%chk=000117636.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117636

0 1
 O    3.813300     -0.4465000     -0.7143000    
 O   -1.822200      -2.581800      0.5346000    
 O   0.2433000      -2.361800     -0.3882000    
 N    1.246700      0.1580000      0.2169000    
 C  -0.1065000      0.5373000      7.2300002E-02
 C    2.309400       1.106900      0.3270000    
 C   -1.112500     -0.4233000     -3.0700000E-02
 C  -0.4306000       1.893400      3.4000002E-02
 C    3.635600      0.3763000      0.4317000    
 C   -2.442700     -2.7899999E-02 -0.1720000    
 C   -1.760700       2.289000     -0.1071000    
 C   -2.766700       1.328300     -0.2102000    
 C  -0.8065000      -1.848000      5.7999999E-03
 H    2.184200       1.738500       1.213700    
 H    2.334900       1.746100     -0.5638000    
 H    1.461300     -0.8315000      0.2538000    
 H   0.3168000       2.677100      0.1117000    
 H    3.664200     -0.2682000       1.316300    
 H    4.470500       1.081300      0.4914000    
 H   -3.248500     -0.7508000     -0.2685000    
 H   -2.013800       3.344800     -0.1374000    
 H   -3.802000       1.636800     -0.3233000    
 H    3.804200      0.1325000      -1.495400    
 H   -1.608700      -3.539000      0.5561000    


%chk=000117636-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117636

0 1
O 3.951191 -0.689425 -0.410955
O -1.925170 -2.699278 0.018458
O 0.360466 -2.343368 0.047310
N 1.238214 0.204977 0.134185
C -0.088705 0.574372 0.062730
C 2.348565 1.154655 0.143078
C -1.144669 -0.419297 0.027223
C -0.475510 1.955521 0.028204
C 3.665541 0.438545 0.485799
C -2.506215 -0.006247 -0.019312
C -1.827107 2.327421 -0.018710
C -2.859276 1.351016 -0.038998
C -0.809080 -1.845368 0.033587
H 2.179556 1.945449 0.903772
H 2.443874 1.670887 -0.840814
H 1.446894 -0.805562 0.074975
H 0.293123 2.733474 0.032883
H 3.599483 -0.023825 1.484472
H 4.494023 1.177450 0.486796
H -3.274111 -0.784546 -0.041144
H -2.085650 3.392731 -0.043252
H -3.910209 1.653094 -0.074698
H 4.039047 -0.359263 -1.341460
H -1.591274 -3.635914 0.020271


