%chk=000074122.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074122

0 1
 N   -1.044100       1.462700     -0.2315000    
 N    4.500400      0.9779000      0.2472000    
 C   -5.876900      0.1558000     -0.1604000    
 C   -4.428800     -0.2601000      0.1191000    
 C   -6.950800     -0.8802000      0.1856000    
 C   -3.410600      0.8483000     -0.1680000    
 C   -8.377500     -0.3834000     -5.5399999E-02
 C   -1.969900      0.3935000      5.5100001E-02
 C   -9.401200      -1.485900      0.2182000    
 C   -10.82340     -0.9891000      1.2200000E-02
 C   0.3317000       1.342300     -0.1132000    
 C    1.155000       2.428200     -0.4109000    
 C   0.8928000      0.1354000      0.3047000    
 C    3.100500       1.100800      0.1273000    
 C    2.539200       2.307500     -0.2906000    
 C    2.277300      1.4700000E-02  0.4250000    
 C    5.378200     -0.1137000      0.1011000    
 C    6.563200     -0.1595000      0.8358000    
 C    5.062700      -1.149200     -0.7787000    
 C    7.432700      -1.240300      0.6904000    
 C    5.932300      -2.230200     -0.9239000    
 C    7.117200      -2.275700     -0.1893000    
 H   -6.088400       1.073700      0.4031000    
 H   -5.968900      0.4183000      -1.221900    
 H   -4.339600     -0.5656000       1.168800    
 H   -4.190300      -1.141500     -0.4886000    
 H   -6.772000      -1.783400     -0.4109000    
 H   -6.842900      -1.170100       1.238000    
 H   -3.527900       1.188700      -1.204700    
 H   -3.626100       1.714800      0.4700000    
 H   -8.476800     -4.1099999E-02  -1.092600    
 H   -8.577500      0.4799000      0.5906000    
 H   -1.766600     -0.4654000     -0.5959000    
 H   -1.861700      6.9399998E-02   1.097300    
 H   -9.293300      -1.847000       1.247700    
 H   -9.217500      -2.338400     -0.4459000    
 H   -1.412700       2.356100     -0.5394000    
 H   -11.53850      -1.793000      0.2123000    
 H   -10.97430     -0.6482000      -1.017100    
 H   -11.05000     -0.1572000      0.6867000    
 H   0.7310000       3.374400     -0.7378000    
 H   0.2894000     -0.7331000      0.5511000    
 H    3.170400       3.160400     -0.5267000    
 H    2.685500     -0.9299000      0.7738000    
 H    4.966900       1.848700      0.4859000    
 H    6.819700      0.6408000       1.525200    
 H    4.158300      -1.129700      -1.380400    
 H    8.355400      -1.275900       1.262300    
 H    5.689500      -3.034000      -1.612700    
 H    7.794800      -3.116800     -0.3033000    


%chk=000074122-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000074122

0 1
N -1.057467 1.413161 -0.268726
N 4.590683 0.984246 0.342628
C -5.967510 0.237226 -0.123635
C -4.514737 -0.264924 0.034384
C -7.023106 -0.867962 0.105189
C -3.464160 0.840948 -0.207214
C -8.477040 -0.362622 -0.032853
C -2.019796 0.341854 -0.006060
C -9.533073 -1.468984 0.192157
C -10.983059 -0.954782 0.060257
C 0.325644 1.276545 -0.126997
C 1.189689 2.381478 -0.390523
C 0.925198 0.050214 0.286008
C 3.179205 1.035045 0.155767
C 2.583742 2.256429 -0.265260
C 2.322226 -0.060669 0.436748
C 5.464775 -0.104288 0.163569
C 6.780352 -0.017092 0.710002
C 5.111114 -1.272506 -0.573152
C 7.707000 -1.061807 0.526607
C 6.047300 -2.314069 -0.741433
C 7.349282 -2.226078 -0.194915
H -6.147362 1.068005 0.590424
H -6.100507 0.665433 -1.139224
H -4.382049 -0.682363 1.054082
H -4.337598 -1.102147 -0.671992
H -6.852287 -1.693664 -0.617023
H -6.882602 -1.305520 1.115886
H -3.575665 1.233859 -1.239245
H -3.655633 1.688045 0.483448
H -8.619524 0.078345 -1.041812
H -8.650420 0.459847 0.692548
H -1.832187 -0.524713 -0.678971
H -1.905295 -0.032376 1.035253
H -9.386615 -1.912048 1.198509
H -9.362601 -2.288568 -0.535632
H -1.422562 2.312956 -0.577827
H -11.717317 -1.764562 0.226043
H -11.164756 -0.534965 -0.947255
H -11.188853 -0.155899 0.797637
H 0.760067 3.339939 -0.709323
H 0.299768 -0.819470 0.509826
H 3.225013 3.114951 -0.501301
H 2.745500 -1.001535 0.801918
H 5.027262 1.854399 0.650248
H 7.066693 0.874160 1.283885
H 4.123148 -1.348006 -1.035926
H 8.711559 -0.969365 0.955847
H 5.756368 -3.200593 -1.317489
H 8.068093 -3.040806 -0.330381


