%chk=000231917.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231917

0 1
N 6.284641 0.448656 -0.082676
C 0.008996 -0.411688 0.005810
C -1.256428 0.456586 -0.004298
C 1.279418 0.449193 0.001025
C -2.527206 -0.403840 0.000565
C 2.545094 -0.418846 0.011526
C -3.792681 0.464374 -0.009299
C -5.063253 -0.395982 -0.004392
C 3.812832 0.443975 0.005747
C -6.329992 0.471340 -0.013995
C 5.077160 -0.430372 0.018153
C -7.597880 -0.379910 -0.009277
C 7.544352 -0.337380 0.036137
H 0.008619 -1.086749 -0.871735
H 0.004767 -1.072285 0.894099
H -1.256325 1.132468 0.872482
H -1.252589 1.116727 -0.893118
H 1.283755 1.108816 -0.888475
H 1.278993 1.125942 0.877106
H -2.527792 -1.079147 -0.876722
H -2.531287 -1.064390 0.888929
H 2.540216 -1.079729 0.899628
H 2.544506 -1.092787 -0.867353
H -3.792228 1.139946 0.867717
H -3.788786 1.124643 -0.897946
H -5.068583 -1.057035 0.883403
H -5.065325 -1.071705 -0.881129
H 3.810191 1.128872 0.874732
H 3.827035 1.097808 -0.890482
H -6.326899 1.131802 -0.903138
H -6.330227 1.146628 0.863916
H 5.084114 -1.083143 0.917168
H 5.078658 -1.106317 -0.865944
H -7.651304 -1.019396 0.879081
H -8.496094 0.247480 -0.016455
H -7.647752 -1.034355 -0.886913
H 6.259609 1.151840 0.664360
H 7.613624 -1.048251 -0.803912
H 7.655827 -0.902940 0.972798
H 8.398624 0.353151 -0.057327


%chk=000231917-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231917

0 1
N 6.379709 0.427896 0.006509
C 0.016047 -0.409657 0.008676
C -1.270909 0.445631 -0.013532
C 1.311274 0.433047 -0.008479
C -2.566865 -0.396092 0.004045
C 2.598385 -0.421937 0.017480
C -3.853802 0.459506 -0.017909
C -5.150050 -0.381829 0.001438
C 3.889398 0.426369 -0.005692
C -6.437078 0.474492 -0.022643
C 5.172903 -0.425430 0.023406
C -7.726788 -0.374753 -0.001092
C 7.654986 -0.311815 0.018360
H 0.014386 -1.096422 -0.863689
H 0.010948 -1.055598 0.911791
H -1.268956 1.132756 0.858622
H -1.265881 1.091360 -0.916703
H 1.317868 1.077042 -0.912569
H 1.311375 1.121426 0.862715
H -2.569150 -1.083156 -0.868113
H -2.571942 -1.041908 0.907214
H 2.592349 -1.064371 0.923031
H 2.596473 -1.111153 -0.852809
H -3.851004 1.147493 0.853601
H -3.849403 1.104409 -0.921766
H -5.156783 -1.025685 0.906038
H -5.153892 -1.070795 -0.869280
H 3.887275 1.115585 0.866448
H 3.910775 1.063488 -0.911064
H -6.429796 1.116125 -0.927514
H -6.431675 1.163672 0.846540
H 5.140527 -1.111750 0.910783
H 5.203252 -1.075974 -0.874302
H -7.772616 -1.001101 0.909964
H -8.631977 0.259846 -0.021311
H -7.768607 -1.052283 -0.874938
H 6.340554 1.140588 0.748090
H 7.743723 -0.908414 -0.908999
H 7.773850 -1.016471 0.879646
H 8.499518 0.399862 0.037803


