%chk=000055850.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055850

0 1
 N    2.945000       1.210300     -0.3274000    
 N   -5.752800      3.4899998E-02  0.2732000    
 C   0.6559000       1.020300      0.7498000    
 C    2.137500      0.5268000      0.7052000    
 C  -8.1299998E-02  0.2437000     -0.3855000    
 C   0.5121000       2.539200      0.6723000    
 C    1.874000     -0.9241000      0.3578000    
 C   0.6386000      -1.080500     -0.2918000    
 C    1.404700       3.144100     -0.3974000    
 C    2.843800       2.672500     -0.2242000    
 C   -1.583000      0.1885000     -0.2110000    
 C    2.691800      -2.019000      0.5970000    
 C    4.357900      0.8222000     -0.2670000    
 C   0.2362000      -2.321300     -0.7657000    
 C   -2.420600      0.6579000      -1.222900    
 C   -2.130600     -0.3317000      0.9620000    
 C    2.279600      -3.273600      0.1440000    
 C    1.064600      -3.422000     -0.5400000    
 C   -3.805300      0.6072000      -1.062000    
 C   -3.515300     -0.3825000       1.122800    
 C   -4.352700      8.6999997E-02  0.1108000    
 H   0.2468000      0.7182000       1.726200    
 H    2.582200      0.6258000       1.703700    
 H   0.1652000      0.6787000      -1.363000    
 H   0.7967000       2.965700       1.643200    
 H  -0.5307000       2.827800      0.5013000    
 H    1.037900       2.876400      -1.395500    
 H    1.365900       4.237500     -0.3305000    
 H    3.443900       3.142300      -1.013400    
 H    3.239500       3.024600      0.7377000    
 H    3.637900      -1.909900       1.116700    
 H    4.940200       1.366200      -1.020000    
 H    4.492800     -0.2371000     -0.5016000    
 H    4.798900       1.023800      0.7158000    
 H  -0.7044000      -2.447000      -1.291400    
 H   -2.008600       1.066400      -2.141800    
 H   -1.501600     -0.7152000       1.760400    
 H    2.909100      -4.142500      0.3156000    
 H   0.7640000      -4.404600     -0.8936000    
 H   -4.447300      0.9761000      -1.857900    
 H   -3.929800     -0.7928000       2.040100    
 H   -6.360400      0.3762000     -0.4596000    
 H   -6.150000     -0.3411000       1.124000    


%chk=000055850-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000055850

0 1
N 2.908581 1.240311 -0.343434
N -5.822226 0.091097 0.213000
C 0.659131 1.062579 0.779500
C 2.140247 0.558942 0.746458
C -0.053406 0.218176 -0.344488
C 0.495517 2.591167 0.686185
C 1.941860 -0.922228 0.426665
C 0.695278 -1.111227 -0.225796
C 1.388254 3.205617 -0.413035
C 2.838289 2.718948 -0.243129
C -1.567386 0.159558 -0.213923
C 2.787748 -2.017738 0.686454
C 4.298589 0.757446 -0.449100
C 0.299985 -2.393079 -0.652747
C -2.410702 0.839913 -1.127254
C -2.192980 -0.549308 0.846581
C 2.389726 -3.311520 0.264359
C 1.157485 -3.495004 -0.407667
C -3.814654 0.826221 -0.996932
C -3.591779 -0.576315 0.993760
C -4.431171 0.115316 0.071424
H 0.230645 0.717949 1.743472
H 2.646038 0.718024 1.734456
H 0.201645 0.669970 -1.325305
H 0.774524 3.042264 1.660833
H -0.570198 2.838742 0.516812
H 1.033445 2.907001 -1.417715
H 1.352879 4.310951 -0.362048
H 3.479974 3.143856 -1.037914
H 3.241625 3.087441 0.739287
H 3.736415 -1.879789 1.219152
H 4.807832 1.287568 -1.273842
H 4.309068 -0.320441 -0.679148
H 4.894731 0.920491 0.486608
H -0.666873 -2.538328 -1.147837
H -1.959504 1.390820 -1.962865
H -1.571300 -1.099861 1.563793
H 3.034640 -4.174878 0.464726
H 0.859461 -4.499803 -0.729363
H -4.438269 1.362613 -1.723263
H -4.044965 -1.136223 1.821892
H -6.421306 0.578418 -0.446087
H -6.258593 -0.420257 0.973874


