%chk=000181317.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181317

0 1
N -1.259273 -0.280446 -0.002495
N -5.150158 1.372372 -0.001656
C 5.034181 0.420488 -0.003694
C 3.749021 -0.418183 0.001510
C 6.283838 -0.470220 0.003163
C 2.500177 0.473616 -0.001585
C 7.569595 0.367596 -0.003220
C 1.216294 -0.366549 -0.000769
C 8.819028 -0.523049 0.003242
C -0.023002 0.539503 -0.004708
C 10.106119 0.313772 0.005854
C -2.527346 0.277135 -0.002106
C -3.682957 -0.608115 0.001018
C 11.353052 -0.567699 0.004858
C -4.969950 -0.005933 0.001091
C -2.734239 1.655572 -0.004816
C -6.151618 -0.844494 0.004144
C -4.064565 2.159865 -0.004485
C -3.583124 -2.031105 0.003977
C -6.003174 -2.212457 0.006937
C -4.712051 -2.810993 0.006855
C -7.499182 -0.205649 0.004312
C -4.291999 3.639050 -0.007473
H 5.048831 1.094477 0.874630
H 5.049626 1.082058 -0.891413
H 3.737446 -1.081744 0.887956
H 3.736051 -1.090257 -0.878441
H 6.270865 -1.131242 0.891193
H 6.270987 -1.144761 -0.874672
H 2.515635 1.142890 0.881094
H 2.517073 1.139093 -0.887039
H 7.583910 1.042080 0.874558
H 7.583888 1.028629 -0.891242
H 1.206062 -1.035510 -0.884484
H 1.204105 -1.030619 0.886627
H 8.804137 -1.189501 0.886953
H 8.809976 -1.193450 -0.877587
H -0.018333 1.200406 -0.903504
H -0.019238 1.206940 0.889247
H 10.121601 0.983581 -0.876173
H 10.120264 0.979693 0.890864
H -1.152461 -1.288698 -0.000287
H 11.388151 -1.218877 0.885682
H 12.266191 0.038005 0.008543
H 11.391159 -1.212633 -0.880422
H -1.912239 2.358391 -0.007259
H -2.598941 -2.496625 0.003927
H -6.875791 -2.864260 0.009271
H -4.641884 -3.896602 0.009118
H -7.617980 0.451486 0.881497
H -7.618551 0.450992 -0.873187
H -8.320829 -0.928355 0.004757
H -3.850405 4.105652 -0.898171
H -5.365903 3.887948 -0.005511
H -3.846068 4.110037 0.878723


%chk=000181317-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181317

0 1
N -1.290020 -0.260198 0.002627
N -5.236248 1.370989 -0.005377
C 5.072295 0.422703 0.002014
C 3.761501 -0.395709 0.001916
C 6.341806 -0.458388 0.001401
C 2.493228 0.486841 0.001787
C 7.653781 0.358506 0.001821
C 1.185880 -0.335889 0.002472
C 8.923320 -0.522703 0.000640
C -0.070568 0.555880 0.000838
C 10.235966 0.294066 0.001352
C -2.571429 0.262079 0.000338
C -3.730391 -0.622693 0.002760
C 11.498524 -0.594896 -0.000178
C -5.039619 -0.007679 -0.000401
C -2.805097 1.653451 -0.004441
C -6.220184 -0.840808 0.001703
C -4.139541 2.161959 -0.007182
C -3.627756 -2.048344 0.008215
C -6.068215 -2.234747 0.006990
C -4.778266 -2.842248 0.010317
C -7.588061 -0.193411 -0.001693
C -4.372307 3.661141 -0.012604
H 5.089045 1.088357 0.890323
H 5.088737 1.089095 -0.885749
H 3.745965 -1.061289 0.890187
H 3.746075 -1.061266 -0.886372
H 6.325839 -1.125206 0.888933
H 6.325715 -1.124087 -0.886968
H 2.510443 1.151734 0.890033
H 2.510093 1.150877 -0.887112
H 7.670844 1.023964 0.890419
H 7.670361 1.025654 -0.885518
H 1.168541 -0.996822 -0.888640
H 1.168043 -0.994457 0.895332
H 8.908521 -1.190152 0.887821
H 8.908242 -1.188141 -0.888042
H -0.055653 1.216584 -0.892739
H -0.055533 1.220258 0.891682
H 10.249865 0.960815 -0.885080
H 10.250360 0.958488 0.889521
H -1.170978 -1.271486 0.005411
H 11.522641 -1.249514 0.891577
H 12.422823 0.011729 0.000704
H 11.522487 -1.246692 -0.893997
H -1.972294 2.361787 -0.006275
H -2.650888 -2.548421 0.011066
H -6.961925 -2.870050 0.008649
H -4.692394 -3.934481 0.014556
H -7.713636 0.463994 0.876951
H -7.711470 0.459338 -0.884080
H -8.387534 -0.954793 -0.000594
H -3.920619 4.133854 -0.905431
H -5.454437 3.863257 -0.012977
H -3.919874 4.140472 0.876296


