%chk=000086345.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086345

0 1
 O   -2.889700     -0.7191000      0.3353000    
 O    2.767100       1.285100      0.8648000    
 O    3.120600      -1.447200      0.4540000    
 N  -0.3968000      0.1953000     -0.7152000    
 C   -1.687500      0.7346000      -1.151700    
 C   0.5956000       1.021200     -0.1327000    
 C   -2.697700      0.6443000     -2.0600000E-02
 C  -0.1222000      -1.153200     -0.8925000    
 C    1.784600      0.5143000      0.2836000    
 C   0.2904000       2.491300      2.8700000E-02
 C    1.009000      -1.767400     -0.5387000    
 C    2.060300     -0.9446000      9.6500002E-02
 C   -3.833900     -0.8546000       1.388400    
 H   -2.054200      0.1542000      -2.009100    
 H   -1.603200       1.764800      -1.513900    
 H   -3.651600       1.069100     -0.3542000    
 H   -2.359100       1.200800      0.8599000    
 H  -0.9219000      -1.715900      -1.362600    
 H   0.9442000       3.016000      0.7291000    
 H  -0.7136000       2.651600      0.4312000    
 H   0.3615000       2.998000     -0.9395000    
 H    1.177800      -2.824400     -0.6967000    
 H    2.630000       2.221100      0.6572000    
 H   -3.944100      -1.918100       1.616700    
 H   -4.808200     -0.4601000       1.084000    
 H   -3.482200     -0.3397000       2.287700    


%chk=000086345-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086345

0 1
O -3.139536 -0.737545 0.149619
O 2.958174 1.291583 0.635894
O 3.292013 -1.434903 0.462915
N -0.372061 0.229618 -0.675256
C -1.698730 0.753000 -1.074525
C 0.646816 1.076761 -0.178450
C -2.757339 0.668560 0.036672
C -0.155508 -1.141551 -0.754324
C 1.878829 0.525180 0.172675
C 0.352275 2.560905 -0.060441
C 1.041096 -1.717558 -0.383707
C 2.168905 -0.933076 0.115285
C -4.023147 -0.997377 1.286813
H -2.062738 0.159599 -1.931944
H -1.599493 1.794695 -1.417881
H -3.640424 1.288472 -0.240201
H -2.350254 1.044952 1.001134
H -1.005937 -1.726326 -1.110765
H 1.071532 3.056923 0.615298
H -0.642695 2.751941 0.378984
H 0.400303 3.085579 -1.034533
H 1.172733 -2.799811 -0.463808
H 2.783628 2.261242 0.545486
H -4.234636 -2.077368 1.269842
H -4.975631 -0.433231 1.198188
H -3.532976 -0.732865 2.246731


