%chk=000036154.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036154

0 1
 O   -2.841600     -0.1128000       1.104600    
 N    2.868900      0.9918000     -0.3588000    
 N   -2.460400     -0.3473000      -1.087300    
 N   -3.812600     -0.1196000     -0.9109000    
 C    1.874200      0.1587000      0.3324000    
 C   0.4580000      0.4555000     -0.1339000    
 C    2.322900      -1.257800      6.0000001E-03
 C    3.841200      -1.165500     -2.4300000E-02
 C    4.150700      0.3226000     -0.1114000    
 C  -0.5377000     -0.5236000      0.5280000    
 C   9.8700002E-02   1.916600      0.1689000    
 C   -1.973000     -0.3294000      0.1034000    
 C   -3.989200      1.0900000E-02  0.3832000    
 H    1.960100      0.3260000       1.415600    
 H   0.3934000      0.3227000      -1.223300    
 H    1.958500      -1.580000     -0.9776000    
 H    1.987800      -1.988700      0.7490000    
 H    4.277100      -1.595200      0.8843000    
 H    4.242300      -1.713900     -0.8832000    
 H    2.884000       1.936300      2.1800000E-02
 H    4.579600      0.6727000      0.8351000    
 H    4.866600      0.5438000     -0.9084000    
 H  -0.4685000     -0.4372000       1.620100    
 H  -0.2800000      -1.558800      0.2764000    
 H   0.1646000       2.125500       1.242300    
 H  -0.9199000       2.152600     -0.1557000    
 H   0.7591000       2.614300     -0.3555000    
 H   -4.899900      0.1984000      0.9300000    


%chk=000036154-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000036154

0 1
O -2.875166 0.438037 0.838177
N 2.870905 1.003579 -0.228163
N -2.521598 -1.091572 -0.820375
N -3.898292 -0.629600 -0.901292
C 1.884175 0.115948 0.436386
C 0.434623 0.438665 -0.010186
C 2.385541 -1.301931 0.024943
C 3.907204 -1.139597 -0.299142
C 4.204564 0.371337 -0.085583
C -0.553937 -0.540022 0.703821
C 0.064628 1.914029 0.263796
C -1.954930 -0.447791 0.199476
C -4.047522 0.249384 0.078926
H 1.927501 0.205598 1.555712
H 0.379135 0.252680 -1.100841
H 1.835938 -1.641481 -0.871611
H 2.210488 -2.039741 0.827376
H 4.541428 -1.767260 0.350686
H 4.107599 -1.430115 -1.344108
H 2.833182 1.985087 0.073350
H 4.653247 0.525042 0.926315
H 4.909499 0.774936 -0.834053
H -0.547295 -0.343281 1.792518
H -0.219390 -1.579484 0.543357
H 0.197355 2.165119 1.334800
H -0.987084 2.123942 0.000767
H 0.694891 2.592225 -0.338057
H -4.931790 0.814867 0.353807


