%chk=000185766.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185766

0 1
O -2.704030 -1.869513 0.250475
O -2.922574 0.379349 0.847421
O -6.598791 -0.635444 1.025968
O -5.863070 -1.408161 -1.643773
O -4.428070 -2.061038 2.904921
O -1.970482 -2.272924 -2.680474
O 1.822719 0.197475 0.107419
O -3.017240 2.908266 0.285690
O -0.702830 4.321266 -0.355584
O 1.890499 4.221277 -0.732934
O 4.649765 -3.652595 -0.965610
O 7.165328 -2.946834 -0.176066
C -5.460717 -1.456159 0.752704
C -4.892740 -1.117750 -0.645833
C -4.443082 -1.102076 1.859058
C -3.578746 -1.874156 -0.911116
C -2.994207 -0.994182 1.313880
C -2.792454 -1.268314 -2.085604
C -1.713286 0.930154 0.530799
C -0.500321 0.224953 0.468749
C -1.776665 2.314481 0.236253
C 0.647953 0.942866 0.140292
C 0.647252 2.317710 -0.145224
C -0.591425 3.005503 -0.097624
C 1.888383 3.015718 -0.487092
C 3.012929 0.850069 -0.220089
C 3.076314 2.167026 -0.508039
C 4.113334 -0.127871 -0.192441
C 3.869197 -1.457124 -0.589928
C 5.388793 0.274215 0.227045
C 4.920521 -2.371148 -0.570555
C 6.449261 -0.640814 0.249119
C 6.214914 -1.954911 -0.149489
H -5.788958 -2.516879 0.827973
H -4.761590 -0.004856 -0.746721
H -4.754168 -0.153480 2.379130
H -3.740780 -2.965688 -1.078740
H -2.209020 -1.221984 2.066860
H -3.468672 -0.968400 -2.913734
H -2.177124 -0.407617 -1.766566
H -7.114460 -0.479975 0.195690
H -6.018142 -2.374389 -1.733524
H -4.275300 -2.969742 2.560266
H -1.238338 -2.513098 -2.070126
H -0.450533 -0.846160 0.654260
H 4.012395 2.655702 -0.784777
H -2.922627 3.892464 0.132381
H 0.238590 4.744786 -0.586309
H 2.874163 -1.778161 -0.907589
H 5.564784 1.303428 0.545509
H 7.437551 -0.323169 0.574704
H 5.471478 -4.221786 -0.918764
H 8.052022 -2.617406 0.119962


%chk=000185766-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185766

0 1
O -2.820601 -1.877736 -0.043536
O -2.968649 0.358967 0.877520
O -6.801158 -1.199746 1.141482
O -6.216717 -1.316549 -1.630927
O -4.350260 -2.336088 2.833344
O -1.886308 -1.389751 -2.733253
O 1.873218 0.122741 0.146947
O -2.945790 3.010592 0.301292
O -0.597139 4.323305 -0.298314
O 1.939079 4.224965 -0.652550
O 4.911824 -3.745334 0.647653
O 7.387638 -2.981739 -0.110519
C -5.498736 -1.678400 0.704702
C -5.126510 -1.066435 -0.663834
C -4.452536 -1.322009 1.782814
C -3.788319 -1.637103 -1.173278
C -3.056009 -1.085570 1.152451
C -3.112214 -0.763882 -2.241336
C -1.720666 0.911503 0.554568
C -0.506206 0.176837 0.507558
C -1.744627 2.306113 0.273281
C 0.675872 0.865738 0.195178
C 0.693857 2.255033 -0.078752
C -0.536349 2.966606 -0.036945
C 1.938404 2.943765 -0.404141
C 3.082725 0.759851 -0.164240
C 3.128654 2.121270 -0.426774
C 4.220775 -0.177859 -0.165821
C 4.030244 -1.528307 0.241110
C 5.515255 0.249660 -0.572440
C 5.108234 -2.424831 0.244812
C 6.599147 -0.649816 -0.569814
C 6.397839 -1.982390 -0.161584
H -5.515958 -2.790993 0.577280
H -5.096971 0.033194 -0.584555
H -4.769723 -0.403389 2.299817
H -3.938081 -2.655563 -1.586955
H -2.272243 -1.398771 1.864626
H -3.776851 -0.679436 -3.117516
H -2.921089 0.250767 -1.838789
H -7.379602 -1.148602 0.333086
H -6.221009 -2.279443 -1.877046
H -4.281413 -3.233154 2.415751
H -1.284377 -1.522589 -1.955674
H -0.471874 -0.897794 0.692482
H 4.077640 2.608784 -0.653269
H -2.743688 3.962380 0.087829
H 0.386229 4.620420 -0.501894
H 3.046865 -1.882063 0.556282
H 5.686592 1.277243 -0.902864
H 7.592544 -0.311681 -0.888250
H 5.773099 -4.237131 0.590241
H 8.273639 -2.652676 -0.395033


