%chk=000064466.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064466

0 1
 N  -7.3399998E-02 -0.4690000      0.2096000    
 N   -2.031900      0.9107000      0.2773000    
 N   0.1302000       1.864600     -2.0300001E-02
 N   -1.076300       4.028800     -0.3752000    
 N   -3.921500      -2.150600     -0.5433000    
 C    1.387400     -0.4704000      0.1136000    
 C    3.519300      0.3584000       1.164900    
 C    3.434500      -1.935500      0.1145000    
 C    3.353900      0.1236000      -1.342500    
 C    1.983200      0.3659000       1.259400    
 C    1.898900      -1.918200      0.2137000    
 C    1.818600      0.1312000      -1.235300    
 C    4.024300      -1.092600       1.259600    
 C    3.944800      0.9540000     -0.1891000    
 C    3.860600      -1.325600      -1.232900    
 C  -0.6720000      0.6758000      0.1428000    
 C   -3.118600      1.9900000E-02  0.1298000    
 C  -0.5218000       3.022800     -0.2110000    
 C   -4.401300      0.4019000      0.4903000    
 C   -2.926700      -1.250500     -0.3767000    
 C   -5.451000     -0.4963000      0.3337000    
 C   -5.161100      -1.749000     -0.1829000    
 H    3.947100      0.9474000       1.984000    
 H    3.799200      -2.966100      0.1869000    
 H    3.663500      0.5463000      -2.305000    
 H    1.676400       1.388200       1.469100    
 H    1.706900     -0.1362000       2.200800    
 H    1.578800      -2.372500       1.160400    
 H    1.463900      -2.534200     -0.5841000    
 H    1.426400     -0.5302000      -2.024700    
 H    1.476300       1.103400      -1.582300    
 H    3.742800      -1.526200       2.227000    
 H    5.120000      -1.110600       1.210300    
 H    5.039100      0.9716000     -0.2630000    
 H    3.603000       1.993500     -0.2639000    
 H    3.461400      -1.926900      -2.058900    
 H    4.953600      -1.347100      -1.323700    
 H   -2.336000       1.841100      0.5492000    
 H    1.131000       1.909800     -8.2099997E-02
 H   -4.599800       1.391100      0.8934000    
 H   -1.967300      -1.623200     -0.7119000    
 H   -6.464100     -0.2247000      0.6073000    
 H   -5.944600      -2.486100     -0.3246000    


%chk=000064466-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000064466

0 1
N -0.056921 -0.068162 0.156393
N -2.154796 1.043840 0.173286
N -0.216727 2.379286 0.093096
N -1.640954 4.487565 -0.077333
N -3.620464 -2.420796 0.070516
C 1.419006 -0.210183 0.068397
C 3.701792 0.178368 1.152752
C 3.215464 -2.040351 0.034741
C 3.511146 0.042047 -1.375817
C 2.177560 0.462371 1.259136
C 1.698347 -1.742678 0.133938
C 1.986318 0.326024 -1.285758
C 3.952229 -1.352081 1.214353
C 4.238713 0.738352 -0.193264
C 3.760351 -1.488881 -1.309963
C -0.755962 1.018004 0.140946
C -3.067221 -0.036936 0.140138
C -0.949036 3.506982 0.002421
C -4.454244 0.281291 0.135754
C -2.699283 -1.414755 0.110182
C -5.401920 -0.757850 0.098017
C -4.945239 -2.096464 0.063933
H 4.219402 0.675595 1.996635
H 3.375504 -3.134917 0.081906
H 3.894684 0.441678 -2.335242
H 2.026843 1.562926 1.280415
H 1.770313 0.070241 2.211150
H 1.280485 -2.135983 1.080518
H 1.147342 -2.232624 -0.691592
H 1.448802 -0.169708 -2.116989
H 1.809339 1.415820 -1.395232
H 3.589245 -1.759014 2.179160
H 5.039529 -1.559008 1.160123
H 5.330232 0.563987 -0.265241
H 4.082586 1.835963 -0.241126
H 3.257317 -1.992312 -2.159337
H 4.844626 -1.699965 -1.398831
H -2.586962 1.972123 0.211955
H 0.798989 2.455241 0.157240
H -4.780978 1.329016 0.158177
H -1.645277 -1.693577 0.120474
H -6.473856 -0.536465 0.092828
H -5.648626 -2.935711 0.031347


