%chk=000126212.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126212

0 1
 S    5.520300       1.410900     -0.1848000    
 O  -0.5556000       1.621600      0.2784000    
 C    3.881400     -0.6903000     -0.2448000    
 C    3.254100      -1.798100      0.5968000    
 C    3.067600      0.5817000     -0.1457000    
 C    1.795400      -2.020800      0.1834000    
 C    1.615000      0.4735000     -9.5899999E-02
 C    1.020200     -0.7317000      1.7400000E-02
 C    5.310000     -0.3586000      0.1965000    
 C  -0.4539000     -0.7717000     -5.1700000E-02
 C   0.7858000       1.725500     -0.2131000    
 C    3.811400       1.696900     -0.1379000    
 C   -1.185000      0.4193000      7.5400002E-02
 C   -1.162200      -1.966100     -0.2276000    
 C   -2.603000      0.4310000      6.1999999E-02
 C   -3.290100     -0.7917000     -0.1140000    
 C   -2.558200      -1.975800     -0.2614000    
 C   -3.368300       1.608600      0.2106000    
 C   -4.694900     -0.8088000     -0.1388000    
 C   -4.763600       1.576200      0.1851000    
 C   -5.426500      0.3680000      9.9999998E-03
 H    3.894800      -1.009500      -1.297500    
 H    3.289400      -1.533400       1.662500    
 H    3.817700      -2.731700      0.4836000    
 H    1.329000      -2.653300      0.9483000    
 H    1.771300      -2.574400     -0.7638000    
 H    5.451600     -0.5006000       1.273300    
 H    6.050900     -0.9621000     -0.3360000    
 H    1.231800       2.535700      0.3727000    
 H   0.7468000       2.058000      -1.257700    
 H    3.430100       2.707500     -9.8700002E-02
 H  -0.6484000      -2.916700     -0.3464000    
 H   -3.068100      -2.927300     -0.4006000    
 H   -2.882900       2.572900      0.3475000    
 H   -5.233900      -1.744500     -0.2742000    
 H   -5.329700       2.495800      0.3013000    
 H   -6.511800      0.3399000     -1.0800000E-02


%chk=000126212-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126212

0 1
S 5.651788 1.482753 -0.101813
O -0.547690 1.629497 0.207708
C 3.932585 -0.696109 -0.160705
C 3.220742 -1.812081 0.633083
C 3.099649 0.591912 -0.134917
C 1.792789 -2.040928 0.081498
C 1.651284 0.482530 -0.156785
C 1.010063 -0.745045 -0.095767
C 5.342056 -0.348795 0.366089
C -0.457771 -0.790476 -0.173640
C 0.818421 1.737771 -0.355697
C 3.853277 1.738838 -0.165564
C -1.196153 0.403057 -0.001821
C -1.196187 -2.013127 -0.341398
C -2.628459 0.422074 0.053984
C -3.337877 -0.830432 -0.108079
C -2.588341 -2.036778 -0.315868
C -3.369345 1.631937 0.259714
C -4.769751 -0.819981 -0.057717
C -4.765411 1.605525 0.306997
C -5.472208 0.370853 0.147286
H 4.017034 -1.017181 -1.222737
H 3.160303 -1.513235 1.697913
H 3.796171 -2.756086 0.584558
H 1.244099 -2.716351 0.765358
H 1.851030 -2.572906 -0.892399
H 5.393387 -0.410682 1.466692
H 6.141641 -0.953550 -0.086811
H 1.254487 2.605472 0.165341
H 0.726279 1.983434 -1.436646
H 3.503841 2.771265 -0.222905
H -0.644935 -2.946500 -0.495424
H -3.128446 -2.980672 -0.450828
H -2.817950 2.569020 0.377465
H -5.308407 -1.767056 -0.182056
H -5.326237 2.533299 0.464804
H -6.567258 0.364633 0.184487


