%chk=000283221.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283221

0 1
S -2.426421 -1.297207 0.070590
O -0.147038 -0.439073 -1.764428
O -3.179075 -0.789088 1.200056
O -2.667590 -0.715089 -1.249083
C -0.692727 -1.205208 0.454740
C -0.176132 -2.618930 0.161972
C 0.050778 -0.132016 -0.378222
C -2.631886 -3.048476 -0.035653
C -1.299430 -3.640326 0.416813
C 1.556463 -0.236046 -0.142110
C -0.414429 1.296770 -0.107867
C 2.094168 0.122129 1.102714
C -0.147120 2.259152 -1.095464
C 2.402466 -0.686768 -1.163514
C -1.052860 1.683322 1.075945
C 3.469767 0.018187 1.323828
C -0.519985 3.590354 -0.902287
C 3.778282 -0.787748 -0.937970
C -1.425808 3.018444 1.267078
C 4.313430 -0.438752 0.305570
C -1.160555 3.972788 0.281482
H -0.545204 -0.973430 1.538379
H 0.715319 -2.847678 0.775305
H 0.170414 -2.676620 -0.895536
H -2.886117 -3.368901 -1.066165
H -3.474064 -3.418514 0.579110
H -1.085069 -4.586293 -0.116818
H -1.341455 -3.908300 1.491626
H -1.094574 -0.227055 -2.056076
H 1.445441 0.495880 1.893500
H 0.353536 1.954217 -2.017561
H 1.978483 -0.948670 -2.136947
H -1.287320 0.957388 1.855572
H 3.885886 0.299126 2.289645
H -0.313422 4.329780 -1.674078
H 4.433077 -1.135709 -1.735004
H -1.932877 3.308937 2.186106
H 5.384683 -0.517070 0.480048
H -1.454733 5.009891 0.432006


%chk=000283221-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000283221

0 1
S -2.570245 -1.304245 0.100061
O -0.216757 -0.417830 -1.838349
O -3.424036 -0.896647 1.434615
O -2.919235 -0.603166 -1.358099
C -0.593917 -1.200009 0.463428
C -0.137905 -2.638267 0.185502
C 0.049786 -0.097754 -0.427710
C -2.561538 -3.242783 -0.099823
C -1.252373 -3.650311 0.581206
C 1.576357 -0.219035 -0.219628
C -0.424519 1.334892 -0.104248
C 2.156484 0.199074 1.004559
C 0.044611 2.370411 -0.954841
C 2.399145 -0.775307 -1.226688
C -1.274516 1.669883 0.976871
C 3.543693 0.055014 1.221676
C -0.324158 3.710804 -0.729025
C 3.790025 -0.909363 -1.011278
C -1.646135 3.016596 1.202780
C 4.366263 -0.502150 0.213870
C -1.171928 4.040750 0.356384
H -0.589127 -0.949293 1.537132
H 0.783301 -2.845315 0.757037
H 0.102739 -2.736067 -0.888764
H -2.571974 -3.396532 -1.189448
H -3.487119 -3.584757 0.383449
H -0.963175 -4.667899 0.262640
H -1.386031 -3.668192 1.678765
H -1.213056 -0.309869 -1.972364
H 1.529565 0.664814 1.774631
H 0.694444 2.108070 -1.796410
H 1.939691 -1.073204 -2.173113
H -1.688902 0.905634 1.643109
H 3.984259 0.386294 2.168753
H 0.044915 4.497910 -1.396107
H 4.423233 -1.329392 -1.801083
H -2.316607 3.256414 2.035303
H 5.444358 -0.607921 0.379237
H -1.463311 5.082144 0.533275


