%chk=000019891.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019891

0 1
 S    4.222200     -0.8883000      6.2700003E-02
 O    1.598400      -2.116800      0.2019000    
 C   -2.285700     -0.3024000      4.5100000E-02
 C    2.744200     -7.9300001E-02  8.9999998E-04
 C  -0.9538000     -0.8839000      0.1063000    
 C   -2.470400       1.049600      0.3343000    
 C   -3.378200      -1.096900     -0.3027000    
 C    1.512100     -0.8978000      0.1032000    
 C   0.2037000     -0.1877000      4.8799999E-02
 C    2.819400       1.254700     -0.1379000    
 C   -3.747800       1.607000      0.2756000    
 C   -4.655400     -0.5393000     -0.3617000    
 C   -4.840300      0.8127000     -7.2499998E-02
 C    4.181800       1.666900     -0.2006000    
 C    5.049700      0.6016000     -0.1034000    
 H  -0.9221000      -1.967900      0.1918000    
 H   -1.655300       1.702800      0.6313000    
 H   -3.253900      -2.152400     -0.5327000    
 H   0.2016000      0.8866000     -6.4199999E-02
 H    1.998400       1.955000     -0.1980000    
 H   -3.893200       2.658500      0.5057000    
 H   -5.506200      -1.157700     -0.6326000    
 H   -5.834900       1.246500     -0.1171000    
 H    4.509100       2.692600     -0.3113000    
 H    6.130100      0.6271000     -0.1220000    


%chk=000019891-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019891

0 1
S 4.325974 -0.991804 -0.128409
O 1.550559 -2.149747 -0.181283
C -2.324868 -0.236364 -0.045628
C 2.754827 -0.087299 -0.062744
C -0.971497 -0.802102 -0.086790
C -2.587324 1.162820 0.048590
C -3.435715 -1.127885 -0.101579
C 1.506026 -0.873911 -0.103772
C 0.221018 -0.128652 -0.053008
C 2.979818 1.289828 0.019252
C -3.908825 1.646092 0.084633
C -4.759772 -0.644326 -0.065735
C -5.002080 0.745718 0.027577
C 4.368607 1.653051 0.033567
C 5.215431 0.552067 -0.036619
H -0.896661 -1.898107 -0.152634
H -1.754910 1.873630 0.094691
H -3.248908 -2.206210 -0.173806
H 0.258144 0.964037 0.010827
H 2.174882 2.026714 0.068697
H -4.093822 2.723516 0.157495
H -5.599476 -1.346216 -0.109982
H -6.029178 1.125774 0.055781
H 4.726815 2.683239 0.094390
H 6.304435 0.537336 -0.042610


