%chk=000287625.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287625

0 1
O -2.696684 -3.092226 -1.164710
O -3.545326 2.568782 -0.345027
O -4.859320 0.785380 0.109577
O 5.999002 0.977154 -0.180625
C -2.157227 -1.560392 0.670632
C -1.791372 -0.051041 0.566550
C -2.541077 0.482211 -0.699659
C -0.978213 -2.427473 1.129695
C -2.896812 -0.724556 -1.574083
C -2.599034 -1.964899 -0.753439
C -0.317332 0.258055 0.453665
C 0.273858 -2.163643 0.289059
C -3.368080 -1.763538 1.586977
C 0.655980 -0.710172 0.314562
C -3.794668 1.216497 -0.263700
C 0.052866 1.642093 0.507403
C 2.041012 -0.331727 0.188918
C 2.392506 1.046759 0.227395
C 1.359162 2.027591 0.397927
C 3.084779 -1.292811 0.023079
C 3.751270 1.439322 0.098271
C 4.400931 -0.918902 -0.103795
C 4.724300 0.467794 -0.064950
C -4.614135 3.466387 0.057877
C 7.093902 0.047004 -0.356049
H -2.167092 0.470688 1.483109
H -1.885750 1.190693 -1.268123
H -1.258603 -3.499188 1.061727
H -0.763637 -2.228991 2.198222
H -2.311135 -0.735541 -2.513506
H -3.959554 -0.731424 -1.893286
H 0.104465 -2.479591 -0.764105
H 1.101717 -2.804732 0.658243
H -3.139214 -1.501667 2.625547
H -4.225374 -1.144333 1.274684
H -3.705743 -2.808077 1.580553
H -0.734473 2.387751 0.636141
H 1.641472 3.078371 0.437659
H 2.820810 -2.353457 -0.000488
H 4.025895 2.490998 0.126463
H 5.179580 -1.663908 -0.230487
H -5.569912 3.134735 -0.362403
H -4.295114 4.427198 -0.359469
H -4.657609 3.488647 1.150614
H 6.973156 -0.513131 -1.287446
H 7.177552 -0.611931 0.512623
H 7.954773 0.726541 -0.416517


%chk=000287625-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287625

0 1
O -2.422260 -3.137344 -1.205522
O -3.578427 2.474228 0.137122
O -5.042486 0.858868 -0.673527
O 6.119135 0.950118 -0.305793
C -2.175328 -1.490474 0.638974
C -1.809228 0.013972 0.502256
C -2.577885 0.513121 -0.810518
C -1.050595 -2.327726 1.281225
C -2.825482 -0.740429 -1.678066
C -2.465280 -1.948294 -0.809212
C -0.308418 0.305316 0.389050
C 0.295872 -2.158471 0.551353
C -3.502341 -1.676355 1.436990
C 0.679440 -0.693722 0.373193
C -3.869189 1.247009 -0.467071
C 0.073239 1.689671 0.293963
C 2.069189 -0.319302 0.198257
C 2.437386 1.080554 0.094432
C 1.401262 2.073162 0.160759
C 3.123857 -1.284586 0.110913
C 3.804522 1.450936 -0.069547
C 4.461054 -0.910562 -0.057101
C 4.806458 0.475570 -0.143340
C -4.750691 3.293948 0.532886
C 7.197082 -0.037588 -0.389853
H -2.195063 0.581409 1.370648
H -1.934025 1.245795 -1.325687
H -1.349805 -3.392152 1.262005
H -0.941116 -2.024769 2.341307
H -2.207222 -0.755103 -2.592981
H -3.882317 -0.819789 -1.995825
H 0.246129 -2.665878 -0.433740
H 1.076559 -2.687159 1.128521
H -3.359740 -1.330255 2.477709
H -4.341869 -1.110487 0.995104
H -3.785434 -2.743809 1.460583
H -0.715081 2.451949 0.340369
H 1.673897 3.133172 0.101272
H 2.887085 -2.351542 0.163039
H 4.085275 2.506626 -0.143834
H 5.232222 -1.683927 -0.123109
H -5.353929 3.547591 -0.354743
H -4.320578 4.194889 0.991783
H -5.378892 2.740757 1.251004
H 7.069741 -0.703702 -1.265445
H 7.262796 -0.645752 0.533397
H 8.116977 0.553813 -0.507897


