%chk=000096156.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096156

0 1
 O   -2.939500      0.8488000     -0.4712000    
 O   -2.077700     -0.5261000       1.120000    
 O  -0.1678000      -1.963700     -0.6625000    
 N   0.4629000     -0.1160000      0.1337000    
 N   0.5750000     -0.9920000     -0.8465000    
 C    1.710400      0.5628000      0.4817000    
 C    2.156600       1.468900     -0.6625000    
 C    2.779600     -0.4752000      0.8076000    
 C  -0.5814000      0.8783000     -0.1445000    
 C   -1.917900      0.3142000      0.2441000    
 H    1.558300       1.170100       1.383600    
 H    3.121100       1.928000     -0.4136000    
 H    2.301100      0.9277000      -1.604300    
 H    1.464000       2.296700     -0.8448000    
 H    2.436700      -1.171200       1.582000    
 H    3.675600      2.2000000E-02   1.197000    
 H    3.094600      -1.057100     -6.5899998E-02
 H  -0.6008000       1.187500      -1.198300    
 H  -0.4676000       1.778200      0.4746000    
 H   -3.807300      0.4778000     -0.2034000    


%chk=000096156-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096156

0 1
O -2.643613 1.491815 0.186254
O -1.460233 0.066808 1.596130
O -0.012781 -1.938364 -1.841579
N 0.546045 -0.229864 -0.478160
N 0.882151 -1.447102 -1.056899
C 1.546828 0.409424 0.427920
C 2.088833 1.714354 -0.206028
C 2.687600 -0.560682 0.788075
C -0.748190 0.399444 -0.763673
C -1.605136 0.598034 0.476366
H 0.995951 0.656175 1.356754
H 2.783006 2.204902 0.499039
H 2.639602 1.491939 -1.137344
H 1.283983 2.435436 -0.436661
H 2.299126 -1.491493 1.232337
H 3.345076 -0.064673 1.524178
H 3.287366 -0.830824 -0.096407
H -1.269531 -0.297431 -1.458067
H -0.638157 1.363965 -1.289072
H -3.232027 1.587838 0.983637


