%chk=000163000.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163000

0 1
 S  -4.6999999E-03  -1.805200      -1.177900    
 S    3.804800       1.885700      3.2000002E-02
 S   -3.841300       1.888600     -6.6699997E-02
 O   3.2699998E-02  -1.034100      -2.412600    
 O  -6.5700002E-02  -3.260000      -1.234800    
 O    4.916900       1.674100      -1.147600    
 O   -3.108100       2.874800       1.011700    
 O    2.776900       2.764500     -0.5065000    
 O    4.507300       2.230300       1.258300    
 O   -3.445300       2.340400      -1.392500    
 O   -5.247000       1.790400      0.2944000    
 C    1.400300      -1.328100     -0.2574000    
 C   -1.455100      -1.320400     -0.2816000    
 C    1.969700     -7.0299998E-02 -0.4558000    
 C   -1.995600     -6.8700001E-02 -0.5067000    
 C    3.092700      0.3106000      0.2788000    
 C   -3.136300      0.3134000      0.1993000    
 C    1.954000      -2.205100      0.6754000    
 C   -2.012000      -2.204300      0.6229000    
 C    3.646200     -0.5665000       1.211700    
 C   -3.714800     -0.5635000       1.117100    
 C    3.076900      -1.824300       1.409800    
 C   -3.152500      -1.822300       1.328900    
 H    1.538800      0.6143000      -1.180900    
 H   -1.533500      0.6164000      -1.210600    
 H    1.523400      -3.187100      0.8498000    
 H   -1.584500      -3.184300      0.8101000    
 H    4.524700     -0.2952000       1.790200    
 H   -4.598400     -0.2853000       1.684600    
 H    3.508200      -2.507300       2.135800    
 H   -3.600400      -2.503500       2.046500    
 H    4.559800       1.372400      -2.016000    
 H   -2.131800       2.965500      0.9057000    


%chk=000163000-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163000

0 1
S -0.028502 -1.960089 -1.234618
S 3.915736 1.909448 -0.025836
S -3.985761 1.920398 -0.093922
O -0.016287 -1.093393 -2.617524
O -0.033149 -3.594308 -1.163707
O 5.068945 1.343924 -1.360637
O -2.883705 2.813858 1.100283
O 2.816346 2.907907 -0.664220
O 4.777767 2.338799 1.272409
O -3.642695 2.421854 -1.591499
O -5.501728 1.929675 0.466041
C 1.480748 -1.390051 -0.219182
C -1.546389 -1.380441 -0.237818
C 2.021732 -0.127105 -0.501622
C -2.070125 -0.109939 -0.519030
C 3.153958 0.212733 0.254258
C -3.207929 0.237009 0.225374
C 2.026595 -2.291999 0.707810
C -2.110285 -2.280759 0.680273
C 3.744300 -0.619916 1.218525
C -3.821353 -0.596834 1.173691
C 3.169869 -1.893479 1.439268
C -3.263624 -1.878166 1.393196
H 1.599064 0.535862 -1.265207
H -1.645812 0.542516 -1.290911
H 1.580670 -3.284808 0.831154
H -1.675889 -3.278665 0.803651
H 4.621595 -0.280461 1.778372
H -4.718600 -0.261450 1.703830
H 3.616924 -2.572863 2.170849
H -3.729373 -2.558932 2.111724
H 5.539618 2.148643 -1.727313
H -3.046361 3.796931 0.997738


