%chk=000068134.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068134

0 1
 S    1.455400      0.4613000     -0.2938000    
 S   -1.462900      0.4519000      0.2950000    
 O    4.877500       1.801400      9.4499998E-02
 O   -4.876300       1.801800     -9.3199998E-02
 O    4.623100      9.5899999E-02   1.568500    
 O   -4.622400      9.7300000E-02  -1.568400    
 N    5.039200      -1.411200     -0.9257000    
 N   -5.037800      -1.411400      0.9250000    
 C    4.088500     -0.3108000     -0.7549000    
 C   -4.087100     -0.3109000      0.7546000    
 C    2.678400     -0.8651000     -0.5430000    
 C   -2.677200     -0.8653000      0.5419000    
 C   6.0000003E-04 -0.5814000     -8.9999998E-04
 C    4.561000      0.5229000      0.4214000    
 C   -4.560000      0.5236000     -0.4211000    
 H    4.110100      0.3062000      -1.661500    
 H   -4.109100      0.3054000       1.661800    
 H    2.372400      -1.458100      -1.412200    
 H    2.654400      -1.515500      0.3393000    
 H   -2.373600      -1.460400       1.410400    
 H   -2.655900      -1.517000     -0.3395000    
 H  -0.1742000      -1.209600     -0.8786000    
 H   0.1781000      -1.210500      0.8756000    
 H    5.955400      -1.036200      -1.169600    
 H    4.752200      -1.991700      -1.712900    
 H   -5.953900      -1.036600       1.169200    
 H   -4.750700      -1.992300       1.712000    
 H    5.163600       2.319200      0.8772000    
 H   -5.162600       2.320100     -0.8754000    


%chk=000068134-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068134

0 1
S 1.194927 -0.368460 1.044525
S -1.201089 -0.163833 -1.051339
O 4.916126 -1.798826 -1.448532
O -4.969635 -1.787235 1.266666
O 2.620270 -1.898381 -1.740778
O -2.676970 -2.029105 1.491215
N 4.510712 0.932163 -1.123012
N -4.458089 0.939652 1.306182
C 3.645706 -0.038209 -0.415317
C -3.633391 0.043977 0.464414
C 2.239023 0.564327 -0.228656
C -2.205032 0.613559 0.351188
C -0.021046 -1.265083 -0.079180
C 3.611492 -1.316644 -1.257302
C -3.647156 -1.340591 1.117724
H 4.035868 -0.340498 0.587532
H -4.038196 -0.100559 -0.567535
H 2.332296 1.595414 0.152651
H 1.676474 0.593607 -1.176201
H -2.261635 1.691215 0.121765
H -1.637788 0.487293 1.287930
H 0.541967 -1.829277 -0.835640
H -0.607508 -1.915775 0.584141
H 5.421688 0.551770 -1.396785
H 4.576649 1.840303 -0.654636
H -5.380053 0.557227 1.537274
H -4.495848 1.903617 0.962814
H 4.887732 -2.618677 -2.012435
H -4.971295 -2.679971 1.707030


