%chk=000065626.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065626

0 1
 S   -4.000400     -0.5307000      0.2068000    
 S    3.860100     -0.7239000      7.2999999E-02
 S  -0.3481000       1.484300      -1.044500    
 S   0.8633000       2.419400      0.3281000    
 O   -4.978700      -1.052200     -0.9895000    
 O    4.326600      -1.151500      -1.430200    
 O   -4.650000      0.5690000      0.8958000    
 O   -3.488900      -1.682400      0.9265000    
 O    3.103300      -1.816200      0.6558000    
 O    4.991500     -0.1307000      0.7615000    
 C   -2.713800      0.1164000     -0.8161000    
 C    2.741600      0.5618000     -0.3923000    
 C   -1.682500      0.8591000      1.3000000E-02
 C    1.976000       1.077600      0.8120000    
 H   -2.270300     -0.7300000      -1.351100    
 H   -3.186100      0.7908000      -1.539000    
 H    3.336700       1.351300     -0.8639000    
 H    2.081700      0.1136000      -1.140300    
 H   -1.257800      0.1888000      0.7681000    
 H   -2.151800       1.701800      0.5318000    
 H    2.669900       1.468000       1.564200    
 H    1.399800      0.2820000       1.296300    
 H   -5.438600     -0.3451000      -1.500400    
 H    3.652900      -1.637300      -1.961800    


%chk=000065626-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065626

0 1
S -4.281603 -0.217048 0.450344
S 4.168954 -0.206312 0.559462
S -0.407164 -0.133542 -1.970700
S 0.355858 1.774220 -0.996419
O -5.505790 1.019238 -0.217705
O 5.349229 -0.577037 -0.833859
O -3.860401 0.176521 1.962016
O -4.768248 -1.725916 0.126430
O 3.632662 -1.582039 1.221092
O 4.769914 0.954548 1.512937
C -2.914441 0.320741 -0.816426
C 2.841409 0.537375 -0.643148
C -1.744504 -0.644374 -0.720465
C 1.669534 1.054749 0.174290
H -3.444829 0.293307 -1.779502
H -2.676753 1.349756 -0.505079
H 3.400188 1.317221 -1.180834
H 2.591796 -0.315067 -1.293827
H -2.021385 -1.669725 -1.024111
H -1.294689 -0.672106 0.284563
H 1.950592 1.905893 0.819874
H 1.201903 0.269968 0.789822
H -6.337158 0.971276 0.336154
H 6.161326 -1.017747 -0.451108


