%chk=000097847.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097847

0 1
 O   -4.716700      -1.801100     -0.5697000    
 O   -2.388200      -2.023100      0.7015000    
 N    5.637700      0.5881000     -0.2122000    
 C    4.298600      0.1687000     -7.0400000E-02
 C    1.649800     -0.6607000      0.2102000    
 C    3.284500       1.113700      8.5299999E-02
 C    3.988300      -1.191200     -8.5900001E-02
 C    1.960100      0.6991000      0.2257000    
 C    2.663800      -1.605900      5.4400001E-02
 C   0.2689000      -1.093100      0.3565000    
 C    6.092400       1.815200      0.4107000    
 C    6.580200     -0.2098000     -0.9712000    
 C   -3.335200      3.9200000E-02  0.1063000    
 C  -0.8177000     -0.3199000      0.1334000    
 C   -2.186900     -0.8707000      0.3348000    
 C   -4.541600     -0.4701000     -0.3339000    
 C   -3.155600       1.388800      0.3444000    
 C   -5.609300      0.4027000     -0.5440000    
 C   -4.223300       2.261600      0.1342000    
 C   -5.450000       1.768600     -0.3100000    
 H    3.491600       2.180100      9.4300002E-02
 H    4.754700      -1.953400     -0.1934000    
 H    1.207000       1.469500      0.3632000    
 H    2.440700      -2.670100      4.1400000E-02
 H   0.1360000      -2.118800      0.6939000    
 H    5.793600       2.685600     -0.1827000    
 H    7.184800       1.834400      0.4956000    
 H    5.696100       1.920100       1.427100    
 H    7.450800      0.3850000      -1.269500    
 H    6.130300     -0.5927000      -1.894300    
 H    6.945800      -1.051600     -0.3737000    
 H  -0.7151000      0.6848000     -0.2559000    
 H   -2.233700       1.810600      0.7308000    
 H   -6.570900      3.2600001E-02 -0.8895000    
 H   -4.102900       3.324000      0.3257000    
 H   -6.281800       2.447900     -0.4715000    
 H   -5.628900      -1.953100     -0.8711000    


%chk=000097847-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000097847

0 1
O -4.589838 -1.437163 -1.451127
O -2.365757 -2.177347 0.244949
N 5.774547 0.556385 -0.205149
C 4.434404 0.180142 -0.123343
C 1.650117 -0.591627 0.040653
C 3.380973 1.150000 -0.242702
C 4.054209 -1.187026 0.080641
C 2.036918 0.768295 -0.162563
C 2.702323 -1.548622 0.157986
C 0.266389 -1.037296 0.131018
C 6.136744 1.965742 -0.411686
C 6.832959 -0.456361 -0.085035
C -3.410886 0.007702 0.095822
C -0.879962 -0.280221 0.048431
C -2.216202 -0.917458 0.127907
C -4.596292 -0.301185 -0.633900
C -3.401038 1.198520 0.868459
C -5.727636 0.549860 -0.566247
C -4.526077 2.047045 0.948932
C -5.695459 1.715609 0.227288
H 3.621563 2.204835 -0.401570
H 4.816609 -1.964521 0.177939
H 1.265626 1.540498 -0.261924
H 2.440937 -2.602712 0.314212
H 0.104608 -2.116327 0.280039
H 5.733283 2.358361 -1.366766
H 7.233206 2.061029 -0.443173
H 5.762921 2.610299 0.409141
H 7.816802 0.028734 -0.179871
H 6.754751 -1.226910 -0.878197
H 6.799087 -0.970849 0.896392
H -0.842258 0.802847 -0.117013
H -2.500420 1.440843 1.444097
H -6.631015 0.300327 -1.139143
H -4.493657 2.948538 1.569131
H -6.578871 2.361653 0.276755
H -5.465708 -1.546638 -1.899883


