%chk=000052906.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052906

0 1
 N   -3.911300      0.7177000     -0.5288000    
 N    2.731300      -1.678400     -0.8230000    
 C   -1.580800     -0.9456000      0.1258000    
 C  -0.3887000      -1.298200       1.035400    
 C   -2.916900      -1.034800      0.8665000    
 C   0.9154000      -1.179500      0.3520000    
 C   -4.080400     -0.6472000     -4.4599999E-02
 C    1.736700     -1.9200001E-02  0.2883000    
 C    2.869500     -0.3592000     -0.4544000    
 C    1.553600      -2.182700     -0.3405000    
 C    1.624800       1.291600      0.7929000    
 C    3.900000      0.5499000     -0.7189000    
 C   -3.889900       1.662300      0.5895000    
 C   -4.978100       1.067400      -1.468200    
 C    2.647900       2.211600      0.5363000    
 C    3.767100       1.844400     -0.2083000    
 H   -1.593500      -1.621600     -0.7391000    
 H   -1.422800      6.4800002E-02 -0.2698000    
 H  -0.5155000      -2.322200       1.410100    
 H  -0.4037000     -0.6500000       1.920500    
 H   -3.068600      -2.074000       1.186400    
 H   -2.896500     -0.4471000       1.790300    
 H   -5.025900     -0.7676000      0.4999000    
 H   -4.107100      -1.344000     -0.8922000    
 H    1.276800      -3.209700     -0.5343000    
 H    3.402600      -2.198400      -1.370900    
 H   0.7584000       1.595000       1.373700    
 H    4.771700      0.2649000      -1.298300    
 H   -2.972700       1.583000       1.180600    
 H   -4.755700       1.546000       1.251700    
 H   -3.895100       2.693400      0.2151000    
 H   -4.820700       2.073100      -1.873700    
 H   -5.968600       1.034100      -1.000100    
 H   -4.977200      0.3828000      -2.323800    
 H    2.566700       3.224200      0.9225000    
 H    4.549800       2.575100     -0.3957000    


%chk=000052906-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052906

0 1
N -3.924937 0.906556 -0.343370
N 3.030319 -1.810135 -0.530159
C -1.527031 -0.987399 0.099775
C -0.384507 -1.512151 1.012332
C -2.918806 -1.149961 0.747291
C 0.995071 -1.348529 0.420567
C -4.061201 -0.551609 -0.102962
C 1.712122 -0.098464 0.212285
C 2.984731 -0.419231 -0.383761
C 1.832824 -2.362629 -0.042546
C 1.406714 1.263184 0.480418
C 3.938821 0.569216 -0.713106
C -4.097360 1.717144 0.877594
C -4.801122 1.372878 -1.436109
C 2.353914 2.253823 0.156589
C 3.606400 1.910902 -0.435254
H -1.499763 -1.531589 -0.865687
H -1.366142 0.078728 -0.143993
H -0.567044 -2.581757 1.239525
H -0.439610 -0.976317 1.983454
H -3.137705 -2.226949 0.902256
H -2.914152 -0.693301 1.758050
H -5.046063 -0.792431 0.380531
H -4.060856 -1.049528 -1.092784
H 1.664995 -3.438416 -0.058897
H 3.808863 -2.337903 -0.917031
H 0.447322 1.540603 0.931629
H 4.902873 0.311187 -1.166377
H -3.349168 1.434102 1.637463
H -5.114320 1.609067 1.337840
H -3.943357 2.784127 0.635976
H -4.609837 2.442847 -1.636033
H -5.893818 1.255388 -1.214181
H -4.577842 0.808359 -2.359042
H 2.130089 3.307456 0.358156
H 4.322185 2.704632 -0.677542


