%chk=000085850.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085850

0 1
 N  -0.3922000      0.4066000      0.4108000    
 N   0.2886000     -0.3633000     -0.2952000    
 N   -2.814900       2.572600       1.298700    
 N   0.9746000      -3.538900      0.4849000    
 C    3.083900      0.8904000     -0.2527000    
 C    2.725400     -0.6103000     -0.2324000    
 C   -1.502700      0.9864000     -0.3429000    
 C   -2.392400     -0.1352000     -0.9104000    
 C    1.399900     -0.9441000      0.4599000    
 C   -3.036600      -1.048300      0.1426000    
 C    3.156500       1.493400       1.150700    
 C    4.422000       1.091900     -0.9697000    
 C  -0.9007000       1.809500      -1.485100    
 C   -3.936600      -2.089400     -0.5074000    
 C   -2.236400       1.872400      0.5763000    
 C    1.161600      -2.393500      0.4717000    
 H    2.317800       1.432800     -0.8200000    
 H    2.698500     -0.9769000      -1.268500    
 H    3.535600      -1.163600      0.2628000    
 H   -1.829000     -0.7579000      -1.618100    
 H   -3.200200      0.3239000      -1.498100    
 H    1.420800     -0.5983000       1.501200    
 H   -3.636700     -0.4607000      0.8457000    
 H   -2.262700      -1.561300      0.7241000    
 H    3.842400      0.9285000       1.790800    
 H    3.510100       2.529400       1.109600    
 H    2.174000       1.510900       1.631300    
 H    4.671900       2.156200      -1.035800    
 H    4.379800      0.6963000      -1.990000    
 H    5.237000      0.5847000     -0.4419000    
 H  -0.3671000       1.188700      -2.214200    
 H   -1.681400       2.352000      -2.032000    
 H  -0.1900000       2.556000      -1.108700    
 H   -4.746600      -1.612900      -1.068800    
 H   -4.385300      -2.731900      0.2567000    
 H   -3.368400      -2.724700      -1.194300    


%chk=000085850-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085850

0 1
N -0.331045 0.284742 0.272943
N 0.408498 -0.424031 -0.500068
N -2.608268 2.710098 1.168802
N 1.263511 -3.725650 -0.009417
C 3.137618 0.926264 -0.157963
C 2.894611 -0.598814 -0.309462
C -1.484839 0.953688 -0.505529
C -2.515325 -0.153418 -0.912304
C 1.535850 -1.086732 0.272247
C -3.150789 -0.926210 0.263833
C 3.057318 1.399065 1.313362
C 4.510295 1.280424 -0.778204
C -0.958535 1.708893 -1.756013
C -4.128306 -2.010592 -0.236272
C -2.097529 1.916733 0.440359
C 1.381384 -2.545254 0.113809
H 2.354050 1.458837 -0.735970
H 2.937401 -0.880141 -1.378377
H 3.699359 -1.155768 0.209728
H -1.970776 -0.850174 -1.579444
H -3.310085 0.331089 -1.511943
H 1.453697 -0.828779 1.347856
H -3.685068 -0.218937 0.927410
H -2.357277 -1.393549 0.878431
H 3.760164 0.828106 1.950735
H 3.329403 2.467497 1.389507
H 2.040963 1.291141 1.734498
H 4.684758 2.371299 -0.752127
H 4.576998 0.950534 -1.831849
H 5.332096 0.794693 -0.217712
H -0.474732 0.987110 -2.433859
H -1.796977 2.198454 -2.279021
H -0.224843 2.482829 -1.471946
H -4.944560 -1.566215 -0.836815
H -4.588645 -2.550173 0.610488
H -3.609877 -2.755657 -0.868113


