%chk=000086075.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086075

0 1
 S   -4.290100      7.0100002E-02  4.1600000E-02
 O    1.918500      -2.098300     -0.6700000    
 O    3.172600       2.523200      0.1451000    
 N    3.954800     -0.1565000     -0.2750000    
 C    1.680700     -0.9738000      0.1815000    
 C    2.535000      0.2291000     -0.2781000    
 C   0.1901000     -0.7138000      0.1465000    
 C    2.368700       1.453000      0.6316000    
 C  -0.5506000     -0.8746000       1.304200    
 C  -0.3988000     -0.3201000      -1.042400    
 C   -1.924300     -0.6343000       1.272000    
 C   -1.772400     -7.9599999E-02  -1.074600    
 C   -2.535300     -0.2366000      8.2699999E-02
 C   -4.348800       1.812100     -0.4650000    
 H    1.989400      -1.272500       1.191900    
 H    2.303000      0.5046000      -1.313300    
 H    2.676200       1.236500       1.660400    
 H    1.331800       1.802000      0.6552000    
 H  -8.6000003E-02  -1.183000       2.236000    
 H   0.1777000     -0.2045000      -1.955100    
 H    4.078500     -0.9920000     -0.8461000    
 H    4.237300     -0.4181000      0.6691000    
 H    1.322800      -2.816800     -0.3961000    
 H   -2.502300     -0.7615000       2.184000    
 H   -2.228300      0.2201000      -2.014900    
 H    2.874900       2.725000     -0.7584000    
 H   -3.758500       2.427300      0.2194000    
 H   -5.385800       2.157400     -0.4392000    
 H   -3.968900       1.932800      -1.482700    


%chk=000086075-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086075

0 1
S -4.286409 0.702271 0.725928
O 1.876403 -1.835543 -1.130619
O 3.583929 2.315280 0.663917
N 4.014326 -0.121213 -0.416653
C 1.651842 -0.946098 0.034655
C 2.592872 0.260664 -0.221048
C 0.188780 -0.558149 0.173577
C 2.557924 1.310848 0.917973
C -0.465103 -0.614449 1.430539
C -0.550085 -0.111425 -0.950931
C -1.812284 -0.225164 1.566586
C -1.900916 0.277102 -0.826987
C -2.540993 0.226332 0.435600
C -4.837691 1.290791 -0.967990
H 1.983396 -1.461805 0.965521
H 2.266545 0.751854 -1.157372
H 2.729038 0.808019 1.900147
H 1.584108 1.825355 0.956346
H 0.082133 -0.964108 2.314950
H -0.064517 -0.077273 -1.932832
H 4.163239 -0.606832 -1.308347
H 4.378491 -0.692070 0.359933
H 1.212398 -2.570079 -1.096651
H -2.298462 -0.272560 2.547471
H -2.440983 0.614802 -1.716889
H 4.301529 1.800693 0.181603
H -4.226808 2.144120 -1.301462
H -5.881007 1.616086 -0.835800
H -4.799796 0.469749 -1.700865


