%chk=000128865.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128865

0 1
 O   -1.388400      -1.800100     -0.2984000    
 O   -2.028200     -0.1451000       1.112100    
 N    1.606300     -0.7414000     -0.2934000    
 N   -1.230100       1.682000     -0.8335000    
 C   0.9142000      0.5514000     -0.2516000    
 C  -0.5390000      0.3909000     -0.7498000    
 C    1.044300       1.151400       1.151500    
 C   -1.392000     -0.5112000      0.1319000    
 C    3.012900     -0.5778000      3.1300001E-02
 H    1.412800       1.235700     -0.9532000    
 H  -0.5358000     -3.1500001E-02  -1.763200    
 H   0.7397000      0.4406000       1.928000    
 H   0.4142000       2.040900       1.258100    
 H    2.066200       1.479600       1.368300    
 H    1.524200      -1.131400      -1.232400    
 H   -2.136000       1.556600      -1.284500    
 H  -0.7001000       2.313700      -1.432600    
 H    3.537900      -1.511000     -0.2010000    
 H    3.177100     -0.3986000       1.097900    
 H    3.490200      0.2137000     -0.5563000    
 H   -1.943600      -2.376300      0.2691000    


%chk=000128865-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128865

0 1
O -1.159680 -1.901004 -0.552567
O -2.016827 -0.343193 0.941823
N 1.578231 -0.705314 -0.124933
N -1.327526 1.630271 -0.981838
C 0.918101 0.609258 -0.246871
C -0.520723 0.412249 -0.878708
C 0.877278 1.339116 1.111285
C -1.309573 -0.601595 -0.055914
C 3.044640 -0.693443 -0.006334
H 1.458255 1.271258 -0.977668
H -0.372692 -0.022492 -1.885748
H 0.305235 0.752321 1.849897
H 0.416093 2.338864 1.012773
H 1.900619 1.483166 1.501120
H 1.232723 -1.393390 -0.804558
H -1.810402 1.883036 -0.114858
H -0.870259 2.413621 -1.452917
H 3.422181 -1.731135 -0.009217
H 3.353120 -0.236182 0.951350
H 3.560665 -0.133715 -0.825745
H -1.632657 -2.539597 0.047931


