%chk=000008267.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008267

0 1
 S   -4.344100     -0.8483000      7.1000002E-02
 O  -0.5495000      0.2105000     -0.3832000    
 O   -1.548700      -1.847600     -0.1100000    
 N   -6.332100       1.195300      0.1020000    
 C    1.883700      0.6249000     -0.5772000    
 C    3.112000     -0.1923000     -7.3299997E-02
 C    2.403500     -0.4995000       1.273100    
 C   0.7231000     -0.4084000     -0.4548000    
 C    1.695000       1.686400      0.5434000    
 C    1.068800      -1.156800      0.8460000    
 C    2.043200      0.9005000       1.818800    
 C    1.985200       1.247000      -1.957200    
 C    4.423600      0.6053000      7.3899999E-02
 C    3.464700      -1.445500     -0.8994000    
 C   -1.622500     -0.6307000     -0.2066000    
 C   -2.883800      0.1943000     -0.1557000    
 C   -5.522200      0.3649000      8.9299999E-02
 H    2.974600      -1.104600       1.981100    
 H   0.7226000      -1.090400      -1.314100    
 H   0.6800000       2.094400      0.5861000    
 H    2.371000       2.539600      0.4189000    
 H    1.216600      -2.224100      0.6485000    
 H   0.3100000      -1.067000       1.630500    
 H    2.890600       1.358500       2.339500    
 H    1.203400      0.8742000       2.521100    
 H    2.825000       1.946800      -2.018300    
 H    2.129800      0.4835000      -2.728300    
 H    1.073000       1.800600      -2.204100    
 H    5.174200      8.0000004E-03  0.6046000    
 H    4.326600       1.544700      0.6217000    
 H    4.834700      0.8574000     -0.9104000    
 H    3.867600      -1.161800      -1.878300    
 H    2.626800      -2.119600      -1.088000    
 H    4.230300      -2.037000     -0.3838000    
 H   -2.976500      0.7456000      -1.096700    
 H   -2.806200      0.8946000      0.6820000    


%chk=000008267-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000008267

0 1
S -4.438279 -0.858236 -0.575433
O -0.577965 0.224076 -0.115006
O -1.662939 -1.772479 -0.679611
N -6.579209 1.115566 -0.125702
C 1.863317 0.622732 -0.503390
C 3.149200 -0.210997 -0.064468
C 2.579909 -0.499898 1.375216
C 0.764831 -0.447012 -0.247201
C 1.757084 1.682249 0.646234
C 1.202109 -1.162759 1.069616
C 2.286670 0.929139 1.919231
C 1.845465 1.214650 -1.915023
C 4.454070 0.619738 -0.072844
C 3.417918 -1.486407 -0.904474
C -1.687265 -0.561996 -0.362735
C -2.948447 0.272331 -0.190243
C -5.682960 0.337935 -0.300912
H 3.231348 -1.108090 2.025233
H 0.666378 -1.149819 -1.092251
H 0.717865 2.030583 0.763264
H 2.373428 2.566606 0.405374
H 1.270791 -2.253616 0.924819
H 0.474767 -0.981153 1.880463
H 3.198751 1.402541 2.323265
H 1.541448 0.906300 2.734341
H 2.685401 1.918667 -2.059478
H 1.921288 0.429015 -2.690554
H 0.908803 1.774013 -2.095402
H 5.263910 0.055586 0.427309
H 4.360291 1.592260 0.437371
H 4.782270 0.816450 -1.110746
H 3.636458 -1.220697 -1.956094
H 2.583543 -2.207266 -0.907563
H 4.305343 -2.015144 -0.509017
H -2.955145 1.126534 -0.884720
H -3.036446 0.641998 0.843230


