%chk=000088921.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088921

0 1
 S    1.722600     -0.2950000     -8.5699998E-02
 S   -1.116800      -1.344500     -8.5800000E-02
 S  -0.6058000       1.639000     -8.5800000E-02
 O    2.585700      0.6627000      0.5788000    
 O    1.758500     -0.4252000      -1.529600    
 O   -1.247800      -1.310600      -1.529700    
 O  -0.7197000      -2.570900      0.5787000    
 O  -0.5108000       1.735400      -1.529600    
 O   -1.866800       1.907800      0.5785000    
 C   9.9999997E-05 -3.0000001E-04  0.4311000    
 C    2.130400      -1.877800      0.6145000    
 C   -2.691200     -0.9053000      0.6145000    
 C   0.5613000       2.783400      0.6145000    
 C    3.547900      -2.284200      0.2784000    
 C   -3.752500      -1.929100      0.2786000    
 C   0.2048000       4.214300      0.2784000    
 H    0.000000     -3.0000001E-04   1.526200    
 H    1.974400      -1.829200       1.694900    
 H    1.485200      -2.630400      0.1679000    
 H   -2.571000     -0.7943000       1.694900    
 H   -3.020200      2.9700000E-02  0.1677000    
 H   0.5972000       2.623900       1.694900    
 H    1.535600       2.601000      0.1678000    
 H    3.772600      -3.268300      0.7015000    
 H    3.701700      -2.336600     -0.8044000    
 H    4.270800      -1.568600      0.6829000    
 H   -4.716900      -1.631200      0.7017000    
 H   -3.874900      -2.036100     -0.8041000    
 H   -3.494700      -2.913100      0.6832000    
 H   0.9446000       4.900800      0.7016000    
 H   0.1735000       4.373600     -0.8043000    
 H  -0.7764000       4.482600      0.6828000    


%chk=000088921-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088921

0 1
S 1.906520 0.082605 0.618518
S -0.883919 -1.695970 0.617295
S -1.031275 1.612405 0.628138
O 2.471531 1.036481 1.837339
O 2.028100 0.616933 -0.914701
O -0.475063 -2.062128 -0.915685
O -0.337318 -2.662788 1.834543
O -1.551149 1.457054 -0.907094
O -2.143557 1.613140 1.844232
C -0.003284 -0.000002 1.126790
C 2.663747 -1.749687 0.798618
C -2.849521 -1.439336 0.797358
C 0.169894 3.188651 0.819070
C 2.881922 -2.338169 -0.583560
C -3.466079 -1.314559 -0.584336
C 0.603751 3.655007 -0.558993
H -0.001128 -0.003756 2.230468
H 3.574553 -1.512866 1.373514
H 1.904763 -2.269614 1.411660
H -3.100763 -2.353833 1.360141
H -2.920101 -0.530051 1.422084
H -0.506429 3.865060 1.367986
H 0.983665 2.800216 1.458217
H 3.348990 -3.334023 -0.451279
H 1.927381 -2.475385 -1.117819
H 3.555050 -1.719060 -1.198500
H -4.562369 -1.224381 -0.452698
H -3.107336 -0.410968 -1.104224
H -3.264296 -2.197771 -1.211905
H 1.224821 4.562276 -0.423356
H 1.215690 2.892404 -1.068480
H -0.255393 3.915317 -1.198339


