%chk=000183878.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183878

0 1
O 2.875558 -0.861599 0.390603
O -1.593771 1.163632 0.403962
O -2.551836 -1.322874 -0.500744
C 3.603362 0.387898 0.658249
C 1.515535 -0.835100 0.213878
C -0.677698 0.154292 0.227215
C -1.229102 -1.089987 -0.178563
C 0.699757 0.286502 0.433886
C 0.987695 -2.074697 -0.190680
C 4.919499 -0.130669 1.219694
C 3.757158 1.148743 -0.650251
C -0.387102 -2.193814 -0.375631
C -1.109409 2.464710 0.871922
C -3.554177 -0.594164 0.281263
C -2.377823 3.291208 0.954078
C -4.838232 -1.348147 -0.007103
H 3.034132 0.970440 1.414754
H 1.131745 1.225243 0.754017
H 1.655126 -2.917429 -0.348768
H 5.622648 0.684443 1.416743
H 4.760028 -0.684859 2.154014
H 5.399492 -0.831357 0.521726
H 4.359693 2.053928 -0.525872
H 2.784621 1.440575 -1.066607
H 4.244795 0.527075 -1.414187
H -0.830830 -3.141087 -0.685349
H -0.623166 2.324315 1.852076
H -0.392277 2.854792 0.129607
H -3.270151 -0.609958 1.345127
H -3.567038 0.446449 -0.094069
H -2.162749 4.323504 1.252732
H -2.896230 3.319537 -0.015317
H -3.087139 2.868052 1.678094
H -5.704472 -0.848556 0.437850
H -5.008589 -1.430420 -1.090045
H -4.794551 -2.374419 0.380295


%chk=000183878-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183878

0 1
O 2.913275 -0.899002 0.347972
O -1.608175 1.203374 0.344896
O -2.657881 -1.281130 -0.529158
C 3.619455 0.358404 0.710578
C 1.518963 -0.887541 0.155126
C -0.715994 0.126916 0.177885
C -1.289145 -1.112889 -0.232727
C 0.683271 0.236886 0.379081
C 0.960103 -2.113854 -0.271779
C 4.965949 -0.097853 1.282523
C 3.770055 1.264790 -0.525411
C -0.432720 -2.213379 -0.452699
C -1.045879 2.526849 0.672332
C -3.630810 -0.983327 0.558060
C -2.218800 3.502088 0.737210
C -5.005106 -1.383857 0.026803
H 3.038707 0.874577 1.504479
H 1.109072 1.189400 0.701313
H 1.621495 -2.967379 -0.443008
H 5.569469 0.775264 1.589870
H 4.814262 -0.750444 2.158942
H 5.529616 -0.665454 0.521482
H 4.271680 2.210840 -0.249576
H 2.792347 1.507975 -0.975751
H 4.382140 0.756237 -1.290993
H -0.889618 -3.151893 -0.781859
H -0.514173 2.475445 1.645436
H -0.320219 2.822861 -0.113380
H -3.354264 -1.574383 1.455742
H -3.581669 0.091645 0.806461
H -1.853880 4.519284 0.969173
H -2.751964 3.532272 -0.228116
H -2.934810 3.201107 1.521081
H -5.783324 -1.177783 0.784860
H -5.245384 -0.811123 -0.885659
H -5.031540 -2.458717 -0.222592


