%chk=000220679.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220679

0 1
O -1.070787 0.330107 2.140793
O -0.202984 0.531436 -2.541116
O -2.845715 1.717155 -1.874420
N -2.190886 1.143006 0.289103
C -0.025766 0.123992 -0.109475
C -1.098121 0.503806 0.949316
C -0.656554 0.605114 -1.440288
C 0.227421 -1.376566 -0.153416
C 1.289413 0.826721 0.197593
C -2.049048 1.234937 -1.120305
C -3.418200 1.582463 1.012286
C 0.791179 -1.943001 -1.308313
C 1.739517 0.895421 1.525948
C -0.045933 -2.193944 0.951993
C 2.082446 1.361925 -0.827149
C -4.486314 0.496320 0.997008
C 1.047015 -3.314458 -1.365028
C 2.952019 1.520091 1.825184
C 0.212543 -3.566585 0.889287
C 3.295358 1.986422 -0.521316
C 0.754093 -4.131558 -0.268350
C 3.731557 2.071812 0.803567
H -3.128690 1.838441 2.058859
H -3.792410 2.510730 0.520529
H 1.038490 -1.314631 -2.168165
H 1.146114 0.457546 2.334530
H -0.448031 -1.773511 1.877482
H 1.776598 1.289147 -1.872962
H -4.794026 0.239320 -0.025540
H -4.140484 -0.427094 1.479038
H -5.385346 0.826338 1.532914
H 1.479638 -3.746202 -2.267075
H 3.290766 1.573235 2.859432
H -0.006942 -4.195106 1.751849
H 3.902690 2.404327 -1.323672
H 0.952374 -5.200993 -0.314862
H 4.675507 2.560435 1.038837


%chk=000220679-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220679

0 1
O -0.972719 0.471228 2.165712
O -0.223002 0.235746 -2.615076
O -2.899208 1.475387 -1.984982
N -2.152395 1.102492 0.235277
C 0.009673 0.067668 -0.119940
C -1.043201 0.539933 0.918052
C -0.670625 0.421460 -1.468932
C 0.226089 -1.463381 -0.081316
C 1.324673 0.850306 0.115539
C -2.046857 1.057755 -1.170733
C -3.329621 1.658231 0.936400
C 1.265960 -2.010437 -0.876548
C 2.062453 0.570724 1.295268
C -0.609104 -2.333692 0.661064
C 1.797360 1.843316 -0.777065
C -4.397789 0.580274 1.212363
C 1.470645 -3.404497 -0.921380
C 3.252517 1.272692 1.575428
C -0.399699 -3.731279 0.615798
C 2.992682 2.544532 -0.492923
C 0.638153 -4.271613 -0.174723
C 3.723352 2.263626 0.681779
H -2.967744 2.098969 1.880787
H -3.739159 2.455134 0.291762
H 1.907601 -1.341666 -1.459393
H 1.696587 -0.190807 1.991432
H -1.406294 -1.934477 1.296463
H 1.260686 2.068422 -1.703793
H -4.760810 0.133208 0.271276
H -3.993843 -0.217742 1.858616
H -5.259052 1.037785 1.730418
H 2.277184 -3.814436 -1.538974
H 3.812000 1.047205 2.489908
H -1.046224 -4.394524 1.200998
H 3.350794 3.306307 -1.194154
H 0.798162 -5.354872 -0.209078
H 4.649276 2.807621 0.898764


