%chk=000104549.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104549

0 1
 S   -3.174600     -0.2966000     -6.2100001E-02
 O    1.097500      0.3778000      0.2564000    
 O   -1.652400      0.2579000     -0.2760000    
 O   -3.310500      -1.480800      -1.175900    
 O    2.931900       1.576000     -0.4490000    
 O   -3.232200     -0.9194000       1.247200    
 O   -4.112500      0.7542000     -0.4114000    
 C   -1.120100       1.222500      0.6239000    
 C   0.2966000       1.563100      0.2029000    
 C    2.402600      0.5311000     -9.7499996E-02
 C    3.104600     -0.7786000      5.4000001E-03
 C    2.361600      -2.002100      0.4472000    
 C    4.407500     -0.8051000     -0.3112000    
 H   -1.747600       2.119400      0.6108000    
 H   -1.118500      0.7955000       1.632400    
 H   0.7147000       2.320200      0.8753000    
 H   0.2976000       1.939000     -0.8268000    
 H    1.955400      -1.862600       1.454400    
 H    1.535500      -2.218900     -0.2380000    
 H    3.008000      -2.886100      0.4729000    
 H    4.974600      -1.729100     -0.2565000    
 H    4.950500      7.7799998E-02 -0.6318000    
 H   -3.002700      -1.244300      -2.082200    


%chk=000104549-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000104549

0 1
S -3.482071 -0.319689 -0.025064
O 1.128293 0.300689 0.313520
O -1.710947 0.151637 -0.354897
O -3.650734 -0.920057 -1.725614
O 2.807985 1.472316 -0.794623
O -3.625024 -1.571646 0.956058
O -4.330895 1.019101 0.229576
C -1.131462 1.106294 0.626834
C 0.244854 1.466486 0.090091
C 2.431380 0.430009 -0.204396
C 3.237695 -0.806430 0.051563
C 2.590771 -1.966929 0.778139
C 4.523868 -0.807709 -0.397313
H -1.763723 2.012777 0.684660
H -1.049932 0.626772 1.618775
H 0.646291 2.340180 0.638097
H 0.216926 1.716645 -0.985030
H 2.256166 -1.667120 1.787513
H 1.691036 -2.318870 0.242853
H 3.297674 -2.807762 0.876108
H 5.176245 -1.675103 -0.251428
H 4.934202 0.064550 -0.917757
H -2.871101 -0.535243 -2.227264


