%chk=000287621.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287621

0 1
O -5.588598 -0.260571 -0.238841
O -4.090923 0.917539 1.150060
O 5.213922 -1.590675 0.221084
C -1.249609 -0.713923 -0.659619
C -1.968293 -1.276498 0.621724
C -1.945279 0.599026 -1.041816
C -4.139264 -0.065941 0.048701
C 0.246048 -0.519871 -0.362820
C -3.499907 -1.405449 0.459811
C -3.459566 0.545120 -1.185417
C 0.924305 0.659814 -0.560721
C -1.383627 -1.726489 -1.849724
C 1.005424 -1.714694 0.215335
C -1.263613 1.766539 -1.220298
C 0.225360 1.920718 -1.044344
C 2.458013 -1.779722 -0.293973
C 2.384008 0.755070 -0.271885
C 3.149178 -0.438980 -0.128289
C -6.367341 0.271059 0.904019
C -5.302626 0.674700 1.955701
C 3.045806 2.012660 -0.173165
C 4.543726 -0.352471 0.115499
C 4.428775 2.078633 0.080751
C 5.193616 0.900889 0.231849
C 6.651399 -1.560729 0.488936
H -1.757580 -0.587195 1.461843
H -1.548288 -2.264968 0.886950
H -3.756765 -2.152954 -0.313332
H -3.952901 -1.758971 1.405688
H -3.875440 1.554215 -1.347108
H -3.760956 -0.079316 -2.048903
H -2.438772 -1.906858 -2.120315
H -0.867404 -1.330119 -2.741494
H -0.935199 -2.704356 -1.596599
H 1.008871 -1.634968 1.324316
H 0.493794 -2.664339 -0.023088
H -1.822318 2.677508 -1.478543
H 0.693303 2.271353 -1.990789
H 0.403523 2.745737 -0.320459
H 2.457201 -2.052265 -1.371577
H 3.024956 -2.567948 0.229104
H -7.048119 -0.517784 1.270813
H -6.956353 1.137960 0.553117
H -5.530798 1.616209 2.478744
H -5.130820 -0.131000 2.697260
H 2.483276 2.943260 -0.287890
H 4.922208 3.053634 0.162326
H 6.267456 0.969228 0.427995
H 6.956702 -2.616614 0.539800
H 6.873934 -1.061729 1.452680
H 7.204458 -1.052674 -0.325404


%chk=000287621-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287621

0 1
O -5.582764 -0.412892 -0.130849
O -4.075565 0.808143 1.243465
O 5.242302 -1.562286 0.162888
C -1.242059 -0.756927 -0.628340
C -1.941303 -1.350406 0.650013
C -1.957812 0.553889 -0.980514
C -4.131925 -0.163097 0.120881
C 0.253702 -0.549178 -0.343194
C -3.472885 -1.496256 0.504979
C -3.471839 0.478699 -1.112798
C 0.912575 0.641119 -0.526758
C -1.374492 -1.749994 -1.835019
C 1.034999 -1.743456 0.206351
C -1.298668 1.727237 -1.141956
C 0.189628 1.900367 -0.977507
C 2.482858 -1.780778 -0.319179
C 2.374315 0.751729 -0.254313
C 3.157559 -0.433654 -0.140232
C -6.351917 0.491754 0.751457
C -5.385080 0.731511 1.923945
C 3.020406 2.016683 -0.143863
C 4.554014 -0.331883 0.086275
C 4.405732 2.097644 0.092375
C 5.188469 0.928267 0.213964
C 6.682330 -1.516990 0.414340
H -1.730753 -0.673001 1.499689
H -1.506211 -2.337513 0.894302
H -3.732252 -2.240969 -0.270483
H -3.913806 -1.855294 1.453657
H -3.900697 1.484528 -1.264129
H -3.767106 -0.142326 -1.981029
H -2.429743 -1.943724 -2.096020
H -0.875700 -1.329470 -2.725687
H -0.906739 -2.724389 -1.604816
H 1.049254 -1.681749 1.316377
H 0.533589 -2.695963 -0.042021
H -1.873274 2.634059 -1.379166
H 0.642059 2.277399 -1.921427
H 0.363215 2.713012 -0.238538
H 2.474346 -2.036948 -1.400762
H 3.065838 -2.569172 0.185719
H -7.280611 -0.031283 1.032250
H -6.589603 1.436227 0.224023
H -5.533823 1.687845 2.449110
H -5.407279 -0.108862 2.646719
H 2.443853 2.941182 -0.235785
H 4.887024 3.077910 0.183006
H 6.263937 1.008327 0.396328
H 7.002269 -2.569308 0.445260
H 6.909545 -1.029883 1.383057
H 7.218992 -0.989079 -0.398353


