%chk=000248838.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248838

0 1
N 0.000046 0.042322 0.000000
N 0.746443 -1.993758 -0.972629
N -0.764852 -1.990053 0.966003
N -0.018332 -4.122546 -0.006349
N 1.529096 -4.066481 -1.794226
N -1.565364 -4.058322 1.781612
C 0.752976 0.821315 -1.019196
C -0.746930 0.824849 1.020846
C 2.046205 1.348368 -0.442429
C -2.035741 1.363907 0.445276
C -0.006283 -1.333028 -0.002292
C 2.188197 2.712942 -0.155749
C -2.166480 2.730366 0.162157
C 3.111018 0.468190 -0.199245
C -3.107710 0.493178 0.199638
C 3.392215 3.193834 0.368243
C -3.366399 3.222510 -0.360757
C 4.310144 0.953343 0.327419
C -4.302715 0.989545 -0.325971
C 4.453045 2.316185 0.611127
C -4.434362 2.354240 -0.606135
C 0.718057 -3.374093 -0.911235
C -0.748352 -3.370399 0.900613
H 0.097438 1.646987 -1.383071
H 0.966780 0.180096 -1.912692
H -0.966030 0.183155 1.912705
H -0.084734 1.644280 1.386825
H 1.367351 3.401767 -0.342981
H -1.340033 3.411928 0.351328
H 2.994185 -0.595321 -0.421314
H -2.999728 -0.571837 0.419013
H 3.502478 4.254225 0.587557
H -3.467920 4.284346 -0.577283
H 5.135142 0.268566 0.517214
H -5.133264 0.312054 -0.517698
H 5.388749 2.691935 1.020002
H -5.366864 2.738742 -1.014188
H 1.400790 -5.062874 -1.891891
H 1.936250 -3.571368 -2.573014
H -1.968055 -3.561959 2.561936
H -1.445458 -5.056034 1.876532


%chk=000248838-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248838

0 1
N -0.001044 -0.208017 -0.000092
N 0.747085 -2.230259 -0.959803
N -0.766803 -2.227311 0.952010
N -0.019406 -4.349271 -0.008188
N 1.421559 -4.285271 -1.850016
N -1.459726 -4.279766 1.833941
C 0.716060 0.557818 -1.041833
C -0.712391 0.560194 1.043959
C 1.923165 1.321406 -0.501831
C -1.913160 1.335058 0.505936
C -0.006956 -1.588171 -0.002596
C 2.036486 2.721499 -0.682655
C -2.012170 2.736446 0.685154
C 2.962519 0.630540 0.174065
C -2.960721 0.653737 -0.167023
C 3.169529 3.421811 -0.205838
C -3.139032 3.447465 0.209541
C 4.092616 1.326855 0.654122
C -4.084705 1.360719 -0.645838
C 4.200875 2.726018 0.464537
C -4.178565 2.761155 -0.457941
C 0.692237 -3.598027 -0.910884
C -0.724244 -3.595310 0.897572
H 0.003296 1.263560 -1.509892
H 1.034881 -0.175058 -1.802022
H -1.037149 -0.172569 1.801709
H 0.005916 1.258706 1.514409
H 1.235082 3.264690 -1.199985
H -1.204383 3.272282 1.200215
H 2.878069 -0.453411 0.315602
H -2.887466 -0.431202 -0.307236
H 3.245023 4.505235 -0.353714
H -3.203419 4.531774 0.356160
H 4.890544 0.782337 1.172115
H -4.889067 0.823529 -1.161531
H 5.078850 3.266228 0.836584
H -5.051823 3.309613 -0.829027
H 1.404530 -5.301270 -1.839618
H 1.961365 -3.765192 -2.536094
H -1.994747 -3.757640 2.522208
H -1.451712 -5.295827 1.819517


