%chk=000133793.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133793

0 1
 S   -4.379100       1.021800      0.1748000    
 O    1.424300      -1.795500     -0.3251000    
 O    4.158100      -2.421800     -0.1438000    
 O   -3.933400     -0.5031000     -0.2488000    
 O   -6.009800      0.9557000      0.2125000    
 O   -3.912400       1.293300       1.522000    
 O   -4.006700       1.907600     -0.9130000    
 N    3.275900       1.116700      0.4945000    
 C    3.769600     -5.5599999E-02 -0.2153000    
 C    3.592500      -1.338700      0.6000000    
 C    3.507400       2.329500     -0.2783000    
 C    2.131900      -1.664200      0.9041000    
 C    2.914300       3.524200      0.4619000    
 C    5.001100       2.523200     -0.5239000    
 C   9.3400002E-02  -1.474300     -0.3061000    
 C  -0.6419000      -1.653200      0.8606000    
 C  -0.5107000     -0.9722000      -1.453800    
 C   -2.610100     -0.8220000     -0.2676000    
 C   -1.997800      -1.326100      0.8798000    
 C   -1.866600     -0.6451000      -1.434500    
 H    3.271600     -0.1572000      -1.188000    
 H    4.841900      1.2800000E-02 -0.4284000    
 H    4.152600      -1.268400       1.539500    
 H    2.992800       2.257100      -1.244800    
 H    3.734400       1.186400       1.402700    
 H    1.721500     -0.8711000       1.541200    
 H    2.075200      -2.623100       1.432700    
 H    3.040100       4.443000     -0.1210000    
 H    1.840900       3.385800      0.6337000    
 H    3.396200       3.675300       1.434500    
 H    5.395500       1.834300      -1.277300    
 H    5.586300       2.411800      0.3963000    
 H    5.193700       3.532200     -0.9075000    
 H    3.641600      -2.520200     -0.9622000    
 H  -0.2118000      -2.070900       1.765700    
 H   6.5099999E-02 -0.8326000      -2.364300    
 H   -2.573400      -1.474300       1.789600    
 H   -2.337300     -0.2546000      -2.332600    
 H   -6.431300      0.5163000     -0.5629000    


%chk=000133793-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133793

0 1
S -5.038565 1.221942 -0.414198
O 1.322324 -1.371284 -0.314954
O 3.826179 -2.607153 -0.650451
O -4.178443 -0.794872 0.176171
O -6.483843 0.231911 -1.008292
O -5.671289 2.392626 0.509527
O -4.119495 1.666001 -1.683729
N 4.010113 0.949248 0.619875
C 4.033827 -0.136068 -0.381997
C 3.651222 -1.485581 0.278536
C 3.799308 2.335518 0.113884
C 2.234345 -1.454076 0.860530
C 3.610179 3.281500 1.316226
C 4.932048 2.833759 -0.823892
C -0.036766 -1.219278 -0.117178
C -0.652132 -1.167035 1.172632
C -0.818371 -1.105095 -1.306767
C -2.848332 -0.902778 0.074001
C -2.035017 -0.992355 1.261171
C -2.199879 -0.944072 -1.217646
H 3.290604 0.103773 -1.166741
H 5.013184 -0.278969 -0.889216
H 4.352610 -1.700465 1.105995
H 2.853729 2.312207 -0.465250
H 4.817167 0.907189 1.259595
H 2.120075 -0.549952 1.487561
H 2.004901 -2.378772 1.421013
H 3.396556 4.310252 0.976124
H 2.775259 2.940326 1.952416
H 4.526779 3.317843 1.937656
H 5.079039 2.145872 -1.676367
H 5.888993 2.910304 -0.272181
H 4.693613 3.833210 -1.232159
H 3.106322 -2.553817 -1.331347
H -0.052373 -1.254619 2.082348
H -0.306284 -1.135684 -2.272923
H -2.539523 -0.936296 2.231217
H -2.816864 -0.831005 -2.113573
H -6.145600 -0.711457 -0.950717


