%chk=000084954.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084954

0 1
 S   -2.693900     -0.9303000     -8.5299999E-02
 S    2.720400     -0.8881000     -8.4500000E-02
 O    2.368700       2.101500      2.7200000E-02
 O   -3.338300     -0.7489000       1.405200    
 O    3.361700     -0.6952000       1.406100    
 O   -3.595300     -0.2783000      -1.022300    
 O   -2.326500      -2.326400     -0.2542000    
 O    2.403700      -2.300100     -0.2330000    
 O    3.584400     -0.2148000      -1.040400    
 C   -1.202500     -1.5400000E-02 -5.1300000E-02
 C   -1.211200       1.378500      1.3000000E-03
 C    1.213400     -5.0000002E-04 -5.1300000E-02
 C   9.8000001E-03 -0.7048000     -7.7500001E-02
 C    1.204800       1.393300      1.5000000E-03
 C  -7.4999998E-03   2.082800      2.7700000E-02
 C   -2.491800       2.146900      3.0700000E-02
 H   2.0000000E-02  -1.789200     -0.1121000    
 H  -1.0500000E-02   3.169600      6.7100003E-02
 H   -3.162700       1.803500      0.8201000    
 H   -2.305600       3.206100      0.2469000    
 H   -2.991200       2.116200     -0.9418000    
 H    2.163600       3.051400      6.3199997E-02
 H   -3.975900     -5.4000001E-03   1.510600    
 H    2.821600      -1.054900       2.148600    


%chk=000084954-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084954

0 1
S -2.839176 -0.878729 -0.228613
S 2.695454 -1.042320 -0.012311
O 2.451211 2.018290 0.144128
O -3.436684 -0.491655 1.491205
O 3.208282 -0.646134 1.721131
O -3.880306 -0.221223 -1.278477
O -2.477112 -2.448515 -0.339576
O 2.205622 -2.578990 -0.088588
O 3.839414 -0.515125 -1.022509
C -1.245682 0.102505 -0.087927
C -1.267241 1.519308 -0.022101
C 1.143658 0.011698 -0.002613
C -0.076319 -0.669689 -0.070126
C 1.207285 1.422738 0.065556
C -0.007130 2.155610 0.052520
C -2.540405 2.336373 -0.017860
H -0.105819 -1.766111 -0.111936
H 0.026720 3.250672 0.109068
H -3.186234 2.038330 0.827526
H -2.318205 3.411734 0.066845
H -3.125971 2.162167 -0.937501
H 2.395766 3.005856 0.174912
H -4.314252 -0.956847 1.618836
H 4.206325 -0.722442 1.750914


