%chk=000019776.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019776

0 1
 O  -0.3526000       1.887600     -0.2192000    
 O    2.350100      0.2767000      -1.354600    
 N    2.509300      0.4292000      0.9536000    
 C   -3.052900       1.042600      1.8100001E-02
 C   -1.904300      8.8299997E-02  1.3600000E-02
 C  -0.5931000      0.5487000     -0.1067000    
 C   0.4670000     -0.3581000     -0.1100000    
 C   0.2155000      -1.725200      7.0000002E-03
 C   -2.155700      -1.278700      0.1307000    
 C   -3.843200       1.003700       1.338900    
 C   -4.006600      0.8191000      -1.169900    
 C   -1.095800      -2.185400      0.1273000    
 C    1.837100      0.1277000     -0.2340000    
 C    1.329800      -2.720700      7.0000002E-03
 C    3.860100      0.9414000      0.9951000    
 C    4.435200       1.102900     -0.3969000    
 H   -2.709300       2.078200     -6.7500003E-02
 H   -3.168100      -1.661500      0.2256000    
 H   -3.182100       1.186700       2.193400    
 H   -4.620700       1.775600       1.344600    
 H   -4.334700      3.7500001E-02   1.495500    
 H   -4.502900     -0.1561000      -1.121300    
 H   -4.787100       1.587700      -1.185700    
 H   -3.463100      0.8733000      -2.119800    
 H   -1.309600      -3.246900      0.2199000    
 H    1.921700      -2.637400     -0.9105000    
 H    1.980700      -2.567900      0.8740000    
 H   0.9566000      -3.749500      5.6800000E-02
 H    2.029900      0.2890000       1.838400    
 H    3.833600       1.900900       1.520700    
 H    4.459800      0.2435000       1.587200    
 H  -0.9627000       2.256900     -0.8794000    
 H    4.549900      0.1523000     -0.9279000    
 H    3.907700       1.852300     -0.9961000    
 H    5.456400       1.492800     -0.2936000    


%chk=000019776-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019776

0 1
O -0.146770 1.738786 0.183886
O 2.840738 -0.959522 -0.984277
N 2.366539 1.096202 -0.047137
C -3.008991 1.029935 0.409794
C -1.891006 0.021952 0.104754
C -0.520499 0.381629 -0.009534
C 0.521302 -0.555366 -0.313182
C 0.150522 -1.933043 -0.481382
C -2.212231 -1.340631 -0.081027
C -3.747087 0.680248 1.729863
C -4.002431 1.144692 -0.778192
C -1.216068 -2.291301 -0.358141
C 1.982110 -0.159384 -0.477268
C 1.134100 -3.052585 -0.776673
C 3.764100 1.540844 -0.163892
C 4.619299 1.155261 1.064276
H -2.589020 2.052111 0.559294
H -3.256842 -1.663813 -0.002167
H -3.044478 0.629165 2.580469
H -4.519608 1.437970 1.956672
H -4.249614 -0.300507 1.649614
H -4.502488 0.176680 -0.962247
H -4.785254 1.895397 -0.563096
H -3.483272 1.435487 -1.708701
H -1.494621 -3.342912 -0.485149
H 1.605430 -2.925945 -1.765260
H 1.972211 -3.066041 -0.060139
H 0.610188 -4.024685 -0.742178
H 1.637712 1.737067 0.283591
H 4.193920 1.072647 -1.066991
H 3.765038 2.637927 -0.305033
H -0.947087 2.293380 0.357378
H 4.212624 1.598861 1.991252
H 4.637869 0.058087 1.178742
H 5.659566 1.508610 0.936381


