%chk=000184974.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184974

0 1
O 3.480814 -0.925905 -0.620462
O 1.800580 0.108511 0.557169
O 2.034719 -3.108158 2.595634
O 1.718335 -4.090672 -0.057362
O 4.605465 -1.210324 2.309285
O 2.422178 -1.306762 -3.287885
O -1.731959 3.116078 -0.525582
O 2.542558 4.876740 -0.136725
O -0.517278 -0.782640 -0.039145
O -6.268698 -3.199430 -0.565744
C 2.821711 -2.692990 1.473736
C 1.939686 -2.697871 0.205409
C 3.269158 -1.260531 1.827389
C 2.677138 -2.085430 -1.000179
C 3.200043 -0.306452 0.606113
C 1.704872 -1.606327 -2.088656
C 1.440487 1.371921 0.214761
C 0.053428 1.517061 -0.064707
C 2.327744 2.453159 0.189747
C -0.394503 2.835738 -0.295709
C -0.869452 0.378781 -0.134596
C 1.810724 3.731706 -0.081049
C 0.438172 3.949338 -0.317019
C -2.293373 0.768048 -0.363498
C -2.630125 2.062643 -0.527357
C -3.315314 -0.288806 -0.408177
C -4.292618 -0.288150 -1.423241
C -3.317852 -1.306986 0.561586
C 3.975258 4.800416 0.094629
C -5.276134 -1.271336 -1.461518
C -4.295956 -2.301672 0.544404
C -5.264852 -2.266106 -0.468591
H 3.683353 -3.390734 1.369039
H 0.964137 -2.173404 0.406115
H 2.664792 -0.868435 2.689156
H 3.447560 -2.775856 -1.417171
H 3.909995 0.545840 0.655874
H 1.131914 -0.718285 -1.754701
H 1.004620 -2.403987 -2.400808
H 1.615843 -3.980767 2.394879
H 0.879672 -4.210528 -0.554049
H 5.219467 -1.700361 1.715831
H 3.072849 -0.590180 -3.112882
H 3.383043 2.302983 0.386860
H 0.054432 4.949024 -0.506988
H -3.616442 2.494622 -0.688294
H -4.275514 0.480658 -2.195799
H -2.538841 -1.325300 1.328078
H -6.040146 -1.290700 -2.235552
H -4.298164 -3.083549 1.296812
H 4.271018 5.853078 -0.017200
H 4.448821 4.175877 -0.668288
H 4.175725 4.441602 1.108400
H -6.214691 -3.880492 0.148623


%chk=000184974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184974

0 1
O 3.658316 -0.650861 -0.268694
O 1.717120 0.124878 0.939200
O 2.245987 -3.704971 2.279547
O 1.888562 -3.987914 -0.462878
O 4.416064 -1.401617 2.808239
O 3.039878 -0.462544 -3.013160
O -1.763161 3.020464 -0.824900
O 2.639272 4.736225 -0.567680
O -0.668353 -0.897634 0.100886
O -6.717266 -3.081233 -0.274535
C 2.929725 -2.811287 1.357441
C 2.115734 -2.623054 0.061896
C 3.160708 -1.457100 2.055191
C 2.959702 -1.814992 -0.946870
C 3.134480 -0.293251 1.030320
C 2.169914 -1.247114 -2.134110
C 1.358755 1.326408 0.321365
C -0.023452 1.451483 -0.054725
C 2.273308 2.383657 0.139382
C -0.421656 2.749038 -0.504909
C -0.995829 0.326644 -0.067966
C 1.815484 3.631845 -0.360549
C 0.454145 3.830780 -0.664446
C -2.410094 0.704469 -0.360036
C -2.701550 2.005882 -0.696233
C -3.497460 -0.308816 -0.336675
C -4.559630 -0.258333 -1.283987
C -3.523876 -1.339973 0.641094
C 4.070793 4.604833 -0.267309
C -5.621843 -1.180048 -1.248993
C -4.580975 -2.269874 0.686364
C -5.634168 -2.187138 -0.257153
H 3.917437 -3.244446 1.063673
H 1.153208 -2.120856 0.274070
H 2.367922 -1.292828 2.801331
H 3.791564 -2.442030 -1.317747
H 3.782881 0.520604 1.398099
H 1.311920 -0.649064 -1.768924
H 1.791428 -2.074381 -2.758703
H 1.954221 -4.485784 1.736002
H 1.000658 -4.025030 -0.895851
H 5.134746 -1.822487 2.270305
H 3.508774 0.196779 -2.437686
H 3.324248 2.249889 0.399181
H 0.093358 4.796292 -1.022475
H -3.703968 2.385094 -0.903820
H -4.539039 0.492497 -2.082381
H -2.709875 -1.415408 1.365550
H -6.432503 -1.146290 -1.982426
H -4.582562 -3.054776 1.453852
H 4.502460 5.583638 -0.519527
H 4.539543 3.818732 -0.889074
H 4.236202 4.389085 0.805355
H -6.632854 -3.753383 0.446675


