%chk=000238823.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238823

0 1
O -1.649628 -1.571402 -1.757071
O -1.378697 0.634964 -2.337299
O -4.081443 -0.549474 0.711334
C -0.659802 -0.589322 -2.132898
C -2.818784 -0.902233 -1.227724
C 0.420120 -0.496143 -1.067078
C 0.289187 0.558449 -0.009051
C -2.678494 0.556685 -1.696670
C 0.594994 1.958644 -0.562250
C -2.801284 -1.069440 0.298679
C 0.496059 3.026670 0.532997
C 1.421682 -1.387483 -1.121795
C 0.784806 4.427403 -0.025524
C 2.547363 -1.468790 -0.175034
C 0.688031 5.499302 1.057821
C -4.403070 -0.831597 2.100490
C 3.453148 -0.404669 -0.039308
C 2.731121 -2.640233 0.578832
C -5.763409 -0.186187 2.293196
C 4.530695 -0.513196 0.843506
C 3.807575 -2.738926 1.463266
C 4.709460 -1.677813 1.596671
H -0.285496 -0.895318 -3.132201
H -3.679037 -1.437082 -1.683289
H -0.743050 0.529463 0.412990
H 0.962767 0.337721 0.846068
H -3.398238 0.843443 -2.480325
H -2.685422 1.296801 -0.879706
H -0.110189 2.188736 -1.390563
H 1.603905 1.969472 -1.016551
H -1.991624 -0.476736 0.774587
H -2.696031 -2.131609 0.578783
H -0.511352 3.007879 0.990963
H 1.203684 2.797181 1.352763
H 1.453420 -2.155858 -1.902317
H 1.792654 4.449322 -0.484269
H 0.075854 4.658370 -0.844976
H 0.896896 6.494376 0.649355
H -0.311799 5.531857 1.505172
H 1.403829 5.320317 1.868030
H -3.626435 -0.383975 2.744294
H -4.429073 -1.925828 2.244558
H 3.312631 0.503052 -0.624507
H 2.031378 -3.467385 0.475373
H -6.137144 -0.332648 3.311871
H -6.500662 -0.603635 1.593476
H -5.721368 0.893256 2.094018
H 5.232801 0.312830 0.944512
H 3.945765 -3.646159 2.049078
H 5.548708 -1.759251 2.283825


%chk=000238823-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238823

0 1
O -1.632468 -1.388479 0.238164
O -1.383024 0.142527 -1.540372
O -5.239048 -0.627876 0.410082
C -0.727646 -1.015358 -0.863077
C -2.995444 -1.095485 -0.266329
C 0.634443 -0.642626 -0.319199
C 0.660700 0.547018 0.620166
C -2.794189 0.205086 -1.077956
C 0.976763 1.895331 -0.091280
C -3.915373 -0.963849 0.942843
C 1.005286 3.085557 0.892841
C 1.688766 -1.420079 -0.725794
C 1.303414 4.435606 0.201148
C 3.125524 -1.392001 -0.387026
C 1.325404 5.624885 1.185607
C -6.252853 -0.497370 1.468982
C 3.800583 -0.335444 0.294977
C 3.906567 -2.517878 -0.790062
C -7.577876 -0.143168 0.796124
C 5.181058 -0.417890 0.573057
C 5.285088 -2.601127 -0.511678
C 5.932238 -1.548762 0.177100
H -0.669775 -1.847204 -1.598220
H -3.338244 -1.919913 -0.924568
H -0.334138 0.630893 1.097957
H 1.387677 0.377411 1.437654
H -3.453126 0.268482 -1.958576
H -2.927748 1.101207 -0.443054
H 0.210774 2.061199 -0.871441
H 1.948575 1.825880 -0.620173
H -3.540167 -0.163052 1.617378
H -3.947253 -1.918265 1.510240
H 0.029462 3.151816 1.418756
H 1.767887 2.902838 1.680334
H 1.430136 -2.246119 -1.408785
H 2.278598 4.368238 -0.322959
H 0.541908 4.616005 -0.584468
H 1.542282 6.577181 0.667376
H 0.350442 5.733117 1.697721
H 2.097675 5.480751 1.965084
H -5.943810 0.294602 2.187113
H -6.331199 -1.455945 2.028789
H 3.258702 0.564117 0.591862
H 3.413100 -3.339506 -1.324600
H -8.378209 -0.038949 1.551080
H -7.870207 -0.931221 0.081037
H -7.489207 0.808789 0.244844
H 5.675856 0.409162 1.095081
H 5.854509 -3.480842 -0.832031
H 7.004591 -1.605490 0.394353


