%chk=000067160.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067160

0 1
 N    2.012400      -1.432100     -0.7297000    
 N   -2.008400       1.425200     -0.7397000    
 N    5.144400      0.9873000       1.058300    
 N   -5.151400     -0.9776000       1.058900    
 C   1.1300000E-02 -9.2000002E-03 -0.7333000    
 C    1.033500     -0.7573000      0.1245000    
 C   -1.035500      0.7351000      9.8499998E-02
 C    3.051100      -2.060900      7.7200003E-02
 C   -3.040000       2.059700      8.2999997E-02
 C    3.781400      -1.047600      0.9615000    
 C   -3.772100       1.046600      0.9657000    
 C    1.347900      -2.423000      -1.578000    
 C   -1.347100       2.422800      -1.582900    
 C    4.454900      6.7800000E-02  0.1600000    
 C   -4.461000     -5.7599999E-02  0.1617000    
 C    5.825600       2.032500      0.3079000    
 C   -5.847000      -2.011700      0.3065000    
 H   0.5701000      0.6838000      -1.372300    
 H  -0.5371000     -0.6945000      -1.388800    
 H   0.5244000      -1.467100      0.7894000    
 H    1.498300      6.5000001E-03  0.7539000    
 H  -0.5362000       1.433300      0.7834000    
 H   -1.509500     -3.5799999E-02  0.7129000    
 H    2.633100      -2.852300      0.7133000    
 H    3.790800      -2.536800     -0.5793000    
 H   -2.609000       2.842800      0.7207000    
 H   -3.779300       2.546100     -0.5662000    
 H    4.562100      -1.599700       1.504200    
 H    3.135700     -0.6404000       1.747200    
 H   -4.543500       1.601200       1.518600    
 H   -3.122900      0.6282000       1.742700    
 H   0.6994000      -3.098000      -1.007600    
 H    2.091600      -3.040300      -2.097100    
 H   0.7689000      -1.954500      -2.379400    
 H  -0.7082000       3.101800      -1.006500    
 H   -2.092100       3.032800      -2.108400    
 H  -0.7551000       1.957100      -2.376300    
 H    5.164700     -0.3753000     -0.5493000    
 H    3.706100      0.6229000     -0.4159000    
 H   -5.172600      0.3964000     -0.5388000    
 H   -3.721800     -0.6150000     -0.4241000    
 H    5.826500      0.4743000       1.616200    
 H   -5.824900     -0.4628000       1.625500    
 H    6.586200       1.617200     -0.3612000    
 H    6.325900       2.713200       1.003600    
 H    5.117000       2.625800     -0.2793000    
 H   -6.347600      -2.693100       1.001300    
 H   -5.147900      -2.606800     -0.2901000    
 H   -6.609200      -1.585400     -0.3539000    


%chk=000067160-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000067160

0 1
N 2.051183 -1.481079 -0.674854
N -2.051673 1.481929 -0.674394
N 5.331033 0.951823 1.019443
N -5.331879 -0.951059 1.018663
C -0.000094 0.000582 -0.791767
C 0.943881 -0.849903 0.085627
C -0.943499 0.851600 0.085675
C 3.078093 -2.090312 0.213920
C -3.078068 2.090940 0.215104
C 3.881644 -1.063697 1.041577
C -3.881545 1.063795 1.042201
C 1.565205 -2.457055 -1.673347
C -1.566770 2.457637 -1.673702
C 4.585371 -0.004027 0.174228
C -4.586550 0.005602 0.174086
C 5.986766 2.045301 0.279591
C -5.988146 -2.043674 0.278024
H 0.625507 0.638128 -1.444454
H -0.626119 -0.637417 -1.443608
H 0.339854 -1.619669 0.638265
H 1.393126 -0.188754 0.849926
H -0.339313 1.622017 0.637206
H -1.392009 0.191000 0.850893
H 2.621354 -2.841099 0.911991
H 3.781353 -2.647079 -0.436360
H -2.620818 2.840973 0.913626
H -3.781402 2.648471 -0.434432
H 4.636859 -1.626685 1.630696
H 3.241373 -0.547239 1.780451
H -4.635890 1.626465 1.632733
H -3.240841 0.545988 1.779762
H 0.994441 -3.307148 -1.216898
H 2.424970 -2.878041 -2.224426
H 0.906647 -1.961074 -2.405612
H -0.995596 3.307928 -1.218127
H -2.427114 2.878358 -2.224063
H -0.908915 1.961450 -2.406463
H 5.234112 -0.519351 -0.582104
H 3.824206 0.553498 -0.402511
H -5.235752 0.522227 -0.580975
H -3.826077 -0.551435 -0.404025
H 5.986493 0.465672 1.646799
H -5.986924 -0.465511 1.646915
H 6.703502 1.707583 -0.510487
H 6.534544 2.697763 0.983270
H 5.217212 2.664341 -0.218466
H -6.535583 -2.696833 0.981324
H -5.218940 -2.662262 -0.221134
H -6.705312 -1.705071 -0.511288


