%chk=000077836.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077836

0 1
 N    2.755800     -0.5583000      0.5188000    
 N   -2.762300     -0.5938000     -0.4938000    
 C    3.541600      0.6557000      0.6337000    
 C   -3.540200      0.6189000     -0.6626000    
 C    4.828100      0.3773000       1.417400    
 C    3.842100       1.221600     -0.7578000    
 C   -4.828900      0.3142000      -1.433100    
 C   -3.836600       1.248100      0.7023000    
 C    5.829300     -0.4682000      0.6301000    
 C    4.846600      0.3730000      -1.537400    
 C   -5.835200     -0.4891000     -0.6088000    
 C   -4.846400      0.4416000       1.519000    
 C    6.124500      0.1368000     -0.7386000    
 C   -6.126000      0.1782000      0.7316000    
 C    1.395900     -0.5671000      0.2692000    
 C   -1.375200     -0.5848000     -0.2395000    
 C   0.6854000      -1.779200      0.1663000    
 C  -0.6865000      -1.788100     -8.5600004E-02
 C   0.6800000      0.6360000      0.1103000    
 C  -0.6919000      0.6271000     -0.1415000    
 H    2.994200       1.400800       1.223600    
 H   -2.990500       1.333100      -1.287300    
 H    4.596900     -0.1245000       2.365000    
 H    5.302700       1.333500       1.673200    
 H    4.259400       2.230300     -0.6402000    
 H    2.935600       1.333800      -1.361400    
 H   -4.601200     -0.2309000      -2.357400    
 H   -5.297500       1.261000      -1.731300    
 H   -4.247600       2.253200      0.5399000    
 H   -2.930000       1.381300       1.301500    
 H    5.447200      -1.488200      0.5055000    
 H    6.761600     -0.5520000       1.200300    
 H    5.092500      0.8723000      -2.481500    
 H    4.393700     -0.5912000      -1.798200    
 H   -5.459100      -1.504600     -0.4390000    
 H   -6.768300     -0.5925000      -1.174700    
 H   -5.088800      0.9842000       2.439900    
 H   -4.399600     -0.5129000       1.822600    
 H    6.654700       1.088500     -0.6097000    
 H    6.792700     -0.5268000      -1.299000    
 H   -6.650200       1.126600      0.5605000    
 H   -6.798100     -0.4555000       1.321100    
 H    3.227300      -1.454300      0.5677000    
 H   -3.228200      -1.494000     -0.4933000    
 H    1.206400      -2.727100      0.2836000    
 H   -1.207600      -2.739200     -0.1596000    
 H    1.156400       1.609200      0.1782000    
 H   -1.173100       1.592600     -0.2543000    


%chk=000077836-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077836

0 1
N 2.783887 -0.505340 0.498791
N -2.815732 -0.522262 -0.586931
C 3.644084 0.675815 0.650504
C -3.687724 0.651696 -0.728447
C 4.918234 0.296670 1.449868
C 4.042801 1.313430 -0.716588
C -5.012126 0.234678 -1.420592
C -3.994366 1.346719 0.634878
C 5.884742 -0.608785 0.644986
C 4.994716 0.400922 -1.524315
C -5.914556 -0.639254 -0.513193
C -4.880951 0.466217 1.545167
C 6.260235 0.039791 -0.709298
C -6.197035 0.063894 0.836587
C 1.408106 -0.469160 0.213743
C -1.437627 -0.476750 -0.314944
C 0.672579 -1.687655 0.112741
C -0.708839 -1.691146 -0.141525
C 0.685194 0.742933 0.033158
C -0.705270 0.739399 -0.219700
H 3.084665 1.434734 1.239446
H -3.174508 1.385796 -1.386896
H 4.626407 -0.187951 2.402001
H 5.450078 1.232592 1.711944
H 4.538407 2.287065 -0.518126
H 3.130454 1.525239 -1.305128
H -4.783386 -0.289095 -2.369245
H -5.566040 1.157135 -1.684121
H -4.509285 2.308677 0.429432
H -3.045712 1.587943 1.149585
H 5.423387 -1.601277 0.456989
H 6.795164 -0.802329 1.244793
H 5.278319 0.897130 -2.472562
H 4.454503 -0.527613 -1.798461
H -5.435823 -1.622148 -0.318843
H -6.863985 -0.859077 -1.038833
H -5.103202 1.002788 2.487830
H -4.316803 -0.446707 1.823490
H 6.847029 0.962670 -0.518029
H 6.912435 -0.640069 -1.291359
H -6.803381 0.974885 0.649099
H -6.801463 -0.593815 1.491231
H 3.207661 -1.421008 0.638907
H -3.249018 -1.442200 -0.648166
H 1.194889 -2.645063 0.242720
H -1.237500 -2.651454 -0.210445
H 1.200311 1.707028 0.093851
H -1.212356 1.700907 -0.350294


