%chk=000035946.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035946

0 1
 S  -0.8392000       1.689700      0.3021000    
 O   -1.916000       2.480200     -0.2636000    
 O  -0.2482000       2.042200       1.578300    
 O  -0.5614000      -2.190000      0.6475000    
 N   -1.272100      1.9099999E-02  0.3073000    
 C   0.4335000       1.613700     -0.9237000    
 C    1.453600      0.6020000     -0.4996000    
 C    1.118300     -0.6374000      7.1000002E-02
 C  -0.2829000      -1.028700      0.3739000    
 C   -2.679600     -0.2677000      0.7125000    
 C    2.807100      0.8822000     -0.7565000    
 C    2.130400      -1.556300      0.3929000    
 C    3.807000     -3.4499999E-02 -0.4330000    
 C    3.468200      -1.253200      0.1430000    
 C   -3.408600     -0.9150000     -0.3794000    
 C   -4.010100      -1.446200      -1.272400    
 H   0.8571000       2.620800     -0.9954000    
 H  -1.4000000E-02   1.342400      -1.884500    
 H   -2.671300     -0.9060000       1.603600    
 H   -3.198500      0.6499000       1.008700    
 H    3.092700       1.825500      -1.217000    
 H    1.896400      -2.516900      0.8454000    
 H    4.847400      0.2023000     -0.6348000    
 H    4.243900      -1.969900      0.3961000    
 H   -4.543100      -1.917400      -2.064800    


%chk=000035946-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035946

0 1
S -0.807683 1.839345 0.414367
O -2.163103 2.605265 -0.042773
O -0.052049 2.283695 1.774253
O -0.613178 -2.231230 0.625158
N -1.266003 -0.027621 0.425455
C 0.461495 1.575856 -1.047031
C 1.490710 0.593172 -0.577570
C 1.128102 -0.631858 0.062583
C -0.287282 -1.028179 0.391014
C -2.687160 -0.341982 0.721138
C 2.858757 0.883274 -0.798396
C 2.141096 -1.552101 0.423920
C 3.860283 -0.041598 -0.431580
C 3.499116 -1.265422 0.176604
C -3.388932 -0.939656 -0.430199
C -4.004835 -1.430413 -1.377149
H 0.857513 2.574486 -1.284956
H -0.226496 1.210713 -1.826618
H -2.728707 -1.033317 1.582367
H -3.183633 0.607393 0.999723
H 3.139245 1.831640 -1.270217
H 1.836248 -2.490069 0.898462
H 4.913468 0.194793 -0.615330
H 4.271338 -1.985731 0.465103
H -4.537709 -1.869654 -2.200727


