%chk=000235621.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235621

0 1
O -3.167288 1.446738 -0.565411
O 3.146031 1.488387 -0.574057
O -0.016732 2.546414 0.145429
C -6.099612 -0.692711 -0.528659
C 6.110512 -0.606190 -0.533451
C -6.453262 -0.701030 0.849527
C 6.472580 -0.594860 0.842527
C -4.233732 0.761538 -0.023078
C 4.225913 0.824918 -0.031289
C -4.969428 0.055195 -0.958398
C 4.966543 0.120068 -0.963837
C -2.322151 2.233215 0.325598
C 2.294032 2.270545 0.314187
C -1.232186 2.745495 -0.616524
C 1.190699 2.756445 -0.626334
C -5.662252 0.043061 1.777425
C 5.676020 0.146807 1.767608
C -4.569956 0.766049 1.362712
C 4.570404 0.848887 1.352266
C -6.897260 -1.443310 -1.455470
C 6.913815 -1.354257 -1.457422
C -7.593282 -1.456189 1.273649
C 7.626461 -1.328286 1.267312
C -7.982693 -2.156183 -1.017398
C 8.012554 -2.046085 -1.018784
C -8.337688 -2.164154 0.365536
C 8.375996 -2.034332 0.361929
H -4.685293 0.070514 -2.007423
H 4.675849 0.120196 -2.011181
H -1.895056 1.578409 1.109938
H -2.928432 3.037853 0.770363
H 1.881789 1.617092 1.107556
H 2.890324 3.088886 0.747304
H -1.204824 2.150481 -1.551318
H -1.332848 3.817432 -0.852222
H 1.273972 3.827117 -0.874119
H 1.165991 2.150974 -1.554492
H -5.942078 0.027588 2.831809
H 5.962429 0.146518 2.820335
H -3.973253 1.325920 2.075270
H 3.969637 1.407093 2.062710
H -6.618764 -1.431904 -2.507730
H 6.628810 -1.357985 -2.507994
H -7.854562 -1.455590 2.331028
H 7.894101 -1.312758 2.322985
H -8.593270 -2.728970 -1.714550
H 8.627508 -2.616806 -1.713780
H -9.205277 -2.740850 0.678751
H 9.254107 -2.594583 0.675667


%chk=000235621-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235621

0 1
O -3.599666 0.285298 -0.834936
O 3.598618 0.348361 -0.839482
O 0.000726 0.214060 -0.207119
C -7.282427 0.245544 -0.412140
C 7.282135 0.360306 -0.420470
C -7.424473 0.043587 1.018295
C 7.428577 0.151947 1.008599
C -4.838679 0.199104 -0.173823
C 4.839548 0.276900 -0.180143
C -5.974953 0.319220 -0.982102
C 5.973122 0.418355 -0.988768
C -2.377773 0.178201 -0.026598
C 2.379625 0.216923 -0.030321
C -1.219163 0.312026 -1.013340
C 1.217542 0.334917 -1.014925
C -6.239338 -0.075012 1.812101
C 6.246118 0.011852 1.802871
C -4.967337 -0.000523 1.240533
C 4.972593 0.071337 1.232963
C -8.469846 0.365590 -1.212607
C 8.466891 0.502139 -1.221324
C -8.738715 -0.029837 1.588110
C 8.744322 0.093841 1.576711
C -9.735380 0.290067 -0.628445
C 9.733988 0.441200 -0.638822
C -9.873895 0.090587 0.784172
C 9.876831 0.235255 0.772434
H -5.846871 0.470675 -2.059025
H 5.841772 0.574134 -2.064681
H -2.330315 -0.801574 0.487977
H -2.332095 0.988156 0.727694
H 2.349510 -0.765683 0.480158
H 2.321233 1.022740 0.727537
H -1.260029 -0.498993 -1.770443
H -1.269905 1.289286 -1.537851
H 1.251037 1.314599 -1.536284
H 1.270751 -0.472799 -1.774803
H -6.338429 -0.227610 2.893466
H 6.348520 -0.145391 2.883260
H -4.081512 -0.095298 1.875142
H 4.088931 -0.039488 1.867983
H -8.367094 0.517893 -2.293638
H 8.360867 0.659406 -2.301328
H -8.839435 -0.182272 2.669701
H 8.848327 -0.063627 2.657268
H -10.632897 0.383244 -1.250115
H 10.629423 0.550936 -1.260790
H -10.873999 0.033457 1.227459
H 10.878115 0.189769 1.214392


