%chk=000223621.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223621

0 1
N -2.779168 0.115152 0.362135
N 7.445582 -0.351165 -1.437706
C -0.822703 -0.224245 1.888008
C -2.260212 -0.652708 1.542708
C 0.169584 -0.598342 0.779919
C 1.598030 -0.162967 1.130328
C 2.584059 -0.534738 0.014486
C -3.077753 1.539689 0.725658
C -3.983277 -0.559253 -0.227681
C 4.014105 -0.098572 0.360986
C -3.055300 2.399884 -0.550718
C -3.521230 -1.745915 -1.092749
C 4.999398 -0.467156 -0.754757
C 6.432059 -0.027944 -0.399748
C -3.286603 3.873511 -0.231317
C -4.702218 -2.428297 -1.775848
H -0.788807 0.870304 2.064160
H -0.526501 -0.698952 2.842533
H -2.905407 -0.544377 2.441080
H -2.265360 -1.735072 1.280665
H -0.156177 -0.125863 -0.170636
H 0.136930 -1.688298 0.595282
H 1.912866 -0.630443 2.082781
H 1.624780 0.929700 1.306447
H 2.555002 -1.626830 -0.164011
H 2.266133 -0.065998 -0.937043
H -2.287216 1.902355 1.421480
H -4.044346 1.659865 1.257599
H -4.711222 -0.898865 0.538418
H -4.523599 0.170859 -0.870693
H 4.039937 0.993981 0.540499
H 4.329686 -0.568310 1.312884
H -3.819930 2.039611 -1.266864
H -2.082449 2.263974 -1.065405
H -2.964915 -2.475780 -0.472139
H -2.793116 -1.386124 -1.847724
H 4.682665 0.003658 -1.704867
H 4.970808 -1.558614 -0.934801
H 6.464355 1.069844 -0.220661
H 6.755018 -0.503525 0.553002
H -4.254944 4.037738 0.254267
H -2.512172 4.270036 0.435190
H -3.271415 4.480379 -1.144038
H -5.423499 -2.817810 -1.048819
H -5.240627 -1.740092 -2.437487
H -4.367325 -3.273020 -2.388880
H 7.477134 -1.351078 -1.611457
H 7.212154 0.093812 -2.320070


%chk=000223621-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223621

0 1
N -2.852192 0.191598 0.451334
N 7.507889 -0.537386 -1.513593
C -0.845253 -0.165621 1.956932
C -2.313007 -0.530600 1.635466
C 0.146065 -0.611080 0.860652
C 1.594208 -0.141746 1.121356
C 2.595290 -0.620683 0.045573
C -3.249911 1.589995 0.759058
C -3.909219 -0.573175 -0.260622
C 4.039417 -0.127926 0.290315
C -3.151968 2.530304 -0.461969
C -3.342435 -1.664077 -1.195821
C 5.045920 -0.613038 -0.777927
C 6.492549 -0.106456 -0.529041
C -3.597470 3.970551 -0.127245
C -4.457909 -2.467267 -1.899376
H -0.757211 0.930147 2.106666
H -0.571436 -0.633812 2.925618
H -2.949362 -0.353175 2.539788
H -2.363644 -1.616066 1.425521
H -0.212802 -0.220025 -0.111538
H 0.128360 -1.719180 0.780902
H 1.928780 -0.502547 2.117367
H 1.615336 0.967496 1.171341
H 2.587737 -1.730275 0.006754
H 2.253034 -0.273861 -0.951900
H -2.574475 1.974763 1.546714
H -4.286301 1.639916 1.183934
H -4.631993 -1.040217 0.457791
H -4.497758 0.136210 -0.872937
H 4.046002 0.982191 0.322493
H 4.376886 -0.467315 1.292566
H -3.771686 2.135280 -1.290977
H -2.106177 2.521746 -0.823300
H -2.695215 -2.354088 -0.619315
H -2.688099 -1.174420 -1.941858
H 4.713359 -0.275583 -1.782492
H 5.052017 -1.723340 -0.806420
H 6.491423 1.001087 -0.503165
H 6.827935 -0.437934 0.473546
H -4.648621 3.993624 0.218525
H -2.972105 4.405971 0.675353
H -3.518235 4.630400 -1.010226
H -5.101772 -2.987354 -1.164545
H -5.107355 -1.804347 -2.502562
H -4.035175 -3.231048 -2.577076
H 7.662477 -1.551228 -1.528776
H 7.346895 -0.172411 -2.458487


