%chk=000135370.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135370

0 1
 S    7.423100     -0.3036000      0.2303000    
 O    7.546700       1.265300     -0.1080000    
 O    7.820000      -1.059500      -1.006700    
 C   -3.663300      -1.841200      5.2400000E-02
 C   -5.213900      0.7967000     -1.1300000E-02
 C   -5.149300      -1.700500      0.4510000    
 C   -5.839800     -0.5831000     -0.3125000    
 C   -2.963200     -0.4778000     -1.1600000E-02
 C   -3.681100      0.7431000     -4.9300000E-02
 C   -3.552400      -2.520000      -1.330900    
 C   -3.015700      -2.773300       1.104200    
 C   -5.783000       1.774300      -1.067200    
 C   -5.657600       1.280900       1.387000    
 C   -1.552200     -0.4320000     -7.3200002E-02
 C   -2.951900       1.952900     -8.5299999E-02
 C  -0.8584000      0.7753000     -0.1281000    
 C   -1.559100       1.969900     -0.1257000    
 C   0.5949000      0.7817000     -0.1835000    
 C    1.231100       1.944500     -0.9178000    
 C    1.389000     -0.1768000      0.3683000    
 C    2.857900     -0.2074000      0.3346000    
 C    3.502900     -0.8485000     -0.7128000    
 C    3.576500      0.4056000       1.350900    
 C    4.897100     -0.8777000     -0.7447000    
 C    4.970800      0.3766000       1.319000    
 C    5.631100     -0.2650000      0.2710000    
 H   -5.238700      -1.511500       1.528200    
 H   -5.680600      -2.643800      0.2691000    
 H   -5.792300     -0.7968000      -1.387800    
 H   -6.907400     -0.5779000     -5.7000000E-02
 H   -4.099400      -3.469600      -1.350100    
 H   -3.950400      -1.887100      -2.131600    
 H   -2.510000      -2.741200      -1.589100    
 H   -1.996600      -3.069300      0.8342000    
 H   -2.969800      -2.289600       2.087100    
 H   -3.592400      -3.699600       1.214100    
 H   -5.523300       2.817100     -0.8570000    
 H   -5.408800       1.536100      -2.069900    
 H   -6.878000       1.723200      -1.098100    
 H   -5.245600      0.6566000       2.187300    
 H   -5.325500       2.307400       1.581800    
 H   -6.749500       1.270000       1.481000    
 H   -1.003800      -1.370000     -0.1092000    
 H   -3.466600       2.910400     -7.2499998E-02
 H   -1.065200       2.937000     -0.1409000    
 H    1.237200       2.841500     -0.2889000    
 H   0.6871000       2.166200      -1.843700    
 H    2.264200       1.757900      -1.224400    
 H   0.9572000      -1.009300      0.9192000    
 H    2.942300      -1.329600      -1.510100    
 H    3.073800      0.9083000       2.172900    
 H    5.384000      -1.384600      -1.573000    
 H    5.527900      0.8573000       2.118900    
 H    8.303000       1.425600     -0.7199000    


%chk=000135370-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135370

0 1
S 7.456717 -0.819359 0.200812
O 7.739248 0.610629 1.440764
O 7.948086 -0.374548 -1.299778
C -3.557564 -1.814653 0.239746
C -5.306648 0.760681 0.072120
C -5.011912 -1.695218 0.777610
C -5.858714 -0.690230 -0.018214
C -2.966354 -0.410165 -0.027107
C -3.774781 0.765473 -0.124974
C -3.546615 -2.631220 -1.089039
C -2.724607 -2.587460 1.302672
C -6.020593 1.607585 -1.020614
C -5.636974 1.371560 1.469135
C -1.567751 -0.293674 -0.228747
C -3.122713 2.000629 -0.387321
C -0.915288 0.938395 -0.495282
C -1.734286 2.098163 -0.576246
C 0.567655 0.993820 -0.675717
C 1.112500 1.972674 -1.703076
C 1.365710 0.178228 0.100538
C 2.824899 -0.019028 0.077330
C 3.647393 0.154034 -1.078709
C 3.456080 -0.462895 1.281746
C 5.035548 -0.077489 -1.027580
C 4.842961 -0.690007 1.350109
C 5.611727 -0.487040 0.186771
H -4.979785 -1.393113 1.843294
H -5.482011 -2.698007 0.748470
H -5.897237 -0.996870 -1.082556
H -6.903951 -0.695187 0.348578
H -3.930043 -3.654132 -0.911609
H -4.172155 -2.156292 -1.865801
H -2.521161 -2.713296 -1.492638
H -1.714635 -2.849112 0.939838
H -2.614437 -1.993936 2.228671
H -3.237408 -3.533935 1.559045
H -5.801997 2.686385 -0.929305
H -5.721613 1.281748 -2.033580
H -7.116473 1.484791 -0.928244
H -5.198311 0.776080 2.289629
H -5.237594 2.398565 1.554926
H -6.732645 1.415138 1.618802
H -0.955265 -1.201862 -0.207132
H -3.720354 2.917084 -0.446533
H -1.288742 3.082816 -0.753531
H 0.474167 2.868802 -1.775764
H 1.124731 1.520387 -2.714819
H 2.136748 2.301490 -1.462723
H 0.856027 -0.378259 0.900195
H 3.195161 0.430908 -2.033811
H 2.843406 -0.610455 2.178891
H 5.679137 0.053403 -1.905757
H 5.311681 -0.998202 2.290206
H 8.714036 0.591275 1.667012


