%chk=000083689.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083689

0 1
 S   -2.627100      0.7967000     -0.2019000    
 S    1.472400      0.1694000     -0.8763000    
 S   -1.005600       1.134500       1.012700    
 S   0.4637000       1.839100     -0.2337000    
 C   -2.361100     -0.9215000     -0.7008000    
 C    2.756700      6.8999999E-03  0.3873000    
 C   -2.337100      -1.831200      0.5129000    
 C    3.638100      -1.193800      9.9799998E-02
 H   -3.191500      -1.209100      -1.353800    
 H   -1.443300      -1.016700      -1.287300    
 H    3.371400      0.9127000      0.4012000    
 H    2.290300     -0.1147000       1.370200    
 H   -1.444700      -1.693200       1.129900    
 H   -3.225800      -1.702800       1.140200    
 H   -2.324900      -2.875500      0.1807000    
 H    3.061900      -2.125300      0.1017000    
 H    4.144300      -1.099200     -0.8670000    
 H    4.411300      -1.281900      0.8704000    


%chk=000083689-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000083689

0 1
S -2.841493 0.814994 -0.206492
S 1.748277 0.319758 -1.107278
S -1.041262 1.343145 1.050854
S 0.590924 2.122383 -0.382303
C -2.457648 -1.002033 -0.641352
C 2.870877 -0.011676 0.397235
C -2.489362 -1.935884 0.572173
C 3.776140 -1.209455 0.069022
H -3.246496 -1.248141 -1.376524
H -1.483394 -1.009086 -1.155584
H 3.449087 0.906243 0.585665
H 2.211981 -0.216436 1.256531
H -1.725202 -1.641454 1.313251
H -3.476684 -1.918932 1.065189
H -2.275776 -2.974868 0.256207
H 3.185894 -2.119978 -0.136659
H 4.418214 -1.004835 -0.805715
H 4.434925 -1.419345 0.931979


