%chk=000085330.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085330

0 1
 S   0.9233000      0.3165000     -0.6103000    
 O    1.286000     -0.6919000      -1.595900    
 O    1.145700       1.725900     -0.9030000    
 C  -0.7564000      8.3099999E-02 -0.1949000    
 C    1.804200     -4.5699999E-02  0.8918000    
 C   -1.507600       1.150100      0.2978000    
 C   -1.346600      -1.170500     -0.3545000    
 C    3.255900      0.1385000      0.6115000    
 C   -2.849200      0.9634000      0.6312000    
 C   -2.688200      -1.357200     -2.1299999E-02
 C   -3.439500     -0.2902000      0.4716000    
 C    4.172500     -0.8220000      0.7759000    
 H    1.471100      0.6548000       1.662600    
 H    1.559100      -1.068700       1.191800    
 H   -1.066200       2.133000      0.4364000    
 H  -0.7790000      -2.017400     -0.7294000    
 H    3.593500       1.119100      0.2852000    
 H   -3.433800       1.793600       1.016600    
 H   -3.147600      -2.333700     -0.1437000    
 H   -4.483800     -0.4358000      0.7319000    
 H    5.218800     -0.6239000      0.5705000    
 H    3.899000      -1.815100       1.114400    


%chk=000085330-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085330

0 1
S 0.960381 0.236679 -0.637793
O 1.340015 -0.983451 -1.661129
O 1.195754 1.810808 -1.023378
C -0.871088 0.034737 -0.167634
C 1.957293 -0.111869 1.088148
C -1.573090 1.178869 0.245373
C -1.452805 -1.236137 -0.305513
C 3.390983 0.198374 0.876081
C -2.942607 1.026859 0.566580
C -2.823273 -1.367916 0.020576
C -3.560177 -0.242286 0.460258
C 4.327802 -0.753824 0.613438
H 1.428981 0.557485 1.784102
H 1.728144 -1.173684 1.263910
H -1.072801 2.152724 0.279683
H -0.862386 -2.077069 -0.684900
H 3.675676 1.257225 0.901992
H -3.524532 1.896628 0.889054
H -3.313467 -2.342201 -0.077505
H -4.621852 -0.351579 0.707084
H 5.375843 -0.486935 0.440816
H 4.068407 -1.817536 0.556960


