%chk=000009676.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000009676

0 1
 O   -5.447900       1.207700     -0.4062000    
 O    5.949600      0.9697000      0.3168000    
 N    5.580400     -0.3635000      0.1543000    
 C   -2.409400     -0.6975000      0.3145000    
 C   -3.058900      0.5810000     -0.2574000    
 C  -0.9867000     -0.9393000     -0.2105000    
 C  -9.5200002E-02  0.2859000      0.1643000    
 C    1.396400      0.1038000     -0.3055000    
 C   -4.490400      0.4743000      0.3544000    
 C   -2.201300       1.778600      0.1842000    
 C  -0.7370000       1.631400     -0.2678000    
 C    1.932500      -1.257500      0.2929000    
 C   -3.465500      -1.771800      7.4299999E-02
 C  -0.3989000      -2.238100      0.3583000    
 C   -4.809900      -1.040200      0.2447000    
 C    1.047200      -2.454800     -7.3399998E-02
 C    2.272200       1.284300      0.2510000    
 C   -3.159400      0.5826000      -1.811000    
 C    1.498400      0.1125000      -1.853500    
 C    3.411600      -1.556600     -6.6200003E-02
 C   -4.629900      0.9466000       1.806900    
 C    3.721800      0.9586000      0.2457000    
 C    4.245700     -0.3449000      0.1194000    
 C    4.834600       1.747000      0.3700000    
 H   -2.319000     -0.5923000       1.406400    
 H   -1.023700      -1.049700      -1.299100    
 H  -6.8000004E-02  0.3184000       1.265400    
 H   -2.200500       1.872600       1.276600    
 H   -2.616700       2.714300     -0.2086000    
 H  -0.6828000       1.755100      -1.353100    
 H  -0.1721000       2.466600      0.1618000    
 H    1.892300      -1.155900       1.389400    
 H   -3.373700      -2.600300      0.7842000    
 H   -3.386900      -2.192300     -0.9346000    
 H  -0.9953000      -3.097500      3.0300001E-02
 H  -0.4478000      -2.220900       1.454600    
 H   -5.467600      -1.271000     -0.6014000    
 H   -5.323800      -1.406300       1.141300    
 H    1.428900      -3.359300      0.4161000    
 H    1.085800      -2.647800      -1.151800    
 H    1.983600       1.499800       1.288000    
 H    2.099700       2.199300     -0.3282000    
 H   -3.589500       1.525400      -2.169000    
 H   -2.188300      0.4787000      -2.301400    
 H   -3.786400     -0.2294000      -2.192900    
 H    1.176100       1.071800      -2.270800    
 H    2.525500     -3.9400000E-02  -2.199900    
 H   0.8887000     -0.6670000      -2.317200    
 H    3.493500      -1.897600      -1.105100    
 H    3.783600      -2.369500      0.5693000    
 H   -4.455800       2.025500       1.884600    
 H   -5.654500      0.7849000       2.163400    
 H   -3.951000      0.4307000       2.491100    
 H   -5.601900      0.7570000      -1.252600    
 H    5.003600       2.805800      0.4974000    


%chk=000009676-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000009676

0 1
O -5.507074 1.331975 -0.364313
O 6.014965 1.070451 0.230119
N 5.639709 -0.350505 0.091744
C -2.422258 -0.727055 0.297062
C -3.061990 0.585021 -0.248300
C -0.983932 -0.972221 -0.206404
C -0.087742 0.253580 0.175531
C 1.406800 0.081100 -0.299175
C -4.524151 0.482290 0.348605
C -2.195180 1.775071 0.220317
C -0.723868 1.611537 -0.247445
C 1.959891 -1.261723 0.319006
C -3.501747 -1.810931 0.036371
C -0.394222 -2.272133 0.390628
C -4.859354 -1.051955 0.204379
C 1.074799 -2.482990 -0.023215
C 2.252797 1.270265 0.276347
C -3.167702 0.590963 -1.800036
C 1.533722 0.079886 -1.846971
C 3.434014 -1.559303 -0.072973
C -4.656036 0.963725 1.803413
C 3.734764 0.997214 0.210786
C 4.288800 -0.331286 0.085599
C 4.837373 1.822885 0.295332
H -2.341785 -0.603199 1.401032
H -1.005378 -1.079971 -1.311377
H -0.053682 0.258787 1.292268
H -2.210074 1.831439 1.326744
H -2.605274 2.732733 -0.156824
H -0.673625 1.728360 -1.346379
H -0.132541 2.444224 0.177996
H 1.926176 -1.126720 1.423599
H -3.414666 -2.663093 0.732847
H -3.398963 -2.219028 -0.987962
H -1.003303 -3.141817 0.077198
H -0.461943 -2.218453 1.498537
H -5.521353 -1.213394 -0.667900
H -5.419205 -1.403425 1.088836
H 1.486108 -3.380272 0.481498
H 1.130127 -2.688515 -1.111813
H 1.954580 1.435176 1.333161
H 2.013670 2.203417 -0.266288
H -3.584082 1.554716 -2.146288
H -2.185137 0.468719 -2.283828
H -3.811425 -0.224201 -2.181857
H 1.098819 0.998121 -2.280416
H 2.592463 0.049171 -2.160640
H 1.022067 -0.782275 -2.308984
H 3.478799 -1.906174 -1.124525
H 3.829230 -2.387628 0.543675
H -4.471697 2.049061 1.872885
H -5.684910 0.773380 2.154509
H -3.956232 0.437536 2.475829
H -5.609537 0.990496 -1.288279
H 4.976396 2.896468 0.400736


