%chk=000017717.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017717

0 1
 S    1.571300     -0.2779000      0.6493000    
 P    3.538900     -0.3952000     -7.9899997E-02
 O   -1.521400      -1.369600     -0.2633000    
 O    4.575600     -0.3544000       1.172200    
 O    3.924700      0.9476000     -0.9111000    
 O   -4.918900     -0.3963000      0.6972000    
 O    3.709100      -1.635300     -0.9190000    
 O   -3.584500       2.061400      0.3481000    
 C   0.5239000     -0.2223000     -0.8181000    
 C  -0.9050000     -0.1376000     -0.4218000    
 C   -1.539700       1.028700     -0.2317000    
 C   -2.965700       1.019500      0.1664000    
 C   -3.598000     -0.3097000      0.3296000    
 C   -2.844400      -1.392100      0.1071000    
 C    5.967800     -0.3694000      0.9064000    
 C    3.828800       2.218200     -0.2910000    
 C   -5.762400     -0.4157000     -0.4406000    
 H   0.8168000      0.6439000      -1.421600    
 H   0.7049000      -1.112500      -1.429400    
 H   -1.049900       1.987200     -0.3569000    
 H   -3.201500      -2.408500      0.1966000    
 H    6.264000      0.5430000      0.3834000    
 H    6.224600      -1.244000      0.3031000    
 H    6.504300     -0.4235000       1.856900    
 H    4.228200       2.191600      0.7257000    
 H    2.784100       2.537600     -0.2696000    
 H    4.405500       2.936900     -0.8786000    
 H   -5.571300      -1.298100      -1.061200    
 H   -5.647700      0.4960000      -1.037200    
 H   -6.799400     -0.4647000     -9.4899997E-02


%chk=000017717-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017717

0 1
S 1.587421 1.794890 -0.188272
P 3.300596 0.283984 -0.453559
O -0.708598 -0.628969 -0.253056
O 3.586747 -0.124546 1.208394
O 4.716269 1.172404 -0.917946
O -4.102168 -1.225478 0.985705
O 3.014071 -0.900282 -1.474111
O -4.399781 1.301067 -0.562057
C 0.466723 1.016965 -1.549866
C -0.832591 0.559958 -0.973936
C -2.052768 1.181707 -1.105295
C -3.285581 0.676645 -0.485396
C -3.098069 -0.602111 0.252765
C -1.847620 -1.181383 0.326398
C 4.369504 -1.357044 1.494579
C 5.060412 2.418098 -0.193925
C -5.469138 -1.280521 0.400752
H 0.311219 1.797759 -2.306669
H 1.040013 0.172146 -1.976747
H -2.126761 2.119264 -1.663373
H -1.635086 -2.104555 0.865655
H 5.399122 -1.272252 1.102639
H 3.869339 -2.240870 1.063103
H 4.382673 -1.419822 2.592438
H 5.197867 2.225629 0.885114
H 4.279675 3.185355 -0.349840
H 6.007229 2.746766 -0.646949
H -5.465873 -1.924376 -0.498733
H -5.818565 -0.268098 0.148169
H -6.083581 -1.737531 1.190117


