%chk=000080250.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080250

0 1
 S   -5.281600     -0.7557000     -3.2099999E-02
 O   -6.263500      0.5469000      7.9499997E-02
 O   -5.509100      -1.347400      -1.342600    
 O   -5.443300      -1.547700       1.177200    
 C    3.900200     -0.2027000      3.5999998E-02
 C    2.807000      0.8697000      7.0600003E-02
 C    5.318500      0.3708000      6.4000003E-02
 C    1.367200      0.3589000     -4.0399998E-02
 C    6.366400     -0.7372000     -6.3199997E-02
 C   0.3188000       1.469900      5.7700001E-02
 C    7.784900     -0.1709000     -2.4999999E-03
 C   -1.082400      0.9128000      3.5100002E-02
 C    8.829000      -1.272300     -9.3900003E-02
 C   -1.732000      0.7521000      -1.179200    
 C   -1.698100      0.5708000       1.229700    
 C   -3.659400     -0.1110000     -5.5000000E-03
 C   -3.028200      0.2373000      -1.199700    
 C   -2.994300      5.5799998E-02   1.209300    
 H    3.772600     -0.8037000     -0.8730000    
 H    3.763200     -0.8824000      0.8859000    
 H    2.985100       1.581000     -0.7459000    
 H    2.909400       1.439000       1.003300    
 H    5.469900      0.9223000      0.9996000    
 H    5.442200       1.086600     -0.7577000    
 H    1.249800     -0.1781000     -0.9903000    
 H    1.196500     -0.3791000      0.7540000    
 H    6.224100      -1.273100      -1.009400    
 H    6.227900      -1.466000      0.7448000    
 H   0.4677000       2.047700      0.9788000    
 H   0.4492000       2.183200     -0.7661000    
 H    7.926600      0.3799000      0.9347000    
 H    7.937200      0.5400000     -0.8229000    
 H    8.735100      -1.824600      -1.034400    
 H    9.835600     -0.8450000     -4.9899999E-02
 H    8.724600      -1.981600      0.7333000    
 H   -1.248500       1.020200      -2.114300    
 H   -1.188200      0.6969000       2.180500    
 H   -3.529100      0.1224000      -2.156800    
 H   -3.468000     -0.2013000       2.152500    
 H   -6.191700       1.195100     -0.6602000    


%chk=000080250-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080250

0 1
S -5.359886 -0.805648 -0.123965
O -6.268154 0.816257 -0.209582
O -5.581939 -1.582905 -1.526117
O -5.728468 -1.524337 1.278813
C 3.925637 -0.171341 -0.042877
C 2.862011 0.940985 0.096453
C 5.374894 0.355801 0.060204
C 1.415066 0.407738 0.012416
C 6.440968 -0.752980 -0.087842
C 0.352732 1.538045 0.136784
C 7.890252 -0.226026 0.021045
C -1.067559 1.004074 0.073922
C 8.949268 -1.339540 -0.128678
C -1.681505 0.733103 -1.178874
C -1.787878 0.717241 1.263763
C -3.645877 -0.068588 -0.046120
C -2.982619 0.193877 -1.255666
C -3.091227 0.177493 1.219327
H 3.791609 -0.687721 -1.016256
H 3.759081 -0.939300 0.741147
H 3.020777 1.702347 -0.695986
H 3.004538 1.465803 1.064332
H 5.510735 0.866026 1.036897
H 5.540266 1.129004 -0.719344
H 1.268259 -0.125507 -0.948548
H 1.245358 -0.340311 0.812821
H 6.309814 -1.261276 -1.066136
H 6.275611 -1.528852 0.689027
H 0.516072 2.073897 1.091578
H 0.521299 2.270131 -0.677265
H 8.020465 0.281557 0.998790
H 8.054712 0.549242 -0.755198
H 8.857313 -1.843990 -1.109143
H 9.975865 -0.936658 -0.050863
H 8.828268 -2.110006 0.656274
H -1.138217 0.952819 -2.105144
H -1.326397 0.922526 2.236337
H -3.461551 -0.025755 -2.214839
H -3.652738 -0.054922 2.129550
H -7.245556 0.607197 -0.274537


