%chk=000038619.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038619

0 1
 N   -1.435100       3.793900     -0.1305000    
 C  -0.8301000       1.387100     -0.3324000    
 C   0.3685000       1.591400      0.6280000    
 C   -1.399200     -2.4100000E-02 -0.2433000    
 C   -1.944900       2.426700     -8.1500001E-02
 C    1.509700      0.6320000      0.3775000    
 C  -0.8891000      -1.000100      -1.073000    
 C   -2.405100     -0.2791000      0.6645000    
 C    1.531300     -0.5826000       1.042500    
 C    2.510100      0.9869000     -0.5119000    
 C   -1.409600      -2.291700     -0.9913000    
 C   -2.925500      -1.570700      0.7463000    
 C   -2.427700      -2.576900     -8.1699997E-02
 C    2.584100      -1.468000      0.8114000    
 C    3.562800      0.1014000     -0.7430000    
 C    3.599800      -1.126100     -8.1299998E-02
 H  -0.4751000       1.542500      -1.362400    
 H   0.7596000       2.613600      0.5483000    
 H   3.6699999E-02   1.487700       1.670500    
 H   -2.748800       2.311800     -0.8183000    
 H   -2.385900       2.331400      0.9134000    
 H  -0.1040000     -0.7881000      -1.792300    
 H   -2.801000      0.4510000       1.358100    
 H   0.7530000     -0.8566000       1.748800    
 H    2.488000       1.939200      -1.033700    
 H   -2.209600       4.448100     -2.6200000E-02
 H   -1.030100       3.974200      -1.048300    
 H   -1.023000      -3.074700      -1.637000    
 H   -3.712000      -1.796200       1.460800    
 H   -2.831600      -3.583000     -1.6700000E-02
 H    2.613800      -2.422800       1.328100    
 H    4.353200      0.3672000      -1.438800    
 H    4.419500      -1.815500     -0.2612000    


%chk=000038619-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038619

0 1
N -1.170340 3.714828 -0.582196
C -0.809974 1.254052 -0.316759
C 0.275092 1.435573 0.796993
C -1.515016 -0.098202 -0.234697
C -1.829953 2.432002 -0.270931
C 1.544198 0.641716 0.532791
C -1.334681 -1.076039 -1.244691
C -2.369135 -0.412141 0.856977
C 1.731692 -0.659570 1.066502
C 2.566795 1.185602 -0.289516
C -1.985591 -2.329364 -1.173420
C -3.023556 -1.661054 0.933049
C -2.835349 -2.626674 -0.083982
C 2.905039 -1.397105 0.787650
C 3.741020 0.452454 -0.572386
C 3.914745 -0.844298 -0.033654
H -0.289737 1.310372 -1.295911
H 0.498451 2.518846 0.832565
H -0.165096 1.145073 1.770496
H -2.678442 2.185715 -0.951153
H -2.252274 2.509156 0.749495
H -0.670776 -0.855955 -2.089759
H -2.524393 0.322279 1.657628
H 0.949461 -1.097534 1.698510
H 2.441237 2.196104 -0.699413
H -1.658681 4.546575 -0.240931
H -0.883294 3.810793 -1.561095
H -1.826789 -3.071530 -1.964242
H -3.679764 -1.882411 1.782904
H -3.342136 -3.596597 -0.025867
H 3.031528 -2.400694 1.210317
H 4.522203 0.891986 -1.203794
H 4.826214 -1.414060 -0.248083


