%chk=000190625.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190625

0 1
O -0.386772 1.670169 -0.697961
O -1.713479 4.383304 1.367660
O -4.188303 0.506063 -0.030269
O -4.305318 -1.939301 -1.036553
O -0.108413 -0.431085 2.314171
C -0.984289 3.798104 0.225758
C -1.498866 2.344364 0.014627
C 0.519391 3.557467 0.540059
C 0.922676 2.368083 -0.368838
C -1.879994 1.628035 1.336445
C -1.195069 4.653651 -1.037673
C -2.107774 0.145758 1.128655
C 1.858848 1.380990 0.273091
C -3.203108 -0.344511 0.455127
C -1.109163 -0.810611 1.645741
C -3.469286 -1.825818 0.190910
C -1.312572 -2.310927 1.378763
C 3.061125 0.939331 -0.199884
C -2.151401 -2.600995 0.113786
C 3.853865 -0.090680 0.602026
C 3.708020 1.399854 -1.495452
C 4.117632 -1.425803 -0.153551
C 2.844024 -2.160790 -0.536977
C 2.795775 -3.426571 -1.041134
C 1.480399 -4.092176 -1.407180
C 4.058899 -4.247503 -1.277863
H -2.359086 2.316469 -0.677754
H 1.142521 4.448046 0.344767
H 0.621354 3.285969 1.605847
H 1.311748 2.732070 -1.337573
H -1.080667 1.752771 2.085513
H -2.787948 2.121276 1.726571
H -0.716379 5.647113 -0.934373
H -0.760535 4.153872 -1.921778
H -2.274475 4.802035 -1.219022
H 1.479032 0.962130 1.216746
H -1.435997 5.329194 1.465327
H -4.124341 -2.242190 0.978946
H -1.810833 -2.748087 2.268983
H -0.314438 -2.777709 1.314757
H -2.350781 -3.683105 0.013365
H -1.588104 -2.267148 -0.781947
H 3.314559 -0.313705 1.541688
H 4.837228 0.342592 0.883663
H 3.151272 2.209667 -1.994107
H 4.739052 1.760708 -1.309195
H 3.788931 0.560724 -2.213568
H 4.751528 -2.071656 0.490319
H 4.732553 -1.226082 -1.057621
H -4.796440 -0.051841 -0.601505
H -3.708378 -1.914524 -1.829618
H 1.906655 -1.602698 -0.396546
H 0.622049 -3.421265 -1.223352
H 1.463219 -4.385580 -2.476369
H 1.325777 -5.021922 -0.822650
H 4.692313 -4.293338 -0.370693
H 3.819005 -5.283704 -1.574809
H 4.684363 -3.806278 -2.079294


%chk=000190625-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190625

0 1
O -0.406690 1.707043 -0.704553
O -1.698367 4.308674 1.520866
O -4.162990 0.466426 -0.024233
O -4.268126 -1.940705 -1.118919
O -0.040463 -0.513144 2.251097
C -0.993249 3.783367 0.335617
C -1.505746 2.338179 0.066587
C 0.518603 3.536563 0.603362
C 0.905498 2.395375 -0.372495
C -1.852005 1.559199 1.361877
C -1.237579 4.697838 -0.879558
C -2.066030 0.084173 1.097093
C 1.859895 1.381012 0.196712
C -3.163037 -0.391346 0.417691
C -1.050397 -0.880870 1.569135
C -3.416928 -1.864494 0.101099
C -1.238155 -2.371990 1.240748
C 3.075962 1.005911 -0.298004
C -2.091899 -2.621094 -0.023058
C 3.887365 -0.064262 0.430158
C 3.724266 1.588036 -1.543360
C 4.187872 -1.339650 -0.419200
C 2.931992 -2.078727 -0.841993
C 2.760383 -3.426262 -0.968999
C 1.423791 -4.004160 -1.411248
C 3.839227 -4.462094 -0.701691
H -2.381402 2.337574 -0.606592
H 1.133011 4.438921 0.436698
H 0.647516 3.214204 1.651903
H 1.270455 2.810031 -1.330217
H -1.041193 1.662410 2.101808
H -2.758281 2.023559 1.789826
H -0.762880 5.688497 -0.737801
H -0.820115 4.245636 -1.796894
H -2.321698 4.847084 -1.029307
H 1.484048 0.883856 1.103009
H -1.425850 5.251442 1.655728
H -4.056943 -2.317637 0.881127
H -1.715862 -2.853861 2.119085
H -0.234085 -2.818588 1.140064
H -2.280784 -3.700630 -0.164124
H -1.544019 -2.246038 -0.911738
H 3.352621 -0.366143 1.349673
H 4.862406 0.367814 0.741964
H 3.139406 2.406421 -1.993474
H 4.733163 1.981559 -1.308038
H 3.861078 0.810847 -2.320304
H 4.854879 -1.997944 0.169048
H 4.771318 -1.042402 -1.316906
H -4.772046 -0.076406 -0.608857
H -3.681964 -1.881040 -1.918105
H 2.073407 -1.427187 -1.068639
H 0.686813 -3.207731 -1.617392
H 1.535324 -4.615442 -2.329524
H 1.002652 -4.676541 -0.635304
H 4.776742 -4.019380 -0.327911
H 3.491911 -5.208223 0.040848
H 4.078784 -5.025457 -1.626186


