%chk=000017138.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017138

0 1
 N   -1.168700       1.114800      0.5485000    
 C  -0.7881000      0.8766000     -0.8509000    
 C  -0.1255000       1.893200       1.230800    
 C    1.703500      0.7038000     -0.1656000    
 C   0.5434000      0.1101000     -0.9857000    
 C    1.247200       1.190100       1.222300    
 C  -0.8004000       2.231500      -1.585600    
 C  -0.1022000       3.304400      0.6117000    
 C   1.7200001E-02   3.331800     -0.9110000    
 C   -1.540700     -0.1028000       1.261500    
 C    2.885400     -0.2505000     -7.5099997E-02
 C   -2.711700     -0.7349000      0.5700000    
 C    2.957200      -1.165300      0.9718000    
 C    3.887900     -0.2037000      -1.039800    
 C   -4.004600     -0.3874000      0.9471000    
 C   -2.495400      -1.663100     -0.4430000    
 C    4.040300      -2.040200       1.054700    
 C    4.971000      -1.078800     -0.9568000    
 C    5.047100      -1.997000      9.0499997E-02
 C   -5.093900     -0.9751000      0.3038000    
 C   -3.584800      -2.250700      -1.086200    
 C   -4.884000      -1.906700     -0.7129000    
 H   -1.546100      0.3189000      -1.403300    
 H  -0.4148000       2.034900       2.281300    
 H    2.077900       1.583700     -0.6975000    
 H   0.8344000      6.3500002E-02  -2.043500    
 H   0.3997000     -0.9323000     -0.6811000    
 H    1.158800      0.3752000       1.944400    
 H    2.009400       1.862400       1.638700    
 H   -1.841700       2.578600      -1.646400    
 H  -0.4614000       2.107500      -2.621300    
 H   0.7040000       3.901500       1.054300    
 H   -1.038900       3.810900      0.8833000    
 H    1.066500       3.256200      -1.207800    
 H  -0.3105000       4.310000      -1.284500    
 H   -1.827800      0.1377000       2.293600    
 H  -0.7206000     -0.8264000       1.342900    
 H    2.180100      -1.278000       1.718000    
 H    3.838900      0.5047000      -1.862200    
 H   -4.181000      0.3385000       1.736200    
 H   -1.498200      -1.979500     -0.7278000    
 H    4.094500      -2.763600       1.863200    
 H    5.754300      -1.046500      -1.708500    
 H    5.888900      -2.680300      0.1533000    
 H   -6.105500     -0.7073000      0.5944000    
 H   -3.421600      -2.982800      -1.871800    
 H   -5.732100      -2.365700      -1.212400    


%chk=000017138-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017138

0 1
N -1.130344 0.968599 0.467732
C -0.701876 0.849685 -0.959760
C -0.132273 1.771921 1.231890
C 1.811990 0.766493 -0.209112
C 0.684206 0.144234 -1.092362
C 1.279408 1.106577 1.219218
C -0.792297 2.259877 -1.600509
C -0.182701 3.230058 0.699856
C 0.003969 3.348199 -0.835084
C -1.539042 -0.300809 1.108483
C 3.046388 -0.135820 -0.147361
C -2.849381 -0.848208 0.542449
C 2.981315 -1.442047 0.408821
C 4.295564 0.315217 -0.644523
C -3.916770 0.028587 0.221028
C -3.034704 -2.241634 0.368984
C 4.125159 -2.267175 0.465212
C 5.445517 -0.506300 -0.591414
C 5.364717 -1.802709 -0.035277
C -5.145245 -0.478810 -0.255070
C -4.264923 -2.754272 -0.105322
C -5.325440 -1.873644 -0.418186
H -1.447780 0.210310 -1.470414
H -0.472509 1.799333 2.287406
H 2.133898 1.710353 -0.685131
H 1.004880 0.144762 -2.152570
H 0.558868 -0.921022 -0.813227
H 1.222519 0.170607 1.810700
H 2.010984 1.755820 1.739281
H -1.864022 2.538446 -1.607124
H -0.458773 2.213439 -2.655881
H 0.573332 3.845315 1.226603
H -1.178846 3.632154 0.968483
H 1.076111 3.290137 -1.095795
H -0.331616 4.349973 -1.167358
H -1.677581 -0.080328 2.187494
H -0.766806 -1.108543 1.056525
H 2.028953 -1.820427 0.801953
H 4.366696 1.321132 -1.077954
H -3.754287 1.105880 0.338903
H -2.212231 -2.929824 0.603836
H 4.053022 -3.271830 0.898034
H 6.400206 -0.135854 -0.982475
H 6.253144 -2.442830 0.008180
H -5.962620 0.209854 -0.499269
H -4.392630 -3.835140 -0.235810
H -6.278751 -2.267838 -0.788483


