%chk=000194716.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194716

0 1
O -1.972062 -0.543335 -0.795822
O -1.387255 1.575480 -0.180385
O 1.275035 -0.046847 0.983863
O 2.040818 1.621058 -0.431400
C -0.574497 -0.430793 -1.167292
C -0.187806 1.009154 -0.742231
C 0.171702 -1.606539 -0.502783
C 1.527180 -1.174722 0.090940
C 0.915123 1.153815 0.326601
C -2.331414 0.510478 0.128756
C 0.358426 -2.747997 -1.502367
C 2.157445 -2.209633 1.009571
C -2.146146 0.052399 1.563121
C -3.711693 1.009180 -0.240280
C 3.190350 1.981710 0.361386
H -0.590779 -0.524661 -2.275272
H 0.046169 1.660510 -1.617141
H -0.482886 -1.967264 0.335928
H 2.233245 -0.831794 -0.697675
H 0.647003 1.839405 1.156667
H 0.777174 -3.638365 -1.018987
H -0.604337 -3.046227 -1.939681
H 1.026135 -2.474137 -2.326637
H 1.464932 -2.523087 1.801493
H 2.471305 -3.101535 0.457618
H 3.039177 -1.791121 1.513487
H -2.466897 0.821841 2.273946
H -2.716240 -0.861635 1.764108
H -1.087258 -0.167054 1.776986
H -3.878637 2.021158 0.151420
H -3.826072 1.058869 -1.333280
H -4.498575 0.350914 0.144127
H 3.466110 1.156204 1.026238
H 2.976997 2.893723 0.926110
H 3.962929 2.157749 -0.395430


%chk=000194716-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194716

0 1
O -1.907445 -0.548479 -0.883963
O -1.271401 0.986074 0.815276
O 1.729064 0.038166 1.021196
O 1.972289 1.766306 -0.648892
C -0.430007 -0.380757 -0.914012
C -0.228976 0.990385 -0.233515
C 0.273761 -1.552342 -0.188005
C 1.738107 -1.154903 0.118630
C 1.139416 1.220110 0.425374
C -2.453723 0.326382 0.208770
C 0.152848 -2.842232 -1.024642
C 2.540660 -2.216489 0.871204
C -3.121963 -0.524954 1.287541
C -3.386931 1.356761 -0.441439
C 3.289930 2.214519 -0.176883
H -0.136849 -0.354036 -1.979285
H -0.409577 1.813052 -0.952118
H -0.228881 -1.695237 0.788568
H 2.255551 -0.871086 -0.823933
H 1.054548 1.935875 1.266960
H 0.493606 -3.729645 -0.463395
H -0.901765 -3.003429 -1.309956
H 0.750805 -2.773683 -1.954808
H 2.013570 -2.518198 1.793865
H 2.699174 -3.110922 0.244585
H 3.527512 -1.812117 1.155423
H -3.478010 0.116692 2.112214
H -3.983109 -1.066338 0.860111
H -2.404803 -1.256773 1.692768
H -3.852589 1.994309 0.330099
H -2.825999 1.997789 -1.142616
H -4.181126 0.839892 -1.007351
H 3.854183 1.382648 0.283905
H 3.184721 3.034621 0.562872
H 3.818110 2.584942 -1.068845


