%chk=000186226.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186226

0 1
N 0.770659 -1.003984 0.009317
C -2.692615 0.155219 -0.003832
C -2.541504 1.602490 -0.017300
C -3.923596 2.206591 -0.023895
C -4.919134 1.001708 -0.013230
C -4.056127 -0.234927 -0.001070
C -1.635069 -0.751865 0.005375
C -0.283824 -0.172130 0.000838
C -0.139346 1.275487 -0.012618
C -1.307684 2.150205 -0.021600
C -4.367182 -1.580226 0.011343
C -1.968925 -2.127451 0.018061
C 1.148710 1.793646 -0.016612
C 2.272941 0.932001 -0.007797
C 2.040019 -0.478109 0.005252
C -3.303344 -2.517274 0.020836
C 3.177277 -1.385744 0.014527
C 3.617390 1.425321 -0.011555
C 4.675960 0.552174 -0.002711
C 4.445243 -0.865887 0.010484
C 2.931685 -2.855721 0.028326
C 6.089755 1.035722 -0.006398
H -4.078609 2.855727 0.855974
H -4.077430 2.839061 -0.916025
H -5.576554 1.022332 -0.899958
H -5.577687 1.038957 0.872116
H -1.139252 3.223034 -0.031547
H -5.395407 -1.929118 0.013938
H -1.166675 -2.866555 0.025527
H 1.309232 2.871744 -0.026598
H -3.550057 -3.579142 0.030636
H 3.771992 2.501247 -0.021542
H 5.312120 -1.524639 0.017285
H 2.333663 -3.160213 -0.846386
H 3.852241 -3.448974 0.032024
H 2.336937 -3.144107 0.910679
H 6.632723 0.681731 0.882045
H 6.633249 0.666755 -0.888385
H 6.165729 2.130713 -0.015622


%chk=000186226-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186226

0 1
N 0.777388 -1.015786 0.009611
C -2.724718 0.171327 -0.003815
C -2.580433 1.606438 -0.017186
C -3.975023 2.231837 -0.023768
C -4.976979 1.013163 -0.013126
C -4.085660 -0.228063 -0.001065
C -1.639296 -0.742244 0.005320
C -0.289656 -0.172522 0.000881
C -0.149003 1.287293 -0.012899
C -1.316133 2.158151 -0.021763
C -4.386528 -1.597908 0.011238
C -1.958581 -2.130370 0.017822
C 1.163655 1.806065 -0.017033
C 2.293245 0.945075 -0.008134
C 2.048100 -0.489246 0.005419
C -3.308365 -2.538479 0.020584
C 3.173872 -1.400847 0.014870
C 3.643362 1.433257 -0.011888
C 4.724246 0.552211 -0.002796
C 4.463263 -0.865963 0.010569
C 2.927578 -2.893543 0.029119
C 6.159179 1.044905 -0.006564
H -4.127146 2.883005 0.856994
H -4.126154 2.866656 -0.916560
H -5.636827 1.027864 -0.900822
H -5.637954 1.044205 0.873303
H -1.155334 3.243270 -0.031884
H -5.422386 -1.956365 0.013744
H -1.143830 -2.860249 0.025068
H 1.316810 2.892866 -0.027215
H -3.541990 -3.609457 0.030182
H 3.814268 2.517382 -0.022031
H 5.321335 -1.551141 0.017655
H 2.333566 -3.202594 -0.849664
H 3.878917 -3.453083 0.033720
H 2.334960 -3.185975 0.914540
H 6.707078 0.686427 0.885783
H 6.707607 0.671254 -0.892350
H 6.211070 2.146981 -0.015958


