%chk=000006855.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006855

0 1
 O  -0.3706000     -0.4393000      0.6762000    
 O  -0.7406000     -0.7412000      -1.605200    
 N    1.478300       1.517900      9.9600002E-02
 C    3.216200     -0.1486000     -3.1999999E-03
 C    1.872000      0.2333000      0.1896000    
 C   0.9433000     -0.7625000      0.4802000    
 C    3.591900      -1.498900      9.8499998E-02
 C    1.316600      -2.105000      0.5807000    
 C    4.151300      0.8534000     -0.2952000    
 C    2.642300      -2.474000      0.3898000    
 C   -2.552600     -9.9600002E-02 -0.1942000    
 C    3.748800       2.177900     -0.3887000    
 C   -1.141600     -0.4600000     -0.4857000    
 C    2.412100       2.454400     -0.1844000    
 C   -3.553400     -0.6414000     -0.9741000    
 C   -2.818200      0.7650000      0.8476000    
 C   -4.878700     -0.3033000     -0.7003000    
 C   -4.143500       1.103000       1.121400    
 C   -5.173700      0.5688000      0.3474000    
 H    4.627100      -1.798500     -4.9100000E-02
 H   0.5747000      -2.865500      0.8093000    
 H    5.199100      0.6070000     -0.4515000    
 H    2.936200      -3.516300      0.4675000    
 H    4.458500       2.965200     -0.6138000    
 H    2.039200       3.471500     -0.2448000    
 H   -3.336500      -1.324200      -1.790200    
 H   -2.033200       1.204600       1.455500    
 H   -5.681000     -0.7197000      -1.302400    
 H   -4.373500       1.784600       1.935200    
 H   -6.205600      0.8324000      0.5602000    


%chk=000006855-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006855

0 1
O -0.400710 -0.871758 0.633898
O -0.726998 -0.787795 -1.689615
N 1.211249 1.237299 -0.277544
C 3.251508 -0.162343 0.013836
C 1.817863 0.039988 0.066220
C 0.996828 -1.055079 0.507254
C 3.808920 -1.417594 0.419612
C 1.556769 -2.266755 0.905933
C 4.049091 0.937315 -0.445083
C 2.974208 -2.445076 0.864050
C -2.526834 -0.108709 -0.182111
C 3.430138 2.135077 -0.805621
C -1.164353 -0.587203 -0.540409
C 2.005081 2.239514 -0.696547
C -3.464662 0.070117 -1.232875
C -2.899030 0.176917 1.156958
C -4.766383 0.527353 -0.945499
C -4.203139 0.634934 1.439121
C -5.138236 0.809754 0.391182
H 4.895134 -1.559688 0.377718
H 0.898010 -3.073013 1.241923
H 5.137638 0.822867 -0.505878
H 3.398805 -3.404191 1.178244
H 4.009856 2.991976 -1.162233
H 1.500756 3.176253 -0.961944
H -3.152078 -0.150741 -2.258944
H -2.163944 0.042554 1.954671
H -5.489285 0.664736 -1.756822
H -4.490996 0.858172 2.472169
H -6.150305 1.166118 0.614238


