%chk=000198998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198998

0 1
N -0.143493 0.025534 0.422076
N 2.672875 0.130809 1.176186
N 4.343606 -1.142206 0.022697
N 4.296020 1.303394 -0.140176
C 0.677835 1.255498 0.153803
C 0.725696 -1.196309 0.317336
C -1.304726 -0.061330 -0.540594
C 1.811633 1.349120 1.193960
C 1.859592 -1.106907 1.357757
C -2.197759 1.165269 -0.412721
C -2.149665 -1.293958 -0.248887
C 3.767542 0.093959 0.303281
C -2.678373 1.782858 -1.576789
C -2.602535 -2.078947 -1.319480
C -2.565490 1.670824 0.842961
C -2.500995 -1.642236 1.063684
C -3.519201 2.895769 -1.482664
C -3.399608 -3.201438 -1.076396
C -3.403761 2.784582 0.931874
C -3.295438 -2.766188 1.301712
C -3.882683 3.399051 -0.230016
C -3.746736 -3.547718 0.232858
C 5.458409 1.251931 -0.829831
C 5.504900 -1.137639 -0.670679
C 6.113594 0.044862 -1.119394
H 0.021513 2.148753 0.253974
H 1.101556 1.281867 -0.873231
H 1.152791 -1.342308 -0.698210
H 0.104330 -2.093188 0.536869
H -0.926874 -0.124529 -1.600240
H 2.422094 2.264223 1.017995
H 1.388781 1.429958 2.222100
H 1.437567 -1.066942 2.388624
H 2.505603 -2.012847 1.303185
H -2.405270 1.397460 -2.556915
H -2.341851 -1.816739 -2.342732
H -2.187686 1.191002 1.747220
H -2.144798 -1.032168 1.895302
H -3.892126 3.370257 -2.388647
H -3.751225 -3.806232 -1.910432
H -3.686714 3.173214 1.908657
H -3.565750 -3.032395 2.322133
H -4.537439 4.264936 -0.158822
H -4.367435 -4.421379 0.419925
H 5.861976 2.217794 -1.160667
H 5.946440 -2.122459 -0.871622
H 7.045782 0.026341 -1.669624


%chk=000198998-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198998

0 1
N -0.199521 -0.022717 0.087100
N 2.647666 0.080763 0.528112
N 4.652817 -1.110925 0.153999
N 4.585202 1.343026 0.044198
C 0.581436 1.200262 -0.249890
C 0.654293 -1.224431 -0.135448
C -1.494919 -0.101733 -0.656581
C 1.833854 1.305139 0.640440
C 1.906591 -1.172486 0.758306
C -2.343406 1.163263 -0.440671
C -2.309387 -1.338708 -0.239684
C 3.993391 0.105014 0.235466
C -2.958324 1.802406 -1.543432
C -3.062564 -2.042568 -1.209722
C -2.561282 1.684140 0.860469
C -2.373737 -1.758779 1.113068
C -3.782421 2.936273 -1.355093
C -3.873736 -3.139381 -0.839514
C -3.377275 2.819075 1.051719
C -3.177623 -2.857427 1.485568
C -3.995355 3.448472 -0.055511
C -3.935153 -3.550395 0.511512
C 5.913064 1.338647 -0.238796
C 5.978981 -1.059197 -0.131918
C 6.679353 0.152950 -0.340441
H -0.047412 2.090666 -0.086019
H 0.895073 1.193842 -1.324428
H 0.971006 -1.297732 -1.206565
H 0.076626 -2.131161 0.109065
H -1.304379 -0.185404 -1.758799
H 2.458735 2.162354 0.348062
H 1.515053 1.434772 1.695218
H 1.592744 -1.220159 1.821392
H 2.580935 -2.015640 0.546170
H -2.790448 1.413909 -2.555919
H -3.017854 -1.728847 -2.260444
H -2.074609 1.201307 1.714851
H -1.774852 -1.226636 1.860693
H -4.251449 3.420104 -2.219374
H -4.451857 -3.673041 -1.602459
H -3.534412 3.212773 2.062522
H -3.215401 -3.173723 2.534388
H -4.631706 4.328030 0.093638
H -4.561624 -4.401522 0.801290
H 6.369818 2.324420 -0.387935
H 6.489196 -2.027921 -0.194268
H 7.747374 0.172127 -0.566936


