%chk=000119382.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119382

0 1
 O   -1.395200     -0.2448000      -1.513500    
 O   -2.292300       1.913800     -1.0500000E-02
 N    5.247000     -0.1061000      0.3010000    
 C    3.808100      0.1009000      0.4616000    
 C    3.257800       1.003300     -0.6435000    
 C    5.506300      -1.125800     -0.7148000    
 C    5.853900     -0.4884000       1.575400    
 C    1.778500       1.243200     -0.4766000    
 C   0.8603000      0.3816000      -1.077000    
 C    1.328200       2.326800      0.2775000    
 C    6.997500      -1.310500     -0.9391000    
 C    5.292100      -1.807800       2.077200    
 C  -0.5082000      0.6038000     -0.9232000    
 C  -0.9583000       1.687500     -0.1689000    
 C  -4.0100001E-02   2.549000      0.4313000    
 C   -1.335600      -1.616500      -1.126800    
 C   -2.718100      -2.247500      -1.251000    
 C   -3.732000      -1.591000     -0.3458000    
 C   -3.922300      -2.069000      0.9508000    
 C   -4.478600     -0.5060000     -0.8055000    
 C   -4.859000      -1.462300       1.787400    
 C   -5.415300      0.1007000      3.1300001E-02
 C   -2.669300       3.042700      0.7752000    
 C   -5.605400     -0.3775000       1.327700    
 H    3.602800      0.5995000       1.419200    
 H    3.251200     -0.8454000      0.4787000    
 H    3.784000       1.967300     -0.6423000    
 H    3.427500      0.5753000      -1.638400    
 H    5.025100      -2.089900     -0.5160000    
 H    5.098600     -0.7878000      -1.674600    
 H    6.946500     -0.5317000       1.514800    
 H    5.655900      0.2929000       2.320900    
 H    1.214100     -0.4586000      -1.669500    
 H    2.034900       3.003200      0.7511000    
 H    7.160900      -1.893500      -1.852600    
 H    7.480400      -1.860800     -0.1260000    
 H    7.509500     -0.3511000      -1.070900    
 H    5.714800      -2.010000       3.068900    
 H    5.570900      -2.662900       1.455300    
 H    4.206700      -1.801300       2.209900    
 H  -0.3169000       3.409200       1.031000    
 H  -0.9725000      -1.715500     -9.5100001E-02
 H  -0.6370000      -2.137300      -1.791400    
 H   -3.068600      -2.168300      -2.288100    
 H   -2.660000      -3.319300      -1.025900    
 H   -3.345000      -2.912100       1.320900    
 H   -4.340100     -0.1229000      -1.813000    
 H   -5.006500      -1.833900       2.797200    
 H   -5.995400      0.9464000     -0.3261000    
 H   -2.336500       2.940400       1.813700    
 H   -2.334900       3.981200      0.3201000    
 H   -3.763900       3.071100      0.7940000    
 H   -6.334000      9.5700003E-02   1.979500    


%chk=000119382-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000119382

0 1
O -1.701101 0.324667 -1.186390
O -2.173602 2.825413 -0.485789
N 5.043474 -0.361871 0.426798
C 3.650693 0.144983 0.451589
C 3.287913 0.967276 -0.819388
C 5.204977 -1.562758 -0.430768
C 5.670618 -0.458454 1.769593
C 1.865630 1.502280 -0.762546
C 0.764972 0.640706 -1.025661
C 1.598993 2.840956 -0.406658
C 6.675378 -1.910165 -0.731033
C 5.089269 -1.533205 2.730861
C -0.564360 1.101803 -0.934562
C -0.819669 2.460727 -0.564666
C 0.269059 3.319673 -0.308161
C -1.514707 -1.111315 -1.453616
C -2.917814 -1.729846 -1.573854
C -3.678861 -1.838776 -0.257246
C -4.035458 -3.111056 0.259218
C -4.049792 -0.678351 0.475175
C -4.743172 -3.229927 1.478069
C -4.754913 -0.796767 1.693602
C -2.464600 4.213018 -0.122410
C -5.105781 -2.070571 2.200353
H 3.536695 0.807548 1.330444
H 2.899382 -0.674847 0.575011
H 4.015425 1.794487 -0.904139
H 3.419638 0.330241 -1.715543
H 4.692528 -2.460224 0.002703
H 4.695770 -1.351754 -1.389756
H 6.753045 -0.638891 1.634099
H 5.581871 0.537687 2.244353
H 0.963240 -0.396855 -1.315374
H 2.433028 3.522753 -0.204190
H 6.728753 -2.724757 -1.476657
H 7.216986 -2.250618 0.169860
H 7.200065 -1.027121 -1.136880
H 5.610975 -1.493918 3.705406
H 5.212837 -2.554074 2.325050
H 4.012444 -1.366134 2.916325
H 0.093744 4.363223 -0.030064
H -0.939337 -1.576667 -0.627326
H -0.953910 -1.238421 -2.403380
H -3.485085 -1.116120 -2.300208
H -2.803202 -2.736089 -2.020787
H -3.760444 -4.016109 -0.297814
H -3.768855 0.307715 0.090278
H -5.011268 -4.221954 1.859825
H -5.032102 0.107232 2.248355
H -2.073921 4.458136 0.885007
H -2.045052 4.921435 -0.863678
H -3.562285 4.283805 -0.122437
H -5.655611 -2.158147 3.144509


