%chk=000147844.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147844

0 1
 S   -5.241100     -1.9500000E-02  6.1600000E-02
 O   -5.676800     -0.1056000      -1.511800    
 O   -5.428300      -1.347800      0.6270000    
 O   -5.899500       1.136500      0.6499000    
 C    1.584800      9.4400004E-02  4.8000002E-03
 C    1.100100      -1.236600      1.0600000E-02
 C   0.6110000       1.125800      1.0900000E-02
 C   -1.225500     -0.4610000      2.7899999E-02
 C  -0.7738000      0.8709000      2.2299999E-02
 C  -0.2814000      -1.496500      2.1900000E-02
 C    3.007200      0.3243000     -6.6000000E-03
 C    3.888800     -0.7881000     -1.2100000E-02
 C    1.999500      -2.306400      5.1000002E-03
 C   -2.606400     -0.7225000      3.9299998E-02
 C   -1.716000       1.914100      2.8200001E-02
 C   0.9560000       2.587300      4.6999999E-03
 C    3.372700      -2.085800     -6.2000002E-03
 C  -0.7707000      -2.921800      2.7700000E-02
 C   -3.529100      0.3234000      4.5100000E-02
 C   -3.084200       1.641100      3.9600000E-02
 C    3.606800       1.609000     -1.3100000E-02
 C    5.281300     -0.5985000     -2.3300000E-02
 C    4.993500       1.784000     -2.4300000E-02
 C    5.831000      0.6795000     -2.9400000E-02
 H    1.700800      -3.348500     -2.5900001E-02
 H   -3.007600      -1.728000     -1.2000001E-03
 H   -1.514900       2.974300      2.3800001E-02
 H    1.494800       2.832000      0.9271000    
 H    1.484200       2.826000     -0.9254000    
 H   0.1874000       3.350800      5.2999998E-03
 H    4.037700      -2.947700     -1.7700000E-02
 H   -1.730100      -3.062200      0.5298000    
 H  -0.8443000      -3.302300     -0.9959000    
 H  -0.1326000      -3.586300      0.6171000    
 H   -3.784000       2.472300      3.6300000E-02
 H    3.127700       2.565000     -8.9999996E-03
 H    5.955900      -1.452800     -2.7400000E-02
 H    5.416900       2.784600     -2.8500000E-02
 H    6.908700      0.8100000     -3.7999999E-02
 H   -5.237700     -0.8178000      -2.033600    


%chk=000147844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147844

0 1
S -5.296868 -0.048698 0.391303
O -5.746283 -0.049135 -1.416706
O -5.493649 -1.545338 0.975218
O -6.048110 1.207454 1.083787
C 1.610276 0.122526 -0.088062
C 1.140177 -1.263247 -0.092124
C 0.656232 1.168120 -0.265507
C -1.197726 -0.515474 0.006735
C -0.743892 0.863043 -0.151991
C -0.245579 -1.584501 -0.039712
C 3.063044 0.355602 0.073832
C 3.982930 -0.743123 -0.093648
C 2.117292 -2.332226 -0.215671
C -2.608117 -0.754998 0.156381
C -1.727737 1.917535 -0.158870
C 1.041346 2.582091 -0.685689
C 3.468188 -2.081720 -0.282015
C -0.679964 -3.042161 -0.046187
C -3.482603 0.315709 0.148031
C -3.088816 1.670472 -0.008899
C 3.621718 1.605815 0.486651
C 5.389251 -0.531708 0.011578
C 5.008703 1.792620 0.615076
C 5.907461 0.727751 0.342542
H 1.762348 -3.363315 -0.282026
H -3.006002 -1.762266 0.300834
H -1.399522 2.955108 -0.253630
H 1.035715 3.308634 0.150815
H 2.040380 2.605822 -1.145203
H 0.330218 2.954638 -1.443391
H 4.182045 -2.902817 -0.416384
H -1.768462 -3.165905 0.030908
H -0.368946 -3.545039 -0.981173
H -0.228934 -3.602201 0.793495
H -3.828591 2.475117 0.015857
H 2.964463 2.430073 0.765872
H 6.061699 -1.384033 -0.141712
H 5.394702 2.764081 0.942455
H 6.988567 0.880966 0.426352
H -6.744151 -0.115672 -1.472523


