%chk=000102949.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102949

0 1
 S   3.8999999E-03  1.2000001E-03  0.2222000    
 O   0.3678000      -1.207300     -0.4967000    
 O  -0.3745000       1.205300     -0.4965000    
 O   -3.420000       1.467300      0.8987000    
 O    3.418300      -1.467900      0.8989000    
 O   -2.172100      -1.810600      -1.522000    
 O    2.176100       1.812000      -1.522100    
 O   -3.492700      0.6108000      -1.236900    
 O    3.496000     -0.6097000      -1.235800    
 C   -1.329900     -0.4092000       1.323700    
 C    1.327100      0.4083000       1.320500    
 C   -2.637600     -0.7431000      0.6054000    
 C    2.636500      0.7427000      0.6056000    
 C   -2.443100      -1.937600     -0.3280000    
 C    2.444300       1.938100     -0.3274000    
 C   -3.238600      0.4953000     -4.5400001E-02
 C    3.239100     -0.4952000     -4.4799998E-02
 C   -2.635000      -3.308700      0.2717000    
 C    2.634800       3.308600      0.2739000    
 C   -3.951600       2.705700      0.4172000    
 C    3.951000      -2.706000      0.4178000    
 H   -1.449600      0.4369000       2.007800    
 H  -0.9894000      -1.270400       1.909400    
 H    1.447200     -0.4372000       2.005300    
 H   0.9875000       1.269200       1.907100    
 H   -3.383000      -1.057800       1.348900    
 H    3.380300       1.056800       1.351000    
 H   -2.414000      -4.072700     -0.4789000    
 H   -1.954200      -3.442000       1.115600    
 H   -3.671000      -3.422900      0.5998000    
 H    2.415900       4.073300     -0.4767000    
 H    1.951900       3.441300       1.116100    
 H    3.669900       3.422400      0.6048000    
 H   -4.047300       3.387400       1.266400    
 H   -4.941900       2.548300     -2.0500001E-02
 H   -3.270600       3.150300     -0.3148000    
 H    4.044800      -3.388300       1.266600    
 H    4.942300      -2.548200     -1.7600000E-02
 H    3.271700      -3.149900     -0.3161000    


%chk=000102949-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102949

0 1
S -0.002658 -0.001865 -1.105140
O 1.234357 -0.692431 -1.931933
O -1.242201 0.687841 -1.928548
O -1.764582 0.658679 1.720644
O 1.764313 -0.654116 1.719443
O -4.125896 -0.112816 -0.282803
O 4.122323 0.108528 -0.304111
O -3.043288 -1.002701 2.723963
O 3.065297 1.001076 2.704144
C -0.717278 -1.487197 -0.031326
C 0.716370 1.484579 -0.035509
C -2.162267 -1.374563 0.458031
C 2.163741 1.372982 0.446660
C -3.249660 -0.948889 -0.598563
C 3.245680 0.945755 -0.615326
C -2.374715 -0.593557 1.753224
C 2.383681 0.594002 1.741705
C -3.240520 -1.684834 -1.925035
C 3.230528 1.682149 -1.941574
C -2.082768 1.545138 2.874050
C 2.087376 -1.538515 2.873135
H 0.030943 -1.563147 0.770418
H -0.576906 -2.293152 -0.771143
H -0.027991 1.560729 0.769811
H 0.571954 2.289922 -0.775230
H -2.454921 -2.417226 0.714162
H 2.457869 2.416000 0.699550
H -4.263292 -1.716362 -2.333205
H -2.603120 -1.112214 -2.624520
H -2.837651 -2.710013 -1.840584
H 4.249716 1.705028 -2.359066
H 2.581954 1.115388 -2.635546
H 2.837473 2.710807 -1.852661
H -1.554170 2.485948 2.664781
H -1.732247 1.087363 3.813495
H -3.171563 1.704184 2.921267
H 1.556914 -2.479260 2.668343
H 1.741279 -1.078479 3.813135
H 3.176228 -1.698260 2.916061


