%chk=000117672.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117672

0 1
 O   5.6100000E-02   2.507700      0.3198000    
 O   -1.456700      -1.086900       1.890300    
 N    1.900400     -0.4234000     -0.7330000    
 C  -0.4657000      0.1117000     -4.4999998E-03
 C   0.5552000     -5.4400001E-02  -1.169200    
 C   -1.857300      0.5063000     -0.5964000    
 C  -3.8800001E-02   1.246900      0.9709000    
 C  -0.5526000      -1.211000      0.7992000    
 C   -2.477000     -0.4897000      -1.570400    
 C    1.880200      -1.716000     -4.8400000E-02
 C    2.456400      0.6088000      0.1418000    
 H   0.2123000     -0.8226000      -1.872600    
 H   0.6070000      0.8700000      -1.759500    
 H   -2.572100      0.6652000      0.2213000    
 H   -1.775500       1.468200      -1.118700    
 H  -0.8790000       1.382300       1.668500    
 H   0.7719000       1.070700       1.668300    
 H  -0.8633000      -2.066700      0.1947000    
 H   0.3224000      -1.419600       1.385700    
 H   -3.466000     -0.1335000      -1.878600    
 H   -2.613200      -1.474100      -1.115000    
 H   -1.878900     -0.6005000      -2.478600    
 H    1.139900      -2.436000     -0.4103000    
 H    2.042900      -1.709100       1.034300    
 H    2.813800      -2.198300     -0.3797000    
 H    2.215300       1.633100     -0.1509000    
 H    3.542900      0.5686000     -2.8600000E-02
 H    2.395100      0.4172000       1.214300    
 H   0.2424000       3.171600       1.005600    
 H   -1.504200      -1.953400       2.329700    


%chk=000117672-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117672

0 1
O 0.032837 2.448530 0.421614
O -2.112795 -0.894222 1.915200
N 1.801553 -0.474403 0.037531
C -0.685880 0.111300 0.193969
C 0.556085 -0.166532 -0.715907
C -1.916755 0.528871 -0.669028
C -0.360432 1.245803 1.192684
C -0.971825 -1.162832 1.014764
C -2.371023 -0.476217 -1.751684
C 2.384792 -1.795384 -0.253268
C 2.805737 0.607474 -0.001151
H 0.317913 -1.014098 -1.389465
H 0.703624 0.724345 -1.359073
H -2.760992 0.706348 0.024526
H -1.677189 1.500447 -1.141095
H -1.253118 1.449492 1.814194
H 0.479702 0.925050 1.841800
H -1.213194 -2.003298 0.328910
H -0.061736 -1.420505 1.595399
H -3.267295 -0.091055 -2.272180
H -2.643055 -1.455334 -1.315148
H -1.595193 -0.647715 -2.520405
H 1.624792 -2.586427 -0.120991
H 3.210861 -2.000370 0.453266
H 2.797967 -1.885977 -1.291120
H 2.313658 1.568717 0.223023
H 3.310448 0.702590 -0.996851
H 3.588979 0.421386 0.757945
H -0.032299 3.242303 1.006663
H -2.252267 -1.675187 2.505880


