%chk=000250156.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250156

0 1
O 2.338141 -0.483258 0.529876
O 2.132526 1.712605 -0.228943
O -3.822447 0.308928 0.890655
C 4.170184 0.469447 -0.761854
C 3.784073 -0.513593 0.369485
C 3.550019 1.843438 -0.453879
C 4.063269 -1.980048 0.024099
C 5.695130 0.572089 -0.917097
C 1.797905 0.809480 0.842462
C 4.104008 -2.862965 1.277738
C 6.105819 1.326082 -2.178635
C 0.304393 0.664523 0.820600
C 4.357403 -4.327019 0.928154
C -0.451567 0.993222 1.960680
C -0.333744 0.201349 -0.336848
C -1.833509 0.860968 1.946656
C -1.723933 0.059676 -0.376170
C -2.459171 0.392178 0.769328
C -7.073403 -0.561892 -0.781751
C -6.028137 -0.111713 0.258407
C -4.595804 -0.162439 -0.261882
C -6.870216 -2.024052 -1.195243
C -7.085241 0.356248 -2.009352
H 3.717350 0.093981 -1.713157
H 4.241314 -0.212371 1.336012
H 3.584942 2.523695 -1.323843
H 4.010982 2.332105 0.420640
H 3.264066 -2.341309 -0.658627
H 5.011532 -2.065891 -0.540047
H 6.138714 1.059090 -0.026564
H 6.128837 -0.450134 -0.944131
H 2.233693 1.180566 1.790655
H 4.885550 -2.502864 1.973901
H 3.140175 -2.765791 1.820560
H 7.195648 1.331088 -2.298102
H 5.776327 2.371023 -2.157303
H 5.680530 0.868890 -3.080177
H 3.570968 -4.726399 0.276710
H 5.313106 -4.462307 0.410244
H 4.380178 -4.949623 1.829772
H 0.046060 1.353870 2.861182
H 0.271908 -0.048531 -1.211694
H -2.442741 1.107339 2.812100
H -2.203311 -0.299547 -1.278806
H -8.075720 -0.482146 -0.283909
H -6.107176 -0.739710 1.169569
H -6.254982 0.919210 0.600095
H -4.418853 0.525334 -1.104880
H -4.263314 -1.183558 -0.510238
H -6.820744 -2.684596 -0.322619
H -7.695790 -2.373838 -1.825223
H -5.947469 -2.166356 -1.767092
H -7.191586 1.408249 -1.722527
H -6.166783 0.268401 -2.598819
H -7.919708 0.111974 -2.676265


%chk=000250156-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250156

0 1
O 2.377797 -0.577782 0.311996
O 2.164230 1.675326 -0.505207
O -3.893957 0.357569 0.985653
C 4.324448 0.445698 -0.852542
C 3.867401 -0.545981 0.254252
C 3.629832 1.807861 -0.608124
C 4.302755 -2.004344 0.050814
C 5.866603 0.611759 -0.884657
C 1.817196 0.748769 0.581529
C 3.868864 -2.934956 1.206073
C 6.377850 1.580771 -1.975710
C 0.319501 0.637969 0.665984
C 4.289768 -4.400831 0.971265
C -0.370029 1.002849 1.847378
C -0.420029 0.164193 -0.441419
C -1.771027 0.898830 1.925788
C -1.824924 0.053828 -0.380889
C -2.503725 0.423519 0.809784
C -7.207753 -0.571975 -0.718121
C -6.167411 -0.078228 0.327783
C -4.710962 -0.126424 -0.145668
C -7.031631 -2.071396 -1.066039
C -7.218930 0.297386 -2.000188
H 3.973812 0.049086 -1.827009
H 4.242342 -0.171754 1.239559
H 3.791079 2.506552 -1.443354
H 4.028040 2.265752 0.328253
H 3.867684 -2.367998 -0.901776
H 5.404413 -2.046126 -0.056218
H 6.217481 0.958695 0.110373
H 6.332048 -0.378242 -1.049112
H 2.265207 1.137559 1.529466
H 4.312292 -2.567875 2.154970
H 2.772257 -2.865648 1.323133
H 7.482135 1.570798 -2.020096
H 6.065248 2.623386 -1.786242
H 5.997908 1.290403 -2.973272
H 3.831113 -4.801220 0.047299
H 5.388139 -4.492840 0.867232
H 3.975241 -5.048707 1.809967
H 0.190958 1.372711 2.714279
H 0.113726 -0.117074 -1.354357
H -2.316995 1.178008 2.831838
H -2.373728 -0.314936 -1.252231
H -8.200019 -0.459829 -0.233209
H -6.250873 -0.691021 1.246217
H -6.401205 0.965152 0.615337
H -4.545235 0.530293 -1.023336
H -4.399148 -1.157893 -0.406518
H -7.000549 -2.694404 -0.152593
H -7.868996 -2.428932 -1.693475
H -6.097327 -2.250494 -1.631213
H -7.325685 1.371247 -1.757353
H -6.287444 0.171453 -2.583740
H -8.060386 0.012584 -2.658649


