01 1.08000000E-01
1.09000000E-01 1.10000000E-01 1.11000000E-01 1.12000000E-01 1.13000000E-01
1.14000000E-01 1.15000000E-01 1.16000000E-01 1.17000000E-01 1.17000000E-01
1.26000000E-01 1.36000000E-01 1.46000000E-01 1.55000000E-01 1.65000000E-01
1.73000000E-01 1.82000000E-01 1.90000000E-01 1.62000000E-01 1.78000000E-01
1.10000000E-01 1.35000000E-01 1.59000000E-01 1.83000000E-01 2.07000000E-01
2.31000000E-01 6.90000000E-02 9.40000000E-02 1.02000000E-01 1.03000000E-01
1.05000000E-01 1.07000000E-01 1.09000000E-01 1.11000000E-01 1.13000000E-01
1.15000000E-01 1.17000000E-01 1.19000000E-01 1.20000000E-01 1.22000000E-01
1.24000000E-01 1.26000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01 1.28000000E-01
5.47000000E-01 5.92000000E-01 5.99000000E-01 6.68000000E-01 6.98000000E-01
7.18000000E-01 7.26000000E-01 7.36000000E-01 7.43000000E-01 7.45000000E-01
6.07000000E-01 6.66000000E-01 6.93000000E-01 7.09000000E-01 7.20000000E-01
7.29000000E-01 7.35000000E-01 7.40000000E-01 6.08000000E-01 7.34000000E-01
7.46000000E-01 7.55000000E-01 7.61000000E-01 7.65000000E-01 7.67000000E-01
7.60000000E-01 7.49000000E-01 7.33000000E-01 7.08000000E-01 6.48000000E-01
6.88000000E-01 7.09000000E-01 7.22000000E-01 7.31000000E-01 7.38000000E-01
7.44000000E-01 6.09000000E-01 7.30000000E-01 7.41000000E-01 7.52000000E-01
7.58000000E-01 7.63000000E-01 7.66000000E-01 7.58000000E-01 7.48000000E-01
7.33000000E-01 7.01000000E-01 6.45000000E-01 6.86000000E-01 7.08000000E-01
7.22000000E-01 7.31000000E-01 7.38000000E-01 7.44000000E-01 6.08000000E-01
7.28000000E-01 7.32000000E-01 7.32000000E-01 7.32000000E-01 7.32000000E-01
7.32000000E-01 7.32000000E-01 7.32000000E-01 7.32000000E-01 7.32000000E-01
7.31000000E-01 7.31000000E-01 7.31000000E-01 7.31000000E-01 7.46000000E-01
7.37000000E-01 7.46000000E-01 7.51000000E-01 7.55000000E-01 7.58000000E-01
7.47000000E-01 7.32000000E-01 7.11000000E-01 7.41000000E-01 7.07000000E-01
7.47000000E-01 7.43000000E-01 7.42000000E-01 7.42000000E-01 7.43000000E-01
7.44000000E-01 6.05000000E-01 7.24000000E-01 7.26000000E-01 7.26000000E-01
7.27000000E-01 7.27000000E-01 7.27000000E-01 7.28000000E-01 7.28000000E-01
7.28000000E-01 7.28000000E-01 7.28000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01 7.29000000E-01
1.00000000E+00 1.70400000E+00 3.23000000E-01 3.89000000E-01 4.67000000E-01
5.67000000E-01 6.36000000E-01 6.64000000E-01 6.96000000E-01 8.79000000E-01
3.07000000E-01 3.48000000E-01 4.00000000E-01 4.54000000E-01 5.09000000E-01
5.65000000E-01 6.21000000E-01 6.77000000E-01 2.56000000E-01 3.50000000E-01
3.64000000E-01 3.62000000E-01 3.62000000E-01 3.62000000E-01 3.62000000E-01
3.65000000E-01 3.69000000E-01 3.75000000E-01 3.86000000E-01 4.46000000E-01
4.55000000E-01 4.74000000E-01 4.96000000E-01 5.20000000E-01 5.45000000E-01
5.70000000E-01 2.45000000E-01 3.22000000E-01 3.55000000E-01 3.59000000E-01
3.64000000E-01 3.70000000E-01 3.76000000E-01 3.85000000E-01 3.95000000E-01
4.08000000E-01 3.76000000E-01 4.23000000E-01 4.22000000E-01 4.32000000E-01
4.45000000E-01 4.59000000E-01 4.75000000E-01 4.91000000E-01 2.28000000E-01
2.92000000E-01 2.89000000E-01 2.92000000E-01 2.95000000E-01 2.98000000E-01
3.00000000E-01 3.03000000E-01 3.06000000E-01 3.09000000E-01 3.12000000E-01
3.15000000E-01 3.18000000E-01 3.21000000E-01 3.24000000E-01 3.61000000E-01
3.69000000E-01 3.70000000E-01 3.72000000E-01 3.75000000E-01 3.78000000E-01
3.85000000E-01 3.94000000E-01 4.07000000E-01 5.26000000E-01 6.21000000E-01
3.36000000E-01 3.54000000E-01 3.71000000E-01 3.86000000E-01 4.02000000E-01
4.17000000E-01 2.09000000E-01 2.94000000E-01 2.65000000E-01 2.72000000E-01
2.78000000E-01 2.84000000E-01 2.91000000E-01 2.97000000E-01 3.03000000E-01
3.10000000E-01 3.16000000E-01 3.22000000E-01 3.29000000E-01 3.35000000E-01
3.41000000E-01 3.48000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01 3.54000000E-01
2.74000000E-01 2.96000000E-01 5.80000000E-02 4.40000000E-02 3.90000000E-02
3.90000000E-02 3.60000000E-02 3.20000000E-02 2.90000000E-02 3.30000000E-02
5.50000000E-02 3.90000000E-02 3.30000000E-02 3.00000000E-02 2.80000000E-02
2.60000000E-02 2.50000000E-02 2.50000000E-02 4.50000000E-02 4.40000000E-02
3.30000000E-02 2.50000000E-02 2.10000000E-02 1.80000000E-02 1.50000000E-02
1.80000000E-02 2.10000000E-02 2.50000000E-02 3.30000000E-02 5.00000000E-02
3.80000000E-02 3.10000000E-02 2.70000000E-02 2.40000000E-02 2.20000000E-02
2.10000000E-02 4.30000000E-02 4.00000000E-02 3.20000000E-02 2.50000000E-02
2.10000000E-02 1.80000000E-02 1.60000000E-02 1.90000000E-02 2.20000000E-02
2.80000000E-02 3.10000000E-02 4.70000000E-02 3.40000000E-02 2.80000000E-02
2.40000000E-02 2.10000000E-02 1.90000000E-02 1.80000000E-02 3.90000000E-02
3.60000000E-02 2.50000000E-02 2.50000000E-02 2.50000000E-02 2.60000000E-02
2.60000000E-02 2.60000000E-02 2.70000000E-02 2.70000000E-02 2.70000000E-02
2.70000000E-02 2.80000000E-02 2.80000000E-02 2.80000000E-02 3.30000000E-02
3.30000000E-02 2.60000000E-02 2.10000000E-02 1.80000000E-02 1.60000000E-02
1.80000000E-02 2.20000000E-02 2.60000000E-02 4.90000000E-02 8.20000000E-02
3.00000000E-02 2.40000000E-02 2.10000000E-02 1.80000000E-02 1.60000000E-02
1.50000000E-02 3.50000000E-02 3.60000000E-02 2.20000000E-02 2.30000000E-02
2.40000000E-02 2.40000000E-02 2.50000000E-02 2.50000000E-02 2.60000000E-02
2.70000000E-02 2.70000000E-02 2.80000000E-02 2.80000000E-02 2.90000000E-02
3.00000000E-02 3.00000000E-02 3.10000000E-02 3.10000000E-02 3.10000000E-02
3.10000000E-02 3.10000000E-02 3.10000000E-02 3.10000000E-02 3.10000000E-02
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Gaussian Version C N= 2
ES64L-G16RevA.03
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