%chk=000020186.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020186

0 1
 O    2.065800     -0.4779000     -0.7389000    
 O   0.4062000       1.392700     -0.7228000    
 O   0.5530000      -2.120200     -0.2863000    
 O   0.7177000       1.604500       1.564900    
 N  -0.1330000      0.1048000     -0.4717000    
 C    3.139000      -1.226800     -0.1564000    
 C    4.464800     -0.6076000     -0.5717000    
 C    2.972200      -1.247800       1.355400    
 C   -1.520900     -0.1107000     -0.2303000    
 C   0.7944000     -0.9320000     -0.4787000    
 C   -1.902100      -1.159800      0.5817000    
 C   -2.440100      0.7366000     -0.8153000    
 C   -3.260500      -1.370700      0.8184000    
 C   -3.798400      0.5257000     -0.5783000    
 C   -4.208500     -0.5280000      0.2386000    
 C   0.7978000       2.035500      0.4225000    
 C    1.352500       3.381800      6.8700001E-02
 H    3.107100      -2.250800     -0.5484000    
 H    5.312300      -1.164300     -0.1607000    
 H    4.552200     -0.5916000      -1.663400    
 H    4.531100      0.4333000     -0.2362000    
 H    3.823900      -1.743600       1.832900    
 H    2.068800      -1.776300       1.673000    
 H    2.901000     -0.2299000       1.754200    
 H   -1.205300      -1.801500       1.108000    
 H   -2.135300       1.558100      -1.456800    
 H   -3.580000      -2.181700       1.466400    
 H   -4.536900       1.181700      -1.029800    
 H   -5.266000     -0.6901000      0.4257000    
 H    1.663200       3.897100      0.9821000    
 H    2.225300       3.264000     -0.5784000    
 H   0.5839000       3.981500     -0.4251000    


%chk=000020186-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020186

0 1
O 2.082997 -0.345699 -0.229043
O 0.229961 1.339754 -0.656596
O 0.631310 -2.131713 0.250799
O 0.755000 1.792084 1.609664
N -0.186542 0.015231 -0.237543
C 3.263343 -1.248729 0.047382
C 4.418353 -0.637529 -0.747554
C 3.501206 -1.306069 1.562252
C -1.605124 -0.170363 -0.136345
C 0.832345 -0.924782 -0.042987
C -2.161064 -1.407119 0.293004
C -2.462769 0.909621 -0.475573
C -3.562708 -1.538426 0.383974
C -3.860787 0.754898 -0.374628
C -4.423705 -0.467096 0.056045
C 0.748886 2.155326 0.429614
C 1.275976 3.430278 -0.179117
H 2.995828 -2.251027 -0.335584
H 5.321740 -1.263271 -0.633099
H 4.168279 -0.575960 -1.820262
H 4.651236 0.378077 -0.381253
H 4.390538 -1.926399 1.777882
H 2.635673 -1.753530 2.078209
H 3.673416 -0.293145 1.966792
H -1.504141 -2.240100 0.544287
H -2.040363 1.854665 -0.823082
H -3.979824 -2.494900 0.718497
H -4.509746 1.597290 -0.638879
H -5.509920 -0.582324 0.132718
H 1.286058 4.225934 0.580506
H 2.311206 3.255013 -0.524548
H 0.678543 3.736008 -1.052231


