%chk=000100987.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100987

0 1
 S   0.9581000      0.6185000     -0.6675000    
 O    1.893700     -9.8999999E-02  0.4703000    
 O    1.141800     -8.1000000E-02  -1.929000    
 O    1.176800       2.054000     -0.5709000    
 C  -0.6848000      0.2993000     -0.1558000    
 C   -1.224400     -0.9853000     -0.2185000    
 C   -1.458100       1.358100      0.3202000    
 C   -2.537400      -1.211300      0.1949000    
 C  -0.4240000      -2.140400     -0.7250000    
 C   -2.771000       1.132200      0.7338000    
 C    3.306700     -2.8999999E-02  0.3553000    
 C   -3.310600     -0.1525000      0.6710000    
 C    3.933300     -0.7637000       1.521100    
 H   -1.069100       2.369800      0.3846000    
 H   -2.974600      -2.205300      0.1508000    
 H  -0.3376000      -2.106100      -1.815100    
 H   0.5667000      -2.191100     -0.2655000    
 H  -0.9116000      -3.091200     -0.4777000    
 H    3.618500     -0.4882000     -0.5884000    
 H    3.622100       1.019500      0.3601000    
 H   -3.373300       1.956200       1.105200    
 H   -4.333000     -0.3281000      0.9927000    
 H    5.024800     -0.7300000       1.463300    
 H    3.615700     -0.3213000       2.471100    
 H    3.611900      -1.810400       1.534400    


%chk=000100987-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100987

0 1
S 0.943153 0.729357 -0.799383
O 1.889398 -0.124905 0.570717
O 1.307508 -0.007010 -2.199234
O 1.165609 2.331651 -0.684459
C -0.784574 0.295563 -0.171738
C -1.249019 -1.040126 -0.217638
C -1.525353 1.393843 0.294584
C -2.576102 -1.229068 0.253857
C -0.421314 -2.207660 -0.714598
C -2.840446 1.160766 0.752287
C 3.364777 -0.030737 0.387117
C -3.359741 -0.153444 0.729364
C 3.963070 -0.826554 1.550107
H -1.080790 2.394404 0.292600
H -2.990717 -2.243314 0.245507
H -0.142905 -2.076642 -1.774988
H 0.523736 -2.284541 -0.147502
H -0.979395 -3.151528 -0.605298
H 3.644524 -0.465961 -0.591338
H 3.672019 1.031738 0.422258
H -3.445312 1.994822 1.121119
H -4.378932 -0.343270 1.082943
H 5.066745 -0.795780 1.487616
H 3.654833 -0.397159 2.518166
H 3.639829 -1.880746 1.513334


