%chk=000276420.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276420

0 1
S -1.287575 -1.418113 -0.198389
S -1.947458 1.307597 0.315560
O 0.697463 0.334914 -1.193427
O 2.171047 0.001985 1.967784
O 3.887995 -1.445162 0.568329
O 4.825693 0.244505 -1.182114
C 0.638312 0.393566 0.238742
C 1.728621 -0.589818 0.732214
C -0.745712 0.022245 0.756314
C 2.924797 -0.732886 -0.234166
C -2.657441 -2.066058 0.812747
C -1.605488 2.656069 1.492733
C -3.205582 -3.327972 0.132763
C -1.446067 3.989992 0.752865
C 3.524641 0.612393 -0.673428
C -3.774133 -3.026771 -1.257602
C -2.159068 -4.445262 0.071171
C -0.170593 4.024690 -0.095767
C -2.679671 4.321987 -0.093023
H 0.918758 1.433520 0.548947
H 1.324434 -1.602815 0.967378
H -0.728335 -0.170036 1.852063
H 2.665569 -1.364441 -1.114102
H -2.298024 -2.294751 1.831729
H -3.448037 -1.297249 0.907166
H -0.706944 2.432625 2.095314
H -2.456187 2.704003 2.199543
H -4.053399 -3.689375 0.777202
H -1.350716 4.783660 1.543798
H 3.636675 1.313934 0.170141
H 2.932535 1.069762 -1.489053
H -0.120058 0.708844 -1.600691
H 3.029275 -0.425653 2.234050
H -4.485768 -2.194152 -1.232662
H -4.296843 -3.898068 -1.666918
H -2.990398 -2.757129 -1.976779
H -1.727696 -4.652424 1.056215
H -2.599454 -5.377314 -0.299838
H -1.326383 -4.197054 -0.599190
H 0.722535 3.831367 0.506932
H -0.040447 5.004730 -0.568920
H -0.196739 3.282375 -0.902736
H -3.603690 4.252218 0.490669
H -2.620156 5.339714 -0.494519
H -2.784712 3.647407 -0.952254
H 4.788031 -1.343773 0.160394
H 5.394389 1.033976 -1.248585


%chk=000276420-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276420

0 1
S -1.102779 -1.876476 -0.364574
S -1.934123 1.056357 -0.053093
O 0.830203 0.294087 -1.556334
O 1.995281 -0.552223 1.823312
O 4.258732 -1.142612 0.533504
O 5.111449 1.147872 -0.490085
C 0.782922 0.217378 -0.094766
C 1.920375 -0.709576 0.363852
C -0.594781 -0.241793 0.408628
C 3.287690 -0.367158 -0.266394
C -2.397410 -2.361733 0.953034
C -1.564923 2.429005 1.235012
C -3.427435 -3.372203 0.403336
C -1.376239 3.831232 0.610970
C 3.660386 1.121081 -0.197126
C -4.323131 -2.751607 -0.694457
C -2.758812 -4.681081 -0.081920
C -0.098204 3.933724 -0.251791
C -2.627313 4.276078 -0.183804
H 0.969238 1.218783 0.351583
H 1.678498 -1.759063 0.104721
H -0.576841 -0.348902 1.505508
H 3.305510 -0.700436 -1.320022
H -1.843914 -2.779182 1.812431
H -2.892790 -1.418486 1.246554
H -0.658767 2.109358 1.780831
H -2.418956 2.423900 1.934016
H -4.077767 -3.625533 1.269355
H -1.258586 4.523046 1.474341
H 3.463312 1.521006 0.818639
H 3.087967 1.685084 -0.957182
H -0.029434 0.704743 -1.850153
H 2.878738 -0.942984 2.072061
H -4.836865 -1.844343 -0.326189
H -5.092228 -3.474757 -1.022860
H -3.720509 -2.462468 -1.574150
H -2.124935 -5.128285 0.706281
H -3.523737 -5.424623 -0.371813
H -2.119864 -4.492846 -0.965098
H 0.806756 3.683037 0.334341
H 0.024548 4.960467 -0.642425
H -0.153621 3.244900 -1.114932
H -3.539938 4.228747 0.439227
H -2.513217 5.314134 -0.545850
H -2.780393 3.623990 -1.064102
H 5.148054 -0.730046 0.361222
H 5.455850 2.072209 -0.445040


