%chk=000113323.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113323

0 1
 S    2.732300      0.3148000      7.5300001E-02
 O    3.210400     -0.1813000      -1.406200    
 O    3.095700       1.718000      0.1935000    
 O    3.193900     -0.6588000       1.050800    
 O   -3.868900       1.134300     -1.7700000E-02
 O   -3.788400      -1.059400     -4.4199999E-02
 N   -3.221300      5.9599999E-02 -2.0800000E-02
 C   0.9853000      0.2137000      4.7699999E-02
 C   0.3330000      -1.018900      2.2100000E-02
 C   -1.060800      -1.070100     -6.0000003E-04
 C   0.2439000       1.395200      5.0999999E-02
 C   -1.802300      0.1114000      2.4000001E-03
 C   -1.149900       1.344000      2.8300000E-02
 C    1.097100      -2.302300      1.8300001E-02
 H   -1.552000      -2.040300     -1.8200001E-02
 H   0.7202000       2.370800      6.8300001E-02
 H   -1.695000       2.284400      3.0900000E-02
 H    1.897000      -2.305100     -0.7268000    
 H    1.500900      -2.517500       1.012100    
 H   0.4469000      -3.145000     -0.2464000    
 H    2.887500      0.3661000      -2.160200    


%chk=000113323-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113323

0 1
S 2.744462 0.442856 0.071971
O 3.014388 -0.163873 -1.664018
O 3.092456 2.019153 0.156608
O 3.462572 -0.585256 1.092982
O -4.013671 1.153313 0.073305
O -3.898871 -1.124074 0.010259
N -3.356715 0.045064 0.040279
C 0.864412 0.236599 0.030283
C 0.285723 -1.055382 -0.008252
C -1.131654 -1.079819 -0.002284
C 0.149984 1.445471 0.064285
C -1.866701 0.122594 0.036105
C -1.256921 1.392986 0.070078
C 1.081849 -2.341063 -0.066549
H -1.669031 -2.031652 -0.031717
H 0.687327 2.398806 0.086945
H -1.870148 2.296424 0.096195
H 1.731335 -2.353188 -0.960129
H 1.745203 -2.441065 0.810254
H 0.409506 -3.212166 -0.105756
H 3.999994 -0.152129 -1.841243


