%chk=000225121.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225121

0 1
S 4.882502 -0.360767 -0.760937
O -3.104816 0.073148 0.450909
C -2.071030 2.584424 -0.159115
C -1.703857 -2.527761 0.234760
C -1.248828 1.301140 -0.319504
C -1.081668 -1.176581 -0.126130
C -1.799234 0.033932 0.000016
C 0.808107 0.140623 -0.927346
C 0.067649 1.322490 -0.782382
C 0.234297 -1.090694 -0.596559
C -3.317225 2.493042 -1.061596
C -2.483936 2.729517 1.318823
C -1.275019 3.843377 -0.562796
C -2.109748 -2.511128 1.724603
C -2.945174 -2.762567 -0.653507
C -0.736045 -3.706554 0.019423
C 2.226655 0.194316 -1.439696
C 3.225567 0.068649 -0.353861
C 3.117304 0.249174 0.989781
C 4.360894 0.045240 1.703806
C 5.405662 -0.287555 0.902790
H 0.543999 2.269759 -1.037201
H 0.840212 -1.990683 -0.706765
H -3.925248 3.399201 -0.995954
H -3.040686 2.346540 -2.109599
H -3.955733 1.648212 -0.768289
H -1.610211 2.754916 1.976236
H -3.058413 3.644690 1.485000
H -3.112033 1.886188 1.637730
H -1.885992 4.743820 -0.435480
H -0.380483 3.973780 0.054396
H -0.967968 3.810691 -1.612726
H -2.526912 -3.473233 2.037630
H -1.242092 -2.304550 2.362813
H -2.858499 -1.738962 1.944597
H -2.676685 -2.729834 -1.716205
H -3.399106 -3.739077 -0.458282
H -3.720451 -2.000956 -0.496718
H -1.207178 -4.657481 0.291516
H -0.424751 -3.790356 -1.027568
H 0.166043 -3.608126 0.634060
H 2.372054 -0.603081 -2.205089
H 2.401239 1.148476 -1.991718
H -3.459275 -0.839366 0.663754
H 2.203027 0.516811 1.503576
H 4.413354 0.157791 2.778677
H 6.426232 -0.490136 1.171630


%chk=000225121-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225121

0 1
S 5.035926 -0.048882 -0.746901
O -3.151508 0.062207 0.520910
C -2.015492 2.616554 -0.144701
C -1.784584 -2.593545 0.214020
C -1.244451 1.280707 -0.313806
C -1.134894 -1.225067 -0.144096
C -1.827477 0.018175 0.017551
C 0.808178 0.060224 -0.982189
C 0.080367 1.258308 -0.811185
C 0.186644 -1.161345 -0.647936
C -3.303825 2.606607 -1.024019
C -2.395081 2.829848 1.353437
C -1.162473 3.837948 -0.583987
C -2.118317 -2.664375 1.741078
C -3.057744 -2.854247 -0.657483
C -0.823696 -3.781547 -0.069847
C 2.246386 0.085786 -1.485823
C 3.265016 0.101229 -0.360617
C 3.084055 0.238751 1.007058
C 4.310618 0.230260 1.773075
C 5.447189 0.085603 0.997674
H 0.567583 2.201846 -1.072814
H 0.758266 -2.084062 -0.780196
H -3.847052 3.562688 -0.898951
H -3.044373 2.496773 -2.093665
H -3.974759 1.782014 -0.738615
H -1.485823 2.884099 1.981120
H -2.946300 3.783088 1.465712
H -3.031325 2.012041 1.724895
H -1.757652 4.758566 -0.442001
H -0.241888 3.939900 0.020148
H -0.880524 3.785135 -1.652080
H -2.578202 -3.640673 1.982699
H -1.190749 -2.563320 2.332715
H -2.807023 -1.877043 2.100557
H -2.781703 -2.876890 -1.727000
H -3.500327 -3.832619 -0.393277
H -3.853999 -2.093729 -0.555401
H -1.327219 -4.727680 0.200799
H -0.549434 -3.842210 -1.138464
H 0.103310 -3.713395 0.527211
H 2.434489 -0.793335 -2.133839
H 2.400832 0.977082 -2.126330
H -3.470259 -0.846892 0.731813
H 2.091734 0.343064 1.452007
H 4.342250 0.327998 2.861205
H 6.491815 0.044852 1.301041


