%chk=000075871.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075871

0 1
 O   0.1472000       1.504000     -0.4748000    
 N    2.824100      -2.495200     -0.6751000    
 N   -4.632900      -1.165800      0.4986000    
 C    1.326700      0.8385000     -0.1853000    
 C   -1.022700      0.8507000     -0.2366000    
 C    1.469900     -0.4806000     -0.5758000    
 C    2.658600      -1.150000     -0.2851000    
 C   -1.201800      0.1540000      0.9585000    
 C   -2.042500      0.8775000      -1.187800    
 C    2.331800       1.511000      0.4859000    
 C   -3.420600     -0.4889000      0.2513000    
 C   -2.400800     -0.5158000       1.202400    
 C   -3.241500      0.2077000     -0.9438000    
 C    3.684000     -0.4888000      0.3911000    
 C    3.520600      0.8416000      0.7766000    
 H   0.6881000     -0.9995000      -1.124400    
 H  -0.4340000      0.1353000       1.727500    
 H   -1.908500       1.418100      -2.120800    
 H    2.206000       2.546700      0.7867000    
 H   -2.530300      -1.050900       2.139800    
 H   -4.028600      0.2361000      -1.693000    
 H    4.615100     -0.9995000      0.6234000    
 H    4.318900       1.356600       1.303100    
 H    3.685500      -2.981200     -0.4637000    
 H    2.080600      -2.975900      -1.163900    
 H   -4.762700      -1.671700       1.364600    
 H   -5.372600      -1.147600     -0.1908000    


%chk=000075871-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000075871

0 1
O 0.135199 1.476155 -0.002571
N 2.955353 -2.536076 -0.482555
N -4.884072 -1.134791 0.214231
C 1.380279 0.799610 0.044822
C -1.082352 0.738199 0.039964
C 1.514678 -0.577485 -0.229989
C 2.808455 -1.172639 -0.209939
C -1.407158 -0.098383 1.132214
C -2.023658 0.959745 -0.986214
C 2.500222 1.612221 0.337707
C -3.631580 -0.514692 0.157120
C -2.667667 -0.723985 1.187526
C -3.289764 0.342214 -0.928981
C 3.944994 -0.365844 0.087664
C 3.775799 1.009217 0.352108
H 0.633168 -1.181768 -0.469740
H -0.678278 -0.252444 1.934917
H -1.758249 1.621834 -1.816269
H 2.354931 2.675921 0.542124
H -2.914214 -1.369796 2.039263
H -4.018048 0.524233 -1.728680
H 4.944711 -0.815557 0.108261
H 4.655576 1.622783 0.578011
H 3.875489 -2.964796 -0.496885
H 2.150689 -3.112259 -0.709318
H -5.137202 -1.725094 1.000436
H -5.579701 -0.970123 -0.506629


