%chk=000050603.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050603

0 1
 S   -3.563800      0.3951000      -1.068200    
 O    3.315800      -2.452700      0.5098000    
 O   -6.199100       1.267600       1.645300    
 O   -6.337600     -7.0100002E-02 -0.1867000    
 C   0.4043000     -0.4609000     -0.2454000    
 C   0.9745000      0.8389000     -0.2862000    
 C    1.176900      -1.606800      2.3900000E-02
 C    2.429800       1.006900     -3.9400000E-02
 C  -0.9856000     -0.6401000     -0.4798000    
 C    3.235200     -0.1166000      0.2333000    
 C    2.628400      -1.466900      0.2736000    
 C   -1.792900      0.4685000     -0.7513000    
 C   0.1204000       1.924100     -0.5633000    
 C   0.6042000      -2.884500      6.1799999E-02
 C   -1.547100      -1.925900     -0.4391000    
 C   -1.242900       1.742300     -0.7925000    
 C    3.077700       2.257600     -6.1799999E-02
 C  -0.7571000      -3.040100     -0.1701000    
 C    4.613500      3.4000000E-03  0.4709000    
 C    4.451700       2.380700      0.1740000    
 C    5.218800       1.254500      0.4404000    
 C   -4.161900      0.5779000      0.6231000    
 C   -5.663100      0.5472000      0.6277000    
 H   0.4905000       2.944100     -0.6093000    
 H    1.202300      -3.767500      0.2698000    
 H   -2.603500      -2.111000     -0.6124000    
 H   -1.851900       2.619100      -1.001700    
 H    2.535700       3.177000     -0.2639000    
 H   -1.204000      -4.029500     -0.1415000    
 H    5.229300     -0.8672000      0.6807000    
 H    4.918100       3.361500      0.1485000    
 H    6.284600       1.350300      0.6235000    
 H   -3.821600       1.540000       1.018500    
 H   -3.794300     -0.2307000       1.261200    
 H   -7.179500       1.233700       1.641100    


%chk=000050603-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000050603

0 1
S -3.610159 0.596517 -1.221915
O 3.252323 -2.511840 0.733411
O -6.136338 0.445530 1.966522
O -6.496245 0.351966 -0.331042
C 0.380180 -0.374047 -0.251477
C 1.027764 0.912801 -0.354454
C 1.124044 -1.551635 0.110175
C 2.478761 1.025162 -0.076024
C -1.039801 -0.504621 -0.520488
C 3.230186 -0.136287 0.291547
C 2.585014 -1.475004 0.402440
C -1.796204 0.674388 -0.862339
C 0.245930 2.023364 -0.723316
C 0.486837 -2.802420 0.190607
C -1.646244 -1.799894 -0.443899
C -1.148993 1.908397 -0.969920
C 3.173726 2.265364 -0.159160
C -0.897418 -2.928943 -0.093045
C 4.620430 -0.041585 0.560984
C 4.551986 2.350467 0.109498
C 5.285496 1.191844 0.472457
C -4.197449 0.536656 0.580601
C -5.707872 0.435160 0.631111
H 0.699249 3.013501 -0.821258
H 1.095277 -3.669296 0.468191
H -2.708988 -1.888648 -0.696444
H -1.728727 2.795537 -1.241898
H 2.640734 3.179602 -0.435644
H -1.377017 -3.911843 -0.045881
H 5.146322 -0.960925 0.837202
H 5.058979 3.318955 0.036970
H 6.358209 1.260838 0.680573
H -3.866605 1.448211 1.104752
H -3.748230 -0.332917 1.089876
H -7.129356 0.375545 1.995786


