%chk=000222778.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222778

0 1
O 0.165241 -2.132764 -0.056334
O -0.489258 2.042410 1.211461
O -3.014223 -1.537215 -0.335235
O -3.656338 0.393055 -1.903992
C -1.114936 0.024013 -0.228661
C -0.836504 1.522340 -0.119765
C -0.083332 -0.806609 0.534594
C 1.224147 -1.128606 -0.176443
C -2.574317 -0.270420 0.197842
C 0.539334 2.069231 0.168909
C -1.819535 2.395496 -0.874978
C -3.609499 0.665986 -0.493113
C -3.244303 2.146100 -0.375354
C -0.164525 -0.788136 2.032655
C 2.503685 -1.442435 0.565972
C 3.370007 -0.225619 0.670731
C -2.758054 -2.703682 0.467920
C 4.236417 0.185791 -0.268832
C 5.069626 1.415874 -0.069895
C 4.449825 -0.515432 -1.573186
H -1.052005 -0.258034 -1.319256
H 1.369134 -0.782118 -1.205691
H -2.684469 -0.244474 1.300239
H 1.389149 1.416205 0.360187
H 0.817806 3.068252 -0.156228
H -1.763423 2.165087 -1.961661
H -1.562723 3.466638 -0.762066
H -4.624148 0.456544 -0.082906
H -3.348508 2.481852 0.675121
H -3.960509 2.743732 -0.976191
H -1.045446 -1.327546 2.399977
H 0.713645 -1.254748 2.500835
H -0.225494 0.254145 2.400246
H 2.278202 -1.845700 1.577955
H 3.030087 -2.271197 0.041800
H -3.677720 -0.584038 -2.055398
H 3.251719 0.327047 1.602468
H -1.685971 -2.943195 0.450778
H -3.328770 -3.478649 -0.058757
H -3.127871 -2.567873 1.485973
H 6.128020 1.151767 0.067927
H 5.013544 2.085567 -0.938312
H 4.768469 1.999030 0.809665
H 4.118298 -1.563334 -1.546978
H 3.891282 -0.020080 -2.379570
H 5.507646 -0.521061 -1.867450


%chk=000222778-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222778

0 1
O 0.047541 -2.214273 -0.164817
O -0.551314 2.139279 1.199759
O -3.092091 -1.594379 -0.187478
O -3.722615 0.310884 -1.920681
C -1.165666 0.035611 -0.240724
C -0.886628 1.555442 -0.178879
C -0.107620 -0.827251 0.474038
C 1.130240 -1.175729 -0.320774
C -2.634102 -0.250261 0.212791
C 0.474253 2.115961 0.087484
C -1.887591 2.409840 -0.945450
C -3.664590 0.670297 -0.493792
C -3.313334 2.158848 -0.414109
C -0.094077 -0.823609 1.994729
C 2.495474 -1.524723 0.267918
C 3.349845 -0.293178 0.520010
C -2.885876 -2.697248 0.754199
C 4.367440 0.185347 -0.254791
C 5.129545 1.438476 0.146835
C 4.837699 -0.454881 -1.548872
H -1.126321 -0.236997 -1.315817
H 1.178252 -0.762564 -1.341814
H -2.729745 -0.120012 1.312209
H 1.329835 1.455448 0.264164
H 0.720489 3.106337 -0.317840
H -1.848448 2.146253 -2.019209
H -1.618674 3.476016 -0.838022
H -4.652603 0.477956 -0.024076
H -3.385908 2.500188 0.636217
H -4.055199 2.723483 -1.006367
H -1.012631 -1.285299 2.397243
H 0.760226 -1.392867 2.394162
H -0.051230 0.217920 2.359013
H 2.348123 -2.080712 1.211551
H 2.993353 -2.225146 -0.427894
H -3.777369 -0.682519 -1.944536
H 3.104766 0.262777 1.438466
H -1.830899 -3.020806 0.770068
H -3.518371 -3.521700 0.386398
H -3.219389 -2.414682 1.775132
H 6.205741 1.217060 0.291203
H 5.070991 2.210939 -0.645749
H 4.742064 1.875878 1.083401
H 4.287591 -1.374734 -1.804870
H 4.727064 0.252275 -2.394893
H 5.915163 -0.705749 -1.488535


