%chk=000272088.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272088

0 1
S 2.289339 -1.337877 -1.341773
O -2.586309 0.185725 1.875130
O -0.359786 -0.169631 1.257063
O -1.605588 1.547482 -1.852482
O -3.712364 2.913051 -0.140279
O -3.865907 2.038894 -2.340324
O 1.852474 0.459717 -0.967997
O 3.158119 -1.419676 -2.705176
O 0.928218 -2.218332 -1.245497
C -2.246441 1.293417 0.949865
C -0.795010 0.976921 0.429086
C -3.365571 1.471785 -0.104031
C -3.009228 1.181332 -1.580786
C -0.692412 0.664770 -1.092028
C -1.570956 -0.884088 1.745199
C -4.167242 3.260122 -1.512415
C 0.686835 0.985945 -1.712938
C -2.026621 -1.972388 0.754230
C -1.265943 -1.423287 3.141000
C -3.342592 4.447495 -2.007374
C -5.682217 3.461342 -1.547127
C 3.421763 -1.566646 0.131921
C 2.907686 -1.376750 1.404525
C 4.746177 -1.933855 -0.135810
C 3.784681 -1.584318 2.482882
C 5.595385 -2.137622 0.961178
C 5.132149 -1.968985 2.279955
C 6.069708 -2.187048 3.452282
H -2.240146 2.215078 1.555632
H -0.112987 1.806650 0.678449
H -4.242185 0.872961 0.211968
H -3.189240 0.139041 -1.907854
H -0.948479 -0.398272 -1.268088
H 0.847093 2.080427 -1.690224
H 0.712484 0.651030 -2.767215
H -1.150416 -2.517538 0.365163
H -2.705491 -2.681823 1.258198
H -2.572009 -1.535405 -0.099582
H -0.851128 -0.618904 3.769623
H -2.193847 -1.796823 3.604976
H -0.542957 -2.256069 3.082276
H -3.656074 4.728627 -3.027301
H -2.275789 4.174175 -2.021867
H -3.490016 5.312621 -1.337651
H -5.958270 4.355574 -0.962774
H -6.194709 2.583622 -1.119836
H -6.021412 3.597035 -2.588513
H 1.872273 -1.050564 1.549610
H 5.095075 -2.051897 -1.166522
H 3.414087 -1.434764 3.503202
H 6.637175 -2.429871 0.785911
H 5.553223 -2.051187 4.417011
H 6.498703 -3.206151 3.437064
H 6.918196 -1.478072 3.420364


%chk=000272088-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272088

0 1
S 2.247067 -1.240101 -1.525802
O -2.601996 -0.507483 1.056859
O -0.277860 -0.085216 1.173124
O -1.668059 1.540604 -1.942851
O -3.665292 2.810595 -0.095867
O -3.896062 2.171365 -2.375391
O 1.785045 0.523331 -1.061310
O 3.173635 -1.257840 -2.853491
O 0.884112 -2.124579 -1.535876
C -2.384336 0.934036 0.786120
C -0.899444 0.967316 0.328939
C -3.454610 1.352552 -0.221769
C -3.082095 1.193341 -1.713062
C -0.743648 0.662707 -1.181451
C -1.362337 -1.001424 1.688796
C -4.110987 3.320857 -1.425543
C 0.618580 1.050409 -1.787672
C -1.122886 -2.432289 1.213106
C -1.420370 -0.846076 3.214957
C -3.218300 4.499649 -1.807544
C -5.610834 3.616731 -1.415920
C 3.313638 -1.532238 -0.013721
C 2.762051 -1.294206 1.254269
C 4.625201 -1.985148 -0.232299
C 3.589281 -1.549760 2.371526
C 5.422261 -2.234565 0.904469
C 4.918432 -2.025305 2.217253
C 5.794668 -2.299027 3.425559
H -2.511406 1.526573 1.713326
H -0.410914 1.923273 0.582836
H -4.390642 0.800767 -0.003108
H -3.304160 0.201621 -2.146219
H -0.973644 -0.404594 -1.371785
H 0.748199 2.147425 -1.723204
H 0.645972 0.763469 -2.855980
H -0.259995 -2.872180 1.742562
H -2.015213 -3.046612 1.425009
H -0.908239 -2.451841 0.133366
H -1.698302 0.183629 3.497132
H -2.162690 -1.544598 3.638743
H -0.432580 -1.070307 3.653758
H -3.524569 4.904323 -2.787276
H -2.171983 4.162468 -1.869260
H -3.304030 5.297689 -1.049489
H -5.824496 4.470489 -0.750583
H -6.173474 2.737291 -1.061120
H -5.951963 3.864917 -2.435683
H 1.745153 -0.897198 1.360000
H 5.005372 -2.128855 -1.248576
H 3.195626 -1.365563 3.377517
H 6.449354 -2.592694 0.769353
H 5.267066 -2.080904 4.369041
H 6.115590 -3.357019 3.453819
H 6.712617 -1.682807 3.400714


