%chk=000083768.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083768

0 1
 S    2.479300      0.1948000      -1.420600    
 O  -0.8047000       2.055400      5.7700001E-02
 N  -1.9800000E-02 -0.1226000      0.4842000    
 C  -0.5483000      -1.463800      0.4051000    
 C   -1.694400      -1.324500     -0.5768000    
 C   -2.179900      0.1056000     -0.3722000    
 C  -0.9313000      0.8401000      5.7000000E-02
 C    1.270000      0.1498000       1.080500    
 C    2.429200     -0.4347000      0.2850000    
 H  -0.8984000      -1.755000       1.400800    
 H   0.2009000      -2.176100      5.2000001E-02
 H   -2.480600      -2.068600     -0.4220000    
 H   -1.319900      -1.437800      -1.602000    
 H   -2.918200      0.1665000      0.4334000    
 H   -2.589500      0.5317000      -1.291300    
 H    1.393300       1.234100       1.185500    
 H    1.261800     -0.2721000       2.091900    
 H    3.375000     -0.1753000      0.7713000    
 H    2.372300      -1.526500      0.2441000    
 H    1.291900     -0.2988000      -1.801700    


%chk=000083768-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083768

0 1
S 2.743679 0.109146 -1.435183
O -0.757906 2.071874 0.128874
N -0.000961 -0.152914 0.389629
C -0.547445 -1.526289 0.346340
C -1.808698 -1.378429 -0.552949
C -2.229804 0.102076 -0.376993
C -0.944846 0.826706 0.053491
C 1.275266 0.178961 1.031349
C 2.492358 -0.472647 0.348855
H -0.807245 -1.872854 1.369288
H 0.184692 -2.236401 -0.077783
H -2.599695 -2.090960 -0.267924
H -1.538584 -1.573413 -1.605575
H -2.981328 0.232311 0.424652
H -2.641029 0.562816 -1.289307
H 1.360869 1.280230 1.006784
H 1.255383 -0.142636 2.095861
H 3.412969 -0.177202 0.878202
H 2.424523 -1.574049 0.357328
H 1.396503 0.055873 -1.763040


