%chk=000220354.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220354

0 1
O -0.394635 -2.946464 -1.205104
O -4.220398 -0.357714 0.577600
N 0.462648 -0.866363 2.367122
C 1.044461 0.932596 -1.165913
C 2.037233 -0.199911 -0.749915
C 2.431398 -0.186355 0.762946
C 1.597779 2.293112 -0.671694
C 2.912449 1.225607 1.185740
C 1.882793 2.298980 0.830806
C 1.527729 -1.573978 -1.198488
C -0.360446 0.643377 -0.657629
C 0.960313 0.996865 -2.708420
C 3.570778 -1.195085 1.018075
C -0.827033 -0.689632 -0.613550
C 0.048814 -1.833354 -1.011435
C 1.308953 -0.569480 1.639913
C -1.234553 1.670508 -0.288212
C -2.121240 -0.983893 -0.192093
C -2.538993 1.403584 0.144040
C -2.970375 0.074993 0.191459
C -5.152295 0.633629 1.071208
H 2.992810 -0.002641 -1.304733
H 0.887075 3.104254 -0.924615
H 2.524875 2.533729 -1.227833
H 3.878142 1.447772 0.692390
H 3.120907 1.242900 2.273239
H 0.944883 2.129512 1.399595
H 2.250658 3.294456 1.144417
H 2.089406 -2.388188 -0.685327
H 1.759904 -1.726780 -2.275804
H 0.521884 0.085440 -3.130675
H 0.321621 1.827211 -3.032191
H 1.942382 1.136599 -3.168909
H 3.864859 -1.213632 2.074819
H 3.271735 -2.218810 0.751533
H 4.464425 -0.951856 0.434026
H -0.904720 2.710193 -0.333348
H -2.479453 -2.016815 -0.152085
H -3.189102 2.222538 0.434384
H -5.402225 1.347326 0.281672
H -4.748935 1.127369 1.960013
H -6.020612 0.012402 1.329176


%chk=000220354-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220354

0 1
O -0.366540 -3.064517 -0.933009
O -4.345176 -0.391724 0.544357
N 0.597615 -0.885978 2.534095
C 1.044688 0.946376 -1.142094
C 2.045059 -0.202670 -0.747920
C 2.492016 -0.204515 0.770708
C 1.611736 2.306922 -0.640545
C 2.992348 1.224094 1.172515
C 1.958458 2.321224 0.860578
C 1.517495 -1.570514 -1.239090
C -0.369775 0.632203 -0.613004
C 0.952834 1.038638 -2.700557
C 3.660542 -1.215620 0.991546
C -0.840976 -0.720377 -0.569498
C 0.055275 -1.871183 -0.900181
C 1.402948 -0.583173 1.706526
C -1.283236 1.646505 -0.250790
C -2.165285 -1.018436 -0.181363
C -2.609122 1.359755 0.144244
C -3.055525 0.014393 0.176047
C -5.290903 0.647021 0.958977
H 2.989406 0.010417 -1.294705
H 0.913556 3.127194 -0.890809
H 2.536365 2.514377 -1.219400
H 3.926541 1.419366 0.606282
H 3.255878 1.223552 2.246627
H 1.048379 2.163436 1.470769
H 2.368590 3.309159 1.144034
H 2.123776 -2.417504 -0.875190
H 1.593833 -1.612631 -2.344046
H 0.460926 0.158304 -3.147708
H 0.356955 1.924976 -2.985534
H 1.960032 1.144669 -3.148330
H 4.070436 -1.104253 2.010874
H 3.338740 -2.263177 0.874349
H 4.470690 -1.011841 0.267193
H -0.971233 2.695392 -0.266556
H -2.488101 -2.063171 -0.146373
H -3.273948 2.182601 0.424344
H -5.490303 1.363979 0.138216
H -4.923652 1.193164 1.849751
H -6.215442 0.107569 1.210868


