%chk=000113644.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113644

0 1
 S  -0.9992000      -1.836400      4.0199999E-02
 O   -3.206000     -0.4299000      0.3852000    
 O    1.274600     -0.4248000      2.0099999E-02
 O    2.617600       1.446000     -4.8999999E-02
 N   0.2424000      0.5232000     -7.3000002E-03
 N    3.502600     -0.6953000      1.7899999E-02
 C   -2.243500      0.5664000      4.1999999E-03
 C  -0.8847000     -9.9699996E-02  2.0099999E-02
 C   -2.567100       1.089100      -1.394700    
 C   -2.317800       1.689500       1.034100    
 C   -2.796900      -1.722100     -6.3199997E-02
 C    2.477100      0.2273000     -8.6000003E-03
 C    4.900900     -0.3334000      1.0000000E-03
 H   -1.877500       1.885200      -1.695500    
 H   -2.501200      0.2936000      -2.145400    
 H   -3.591000       1.476800      -1.437700    
 H   -3.331000       2.103200       1.089100    
 H   -2.077000       1.314600       2.035900    
 H   -1.621500       2.502500      0.8028000    
 H   -3.270900      -2.481800      0.5637000    
 H   -3.126100      -1.864600      -1.097200    
 H    3.262000      -1.680900      5.7799999E-02
 H    5.379200     -0.8583000     -0.8294000    
 H    5.349000     -0.6616000      0.9420000    
 H    5.032800      0.7448000     -0.1159000    


%chk=000113644-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000113644

0 1
S -1.114214 -2.011468 -0.036412
O -3.264879 -0.430264 0.515323
O 1.345388 -0.419061 -0.011155
O 2.742851 1.534047 0.061747
N 0.191753 0.492298 0.049248
N 3.588934 -0.664453 -0.002041
C -2.263182 0.564099 0.022743
C -0.915353 -0.198132 0.023618
C -2.606739 1.018996 -1.414955
C -2.287842 1.722004 1.026951
C -3.029682 -1.720866 -0.068785
C 2.605678 0.297916 0.023009
C 5.011553 -0.313377 0.011793
H -1.879408 1.781052 -1.742715
H -2.566796 0.182662 -2.135165
H -3.619635 1.456852 -1.430301
H -3.264577 2.233037 0.982762
H -2.129518 1.342113 2.049091
H -1.485539 2.439228 0.789498
H -3.516200 -2.478564 0.560264
H -3.344707 -1.789524 -1.124786
H 3.296734 -1.641700 -0.027197
H 5.524627 -0.682430 -0.895333
H 5.517906 -0.726028 0.903827
H 5.089647 0.784964 0.039171


