%chk=000086977.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086977

0 1
 S   0.3133000       1.286000      6.9999998E-04
 O    1.423900      7.9700001E-02  1.7000000E-03
 O    4.998600     -0.5598000     -1.7300000E-02
 O   0.4086000       2.001100      -1.263300    
 O   0.4406000       1.994300       1.267100    
 C   -1.230700      0.4712000      6.0000003E-04
 C    2.806200      0.4017000      2.0000001E-03
 C   -1.848000      0.1463000       1.208400    
 C   -1.847700      0.1466000      -1.207500    
 C   -3.699700     -0.8277000       0.000000    
 C   -3.082500     -0.5031000       1.208100    
 C   -3.082200     -0.5028000      -1.207700    
 C    3.613300     -0.8823000      3.0000000E-03
 C   -5.019300      -1.522500     -6.0000003E-04
 C    5.805600      -1.728900      4.6999999E-03
 H    3.048800       1.001000     -0.8829000    
 H    3.050000       1.002500      0.8853000    
 H   -1.383200      0.3832000       2.161200    
 H   -1.382900      0.3825000      -2.160600    
 H   -3.553800     -0.7508000       2.155600    
 H   -3.553100     -0.7505000      -2.155400    
 H    3.354500      -1.487600     -0.8742000    
 H    3.374400      -1.471800      0.8965000    
 H   -5.124900      -2.169000     -0.8785000    
 H   -5.130300      -2.161100      0.8823000    
 H   -5.830600     -0.7879000     -6.2000002E-03
 H    5.626200      -2.301700      0.9197000    
 H    6.855100      -1.423300     -1.5200000E-02
 H    5.605900      -2.349600     -0.8741000    


%chk=000086977-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086977

0 1
S 0.288299 1.479081 -0.001038
O 1.425758 -0.001476 -0.001773
O 5.036612 -0.594693 0.000504
O 0.470519 2.265631 -1.408254
O 0.473197 2.265013 1.406223
C -1.315839 0.516944 -0.000006
C 2.859400 0.387458 -0.000369
C -1.888567 0.189191 1.238423
C -1.888764 0.186745 -1.237722
C -3.738751 -0.877133 0.001559
C -3.112503 -0.514667 1.223953
C -3.112646 -0.517098 -1.221677
C 3.613839 -0.944828 0.003348
C -5.068842 -1.607220 0.002258
C 5.891249 -1.780623 0.006256
H 3.103910 0.969906 -0.907254
H 3.100951 0.973776 0.904812
H -1.404704 0.485121 2.174326
H -1.405127 0.480853 -2.174306
H -3.585063 -0.785837 2.174599
H -3.585340 -0.790175 -2.171718
H 3.349092 -1.540042 -0.896752
H 3.351233 -1.534098 0.907971
H -5.180308 -2.249164 -0.888509
H -5.184407 -2.240141 0.898904
H -5.910124 -0.887636 -0.003369
H 5.722837 -2.399403 0.913328
H 6.928409 -1.410805 0.003688
H 5.721779 -2.408982 -0.894005


