%chk=000083834.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083834

0 1
 S   -1.651900      -2.612600      -1.024900    
 O    1.559600      -1.873400      0.5985000    
 O   -2.770800       1.440100      0.9582000    
 N    1.388300       1.632300     -0.3955000    
 C  -0.3436000     -0.4909000      0.1574000    
 C  -0.8545000      0.7501000     -0.2067000    
 C    1.032200     -0.6714000      0.2454000    
 C    1.847800      0.4120000     -3.8800001E-02
 C   -1.266800      -1.628400      0.4538000    
 C   -2.318600      0.9998000     -0.3172000    
 C   4.5499999E-02   1.769900     -0.4704000    
 C    3.332800      0.2726000      4.0300000E-02
 H  -0.8211000      -2.301500       1.195500    
 H   -2.201900      -1.298600      0.9156000    
 H   -2.525200       1.795300      -1.041800    
 H   -2.903700      0.1351000     -0.6381000    
 H  -0.2903000       2.761700     -0.7575000    
 H    3.690600     -0.4816000     -0.6679000    
 H    3.824700       1.218200     -0.2136000    
 H    3.644500      4.8000002E-03   1.054900    
 H    2.528600      -1.842400      0.6155000    
 H  -0.3959000      -3.005900      -1.283300    
 H   -2.462300      0.8134000       1.634100    


%chk=000083834-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000083834

0 1
S -1.466668 -2.857874 -1.049077
O 1.496623 -1.944429 0.506442
O -2.936980 1.579348 1.003169
N 1.406350 1.667301 -0.381727
C -0.390249 -0.494512 0.149150
C -0.884302 0.797451 -0.193288
C 1.019513 -0.654182 0.201459
C 1.896528 0.433690 -0.058843
C -1.268931 -1.681444 0.449750
C -2.367837 1.100755 -0.279602
C 0.055418 1.827041 -0.449262
C 3.400880 0.264970 0.006145
H -0.852751 -2.285802 1.268870
H -2.303523 -1.400682 0.695544
H -2.544781 1.940647 -0.970189
H -2.935105 0.224613 -0.651356
H -0.293868 2.831531 -0.714129
H 3.773883 -0.466565 -0.738908
H 3.868103 1.236456 -0.214705
H 3.746971 -0.056297 1.009492
H 2.485185 -1.952740 0.548306
H -0.142487 -3.264787 -1.050009
H -2.673972 0.954111 1.726267


