%chk=000264677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264677

0 1
O -0.180935 -4.467069 0.956292
O -6.170739 1.251449 0.651323
O 2.312482 2.707865 -1.042688
N -0.313772 -2.145244 -0.708195
N -3.731493 1.158067 -0.833376
N -2.110083 -0.575039 -0.560445
N -1.608252 1.731672 0.094820
N 0.139227 0.022894 0.188387
N 0.512029 2.243914 1.043164
N 1.887468 1.943060 1.087809
C -1.295058 -3.258214 -0.861252
C 0.985013 -2.628564 -0.157441
C -4.288169 2.455644 -0.352717
C -4.795572 0.134505 -1.039188
C -1.461322 -4.018374 0.464196
C 0.763367 -3.394640 1.155844
C -5.148978 2.239834 0.901518
C -5.641932 -0.023945 0.234198
C -0.782849 -0.884380 -0.321060
C -2.472632 0.753739 -0.392124
C -0.336694 1.303087 0.379012
C 2.660919 1.999022 -0.125250
C 3.923227 1.203199 -0.055718
C 5.162925 1.852339 -0.082606
C 3.847679 -0.195799 -0.004488
C 6.336776 1.092985 -0.045178
C 5.024379 -0.946971 0.026168
C 6.267389 -0.302717 0.009236
H -0.898171 -3.934245 -1.653396
H -2.274069 -2.871750 -1.227315
H 1.698855 -1.776222 -0.014725
H 1.433408 -3.297272 -0.928407
H -4.902507 2.873021 -1.183527
H -3.471107 3.189175 -0.155171
H -4.353813 -0.839382 -1.351190
H -5.427683 0.489717 -1.885931
H -2.007850 -4.970161 0.336982
H -1.950604 -3.401008 1.237747
H 0.400741 -2.735973 1.964571
H 1.666835 -3.937843 1.485763
H -5.746437 3.132991 1.158909
H -4.544711 1.925894 1.770672
H -5.063503 -0.466322 1.063951
H -6.560712 -0.611265 0.056697
H 0.344408 3.231689 0.768135
H 2.067499 1.151439 1.729064
H 5.209719 2.941020 -0.137697
H 2.867808 -0.695718 -0.003240
H 7.305462 1.591258 -0.063511
H 4.976868 -2.034118 0.060317
H 7.184166 -0.891643 0.035060


%chk=000264677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264677

0 1
O -0.583528 -5.266865 0.824329
O -6.424630 1.917135 0.399366
O 2.819676 3.439449 0.084199
N -0.872978 -2.622667 -0.252561
N -3.867695 1.000651 -0.520364
N -2.398032 -0.837438 -0.394254
N -1.568701 1.457582 -0.322127
N -0.005222 -0.427737 -0.188036
N 0.732615 1.779419 -0.145850
N 2.034705 1.283556 -0.068252
C -1.961477 -3.606636 -0.412704
C 0.471028 -3.211744 -0.104534
C -4.182769 2.442931 -0.547271
C -5.040599 0.111425 -0.612003
C -1.910355 -4.628081 0.739582
C 0.455595 -4.245415 1.040956
C -5.222597 2.759934 0.545461
C -6.059033 0.491713 0.482142
C -1.099500 -1.263157 -0.279347
C -2.579742 0.527003 -0.409222
C -0.324323 0.908961 -0.220280
C 3.074210 2.186068 0.034729
C 4.458186 1.617081 0.090897
C 5.499635 2.491731 0.493929
C 4.772417 0.275548 -0.255432
C 6.829996 2.030455 0.567833
C 6.104764 -0.183785 -0.182030
C 7.136779 0.690236 0.233970
H -1.831432 -4.137112 -1.378276
H -2.918149 -3.062038 -0.428394
H 1.188211 -2.401971 0.099668
H 0.757926 -3.715517 -1.050415
H -4.602466 2.702936 -1.540249
H -3.248817 3.005238 -0.392875
H -4.697356 -0.928637 -0.499068
H -5.510940 0.231279 -1.609242
H -2.621481 -5.452903 0.569259
H -2.146382 -4.124788 1.702094
H 0.279585 -3.729027 2.009536
H 1.407417 -4.799881 1.085346
H -5.581826 3.798473 0.460092
H -4.773474 2.602435 1.549915
H -5.632538 0.270570 1.484733
H -7.004090 -0.060949 0.352243
H 0.650176 2.799256 -0.143228
H 2.064461 0.258995 -0.054652
H 5.237041 3.526425 0.736957
H 3.997039 -0.411598 -0.615564
H 7.626792 2.712996 0.882687
H 6.340356 -1.217442 -0.458111
H 8.170526 0.331502 0.288415


