%chk=000006808.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006808

0 1
 O    2.589200      -1.372700     -0.1084000    
 O   0.2087000       2.505200      0.5930000    
 N    1.677200      0.7090000      0.4032000    
 C   0.2673000     -0.8395000     -0.6097000    
 C  -0.2749000      0.5792000     -0.8339000    
 C  -0.4728000      -1.659800      0.4593000    
 C   -1.788700      0.7483000     -0.7618000    
 C    1.671200     -0.5668000     -0.1125000    
 C   0.5157000       1.406500      0.1586000    
 C   -1.903300      -1.290500      0.6773000    
 C   -2.489600     -0.2189000      0.1348000    
 H   0.3062000      -1.383800      -1.559700    
 H   5.9700001E-02  0.9374000      -1.819200    
 H   3.7099998E-02  -1.598900       1.429800    
 H  -0.4278000      -2.717500      0.1697000    
 H   -2.206400      0.6163000      -1.768000    
 H   -2.046000       1.767200     -0.4504000    
 H    2.456200       1.092400      0.9267000    
 H   -2.490400      -1.938600       1.322400    
 H   -3.540400     -3.4800000E-02  0.3408000    


%chk=000006808-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006808

0 1
O 2.648148 -1.447315 -0.101149
O 0.384746 2.624539 0.481594
N 1.781122 0.720102 0.295743
C 0.246809 -0.860859 -0.568298
C -0.304385 0.576601 -0.813661
C -0.480497 -1.616651 0.588291
C -1.824425 0.816316 -0.633675
C 1.704848 -0.625360 -0.141739
C 0.599543 1.463379 0.067110
C -1.983697 -1.434613 0.533704
C -2.575200 -0.338066 -0.003119
H 0.206860 -1.478867 -1.479547
H -0.031220 0.860702 -1.851349
H -0.105912 -1.251134 1.568133
H -0.206545 -2.685803 0.540846
H -2.287039 1.046385 -1.612889
H -1.961640 1.734614 -0.025689
H 2.607236 1.110898 0.755851
H -2.600570 -2.223470 0.983170
H -3.669981 -0.251696 0.008672


