%chk=000108009.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108009

0 1
 S   -1.584000     -0.2507000      0.3089000    
 O    1.159200       2.150300       1.247600    
 O   0.2458000       2.874400     -0.6971000    
 O   -4.629500     -5.7599999E-02  0.7023000    
 O    2.926200      -1.501500      -1.120700    
 N    1.688100     -0.2481000      0.4016000    
 C   0.9695000      0.5649000     -0.5475000    
 C  -0.3293000     -0.1030000      -1.006300    
 C   -2.894200      -1.012100     -0.6740000    
 C   0.7425000       1.975400     -2.9300001E-02
 C    2.608900      -1.215700      3.0900000E-02
 C   -4.134600      -1.277100      0.1648000    
 C    3.231300      -1.899100       1.218900    
 H    1.623400      0.6765000      -1.422400    
 H  -0.1170000      -1.106000      -1.392600    
 H  -0.7695000      0.4860000      -1.818600    
 H    1.495600     -0.1071000       1.389400    
 H   -3.144700     -0.3294000      -1.492500    
 H   -2.531600      -1.953000      -1.099300    
 H   -3.921300      -1.959600      0.9940000    
 H   -4.922400      -1.728500     -0.4468000    
 H    3.805400      -2.768000      0.8855000    
 H    3.899000      -1.201900       1.732500    
 H    2.454300      -2.236900       1.910700    
 H    1.009700       3.068100       1.559700    
 H   -4.831900      0.5312000     -4.4599999E-02


%chk=000108009-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108009

0 1
S -1.309707 -1.803605 -0.572402
O -0.616874 0.848875 1.360627
O -1.058373 1.886051 -0.671881
O -3.118474 0.953593 0.907528
O 3.301653 -0.846988 -0.941624
N 1.566382 -0.360846 0.514533
C 0.763019 0.262775 -0.534313
C 0.035337 -0.783507 -1.445392
C -2.918407 -0.831082 -0.921662
C -0.341143 1.131229 0.045769
C 2.816419 -0.883630 0.233515
C -3.660463 -0.293448 0.320115
C 3.563875 -1.490939 1.414412
H 1.423930 0.853172 -1.195117
H 0.778681 -1.517667 -1.793235
H -0.417729 -0.279229 -2.314456
H 1.146559 -0.411128 1.445807
H -2.683015 -0.024167 -1.637988
H -3.583118 -1.554063 -1.426647
H -3.645650 -1.026241 1.142562
H -4.716637 -0.099312 0.043472
H 3.814567 -2.540444 1.183355
H 4.516621 -0.951018 1.552836
H 2.993541 -1.456806 2.358286
H -1.646142 0.960622 1.497368
H -2.955952 1.629303 0.189634


