%chk=000108836.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108836

0 1
 S    2.831100     -0.5855000     -3.1999999E-03
 O    2.645500      -1.920600     -0.5541000    
 O    3.858700      0.2876000     -0.5532000    
 O   -3.376600      0.1359000      0.4354000    
 O   -2.481700      -1.683000     -0.6554000    
 N    3.066000     -0.7133000       1.684500    
 C    1.300700      0.2529000     -6.3500002E-02
 C   0.1086000     -0.4712000     -8.6999997E-02
 C   -1.113700      0.1992000     -0.1350000    
 C    1.270200       1.647300     -8.8000000E-02
 C   -1.144000       1.593500     -0.1595000    
 C   4.8000000E-02   2.317600     -0.1360000    
 C   -2.356800     -0.5552000     -0.1598000    
 C   -4.656100     -0.5053000      0.4748000    
 H   0.1260000      -1.557800     -5.8100000E-02
 H    2.185800       2.231500     -6.4599998E-02
 H   -2.080300       2.143000     -0.2092000    
 H   2.4599999E-02   3.403300     -0.1565000    
 H    2.973200      -1.643800       2.109600    
 H    3.800600     -0.1339000       2.108800    
 H   -5.014100     -0.6948000     -0.5414000    
 H   -5.358100      0.1659000      0.9765000    
 H   -4.592800      -1.438200       1.042700    


%chk=000108836-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108836

0 1
S 2.902203 -0.576984 -0.068429
O 2.650180 -2.056883 -0.695416
O 4.002861 0.474914 -0.648312
O -3.556413 0.225611 0.121305
O -2.451150 -1.825441 0.197550
N 3.302485 -0.812184 1.711781
C 1.242438 0.321435 -0.012396
C 0.075712 -0.446865 0.047848
C -1.162459 0.244462 0.068453
C 1.260944 1.724488 -0.067340
C -1.186953 1.662320 0.024454
C 0.016576 2.396019 -0.047574
C -2.412010 -0.573596 0.135225
C -4.844144 -0.507431 0.182113
H 0.096584 -1.541746 0.058634
H 2.211333 2.262291 -0.145961
H -2.153079 2.173554 0.039405
H -0.009239 3.489169 -0.091481
H 3.338336 -1.826882 1.904188
H 4.192849 -0.325072 1.906443
H -4.938010 -1.181722 -0.685354
H -5.613802 0.276233 0.162626
H -4.900440 -1.100592 1.110039


