%chk=000100906.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100906

0 1
 S    4.641600      0.4809000     -0.1980000    
 O   0.1755000     -0.6794000      0.1988000    
 O    2.463800      -1.824600     -0.9306000    
 O    4.615600       2.061000     -0.6006000    
 O    5.007600     -0.2942000      -1.368400    
 O    5.342800      0.3319000       1.063500    
 C   -2.170300     -0.1393000     -0.1212000    
 C   -3.580000     -0.4754000      0.4094000    
 C   -1.911800       1.371700     -0.3157000    
 C   -1.115600     -0.8021000      0.7799000    
 C   -4.710900      1.3700000E-02 -0.5013000    
 C   -6.105100     -0.3098000      4.2599998E-02
 C    1.174300      -1.275400       1.015600    
 C   -2.037700       2.217200      0.9442000    
 C    2.535100      -1.164000      0.3338000    
 C    2.908000      0.2919000      9.2100002E-02
 C   -7.232700      0.1958000     -0.8440000    
 H   -2.070600     -0.5926000      -1.117700    
 H   -3.712300     -6.1000001E-02   1.416000    
 H   -3.671500      -1.564500      0.5131000    
 H  -0.9031000       1.512400     -0.7242000    
 H   -2.590900       1.769100      -1.078400    
 H   -1.120300     -0.3570000       1.781200    
 H   -1.347800      -1.869200      0.8862000    
 H   -4.595700     -0.4337000      -1.496000    
 H   -4.644900       1.099500     -0.6291000    
 H   -6.205800      -1.395300      0.1601000    
 H   -6.216900      0.1300000       1.040900    
 H   0.9284000      -2.335200       1.153000    
 H    1.197600     -0.7856000       1.996000    
 H   -1.322800       1.908800       1.711900    
 H   -3.046100       2.167000       1.364500    
 H   -1.832500       3.266600      0.7073000    
 H    3.289300      -1.676300      0.9402000    
 H    2.675100      0.9120000      0.9642000    
 H    2.393800      0.6944000     -0.7875000    
 H   -7.186900       1.284100     -0.9512000    
 H   -7.174200     -0.2505000      -1.841700    
 H   -8.203300     -6.3699998E-02 -0.4102000    
 H    1.738900      -1.421600      -1.438500    
 H    4.426600       2.684400      0.1397000    


%chk=000100906-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100906

0 1
S 4.542714 0.436618 -0.699818
O 0.173160 -0.598560 0.452553
O 2.381865 -1.819646 -0.753073
O 4.947020 2.116193 0.032899
O 4.360199 0.612682 -2.293912
O 5.576036 -0.656081 -0.109460
C -2.184333 -0.126365 -0.015747
C -3.636448 -0.455328 0.430464
C -1.908004 1.393366 -0.199788
C -1.196679 -0.779081 0.966786
C -4.728484 0.037183 -0.545854
C -6.145347 -0.433081 -0.142898
C 1.200677 -1.192150 1.315844
C -2.168345 2.272767 1.044573
C 2.509660 -1.097591 0.512747
C 2.875246 0.369931 0.265505
C -7.241879 0.071063 -1.105583
H -2.018340 -0.609290 -1.002649
H -3.828181 -0.028486 1.436766
H -3.734283 -1.556432 0.539640
H -0.853827 1.511963 -0.513981
H -2.525638 1.765222 -1.039808
H -1.272687 -0.320679 1.977036
H -1.408584 -1.866697 1.063832
H -4.499580 -0.326727 -1.569374
H -4.720025 1.144354 -0.599116
H -6.164290 -1.541580 -0.105682
H -6.365575 -0.084032 0.886826
H 0.976215 -2.262136 1.508506
H 1.265448 -0.653033 2.285223
H -1.552259 1.960062 1.908082
H -3.228141 2.242668 1.357469
H -1.917213 3.327141 0.828609
H 3.325813 -1.604545 1.056161
H 3.104649 0.938033 1.180017
H 2.167168 0.903232 -0.385473
H -7.266359 1.176861 -1.134807
H -7.059148 -0.286751 -2.136423
H -8.243829 -0.280793 -0.798706
H 1.513347 -1.548521 -1.155871
H 5.752561 2.470247 -0.441615


