%chk=000210982.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210982

0 1
O -1.097523 -0.885268 -2.516558
O -1.038642 -1.003135 2.243858
O 5.206430 1.830765 0.363220
N 3.994374 -0.756086 0.327364
C -1.251810 -1.517547 -0.147922
C -2.744522 -1.883262 -0.133315
C -0.927362 -0.604021 -1.360743
C -0.888051 -0.667112 1.100777
C -0.381510 -2.789220 -0.192418
C -0.377273 0.676462 -0.813286
C -0.348210 0.637698 0.601243
C -3.644795 -0.676115 -0.091842
C 0.058106 1.795249 -1.504706
C 0.123000 1.714197 1.334641
C 1.031192 -2.509289 -0.227169
C 3.403134 0.382482 -0.448943
C 5.486257 -0.602920 0.399714
C 3.647827 -2.080427 -0.298860
C -4.049545 -0.141341 1.140321
C -4.090216 -0.088300 -1.285192
C 0.535038 2.892386 -0.760833
C 0.568079 2.852088 0.633132
C 3.773903 1.697092 0.253427
C 5.801979 0.735493 1.087618
C 2.220178 -2.305832 -0.260917
C -4.897770 0.968358 1.175824
C -4.938398 1.021261 -1.243687
C -5.344917 1.550664 -0.014623
H -2.949010 -2.540065 0.740962
H -2.976937 -2.500241 -1.029116
H -0.665545 -3.396459 -1.086949
H -0.615227 -3.422400 0.699411
H 0.028143 1.825671 -2.594568
H 0.146852 1.680131 2.424923
H 2.296252 0.261762 -0.456548
H 3.739387 0.408747 -1.507141
H 5.977629 -0.637667 -0.596270
H 5.897084 -1.439285 1.004313
H 4.157297 -2.878372 0.302273
H 4.017975 -2.182401 -1.349773
H -3.698362 -0.588154 2.071371
H -3.771057 -0.493725 -2.246045
H 0.877135 3.784649 -1.286780
H 0.937817 3.712339 1.192967
H 3.496804 2.581800 -0.345195
H 3.329197 1.759004 1.262760
H 5.437476 0.753669 2.130239
H 6.877367 0.980881 1.049531
H -5.210743 1.379742 2.134309
H -5.283157 1.473855 -2.172180
H -6.007032 2.413401 0.015381


%chk=000210982-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210982

0 1
O -1.171005 -0.844394 -2.576741
O -1.029216 -0.876385 2.266418
O 5.560631 1.756451 0.480524
N 4.186189 -0.790453 0.299262
C -1.278546 -1.426242 -0.153373
C -2.779337 -1.873007 -0.108737
C -0.984469 -0.520412 -1.375163
C -0.906733 -0.538572 1.060804
C -0.386479 -2.715307 -0.187895
C -0.450969 0.778315 -0.873482
C -0.404910 0.767485 0.545653
C -3.787246 -0.731745 -0.066523
C -0.034816 1.908826 -1.607337
C 0.060406 1.885885 1.267982
C 1.062592 -2.460074 -0.245816
C 3.653516 0.417642 -0.381633
C 5.666881 -0.724544 0.395266
C 3.738537 -2.054419 -0.344609
C -4.232972 -0.203985 1.173528
C -4.305105 -0.178911 -1.267018
C 0.432032 3.031453 -0.887015
C 0.480067 3.019669 0.536226
C 4.092861 1.675713 0.381609
C 6.077125 0.551005 1.149982
C 2.278563 -2.255961 -0.282442
C -5.170046 0.852981 1.213170
C -5.242093 0.878144 -1.229791
C -5.677720 1.398395 0.011096
H -2.894413 -2.514582 0.785578
H -2.952261 -2.499204 -1.004670
H -0.696507 -3.308395 -1.071033
H -0.626581 -3.305526 0.718533
H -0.079030 1.904866 -2.700967
H 0.089992 1.863901 2.361822
H 2.550626 0.359158 -0.399189
H 4.015494 0.481626 -1.439936
H 6.150067 -0.721772 -0.615603
H 6.033640 -1.610817 0.948115
H 4.237525 -2.892605 0.180979
H 4.063201 -2.107714 -1.417454
H -3.844502 -0.625531 2.108516
H -3.973350 -0.582006 -2.231536
H 0.759996 3.927123 -1.425942
H 0.845616 3.905936 1.066357
H 3.782928 2.590644 -0.149778
H 3.647388 1.664280 1.399888
H 5.688686 0.504889 2.190055
H 7.173273 0.669115 1.166038
H -5.507262 1.245523 2.179201
H -5.635699 1.290039 -2.165983
H -6.408268 2.214698 0.041064


