%chk=000187795.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187795

0 1
N -1.278486 1.012360 0.050478
C -5.025693 0.769997 0.022695
C -5.097054 -0.658597 -0.025549
C -6.272044 1.613792 0.088770
C -6.423291 -1.370169 -0.096896
C -7.540819 0.868928 -0.341450
C -7.608744 -0.501415 0.338916
C -2.633050 0.636931 0.025875
C -2.685421 -0.796378 -0.018925
C -3.798258 1.422764 0.046816
C -3.940099 -1.428365 -0.043489
C -0.492588 -0.166903 0.008545
C -1.328564 -1.273708 -0.031192
C 0.969751 -0.105318 0.012972
C 1.698813 -0.905239 -0.883522
C 1.653610 0.733230 0.909005
C 3.776437 -0.019255 0.004114
C 3.093020 -0.860663 -0.888507
C 3.048284 0.775211 0.904067
C 5.255299 0.028183 -0.001959
C 5.974354 -0.260720 1.168790
C 5.944730 0.362030 -1.178556
C 7.370785 -0.216579 1.159087
C 7.341149 0.407880 -1.180225
C 8.055967 0.118338 -0.013385
H -6.389928 1.975502 1.133581
H -6.151104 2.524149 -0.532783
H -6.578502 -1.713028 -1.142799
H -6.395726 -2.290597 0.521103
H -8.434676 1.469553 -0.091974
H -7.549342 0.744506 -1.441953
H -8.559774 -1.008343 0.092916
H -7.600421 -0.377823 1.439391
H -3.732118 2.504504 0.082881
H -3.986576 -2.514533 -0.077956
H -0.924419 1.947716 0.044092
H -1.033562 -2.302311 -0.053499
H 1.169584 -1.559327 -1.577099
H 1.096706 1.340150 1.621426
H 3.655212 -1.484950 -1.582607
H 3.575653 1.427973 1.599050
H 5.442148 -0.526336 2.080946
H 5.389327 0.590948 -2.086696
H 7.926338 -0.444445 2.067416
H 7.873530 0.669936 -2.093171
H 9.143563 0.153221 -0.017842


%chk=000187795-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187795

0 1
N -1.308660 0.905596 0.343954
C -5.085731 0.719950 0.263135
C -5.171242 -0.623451 -0.246865
C -6.345186 1.512803 0.615660
C -6.528163 -1.262556 -0.550109
C -7.626467 0.960420 -0.045797
C -7.710101 -0.567419 0.159779
C -2.660468 0.572401 0.212786
C -2.720419 -0.775061 -0.292359
C -3.823757 1.316717 0.486677
C -3.995161 -1.356587 -0.511678
C -0.505151 -0.179643 -0.070849
C -1.359770 -1.223695 -0.462463
C 0.959716 -0.117111 -0.040898
C 1.741770 -1.087007 -0.731503
C 1.659491 0.901489 0.668149
C 3.846118 -0.017881 -0.010565
C 3.145203 -1.039998 -0.712524
C 3.065581 0.950162 0.678925
C 5.334683 0.034425 0.001261
C 6.042406 0.540592 1.127992
C 6.093574 -0.420059 -1.114082
C 7.452226 0.592387 1.138931
C 7.503565 -0.371113 -1.103563
C 8.192016 0.136243 0.023014
H -6.483297 1.489999 1.717911
H -6.201755 2.577646 0.347138
H -6.705259 -1.221016 -1.646006
H -6.499413 -2.337145 -0.285018
H -8.514461 1.462989 0.382781
H -7.618190 1.181879 -1.132138
H -8.666493 -0.963219 -0.231918
H -7.685004 -0.790574 1.245669
H -3.767403 2.341715 0.874237
H -4.072996 -2.381141 -0.896361
H -0.956021 1.821149 0.611457
H -1.042385 -2.208186 -0.802026
H 1.238032 -1.881320 -1.292372
H 1.108020 1.658703 1.238769
H 3.710980 -1.821743 -1.231463
H 3.566148 1.766317 1.211737
H 5.485880 0.865691 2.014430
H 5.575208 -0.784726 -2.008176
H 7.974338 0.978178 2.021859
H 8.065107 -0.719027 -1.977989
H 9.286892 0.175025 0.031369


