%chk=000113044.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113044

0 1
 S    4.095100     -0.2225000     -0.2138000    
 O   -1.301700       2.011800      0.5961000    
 O   -2.607600      -1.308100      0.3329000    
 O   -4.210100     -0.8135000      -1.251400    
 O    3.852100      -1.747300     -0.7511000    
 O    4.728400      0.5138000      -1.298100    
 O    4.723100     -0.3000000       1.096100    
 O  -8.7000001E-03  -2.355400      0.4166000    
 C   -3.595500       1.957200     -8.8200003E-02
 C   -2.148100       2.072000     -0.5435000    
 C   -3.850400      0.6510000      0.6568000    
 C  -4.6999998E-02   1.493000      0.4082000    
 C    2.497200      0.4392000      2.6300000E-02
 C   -3.607200     -0.5573000     -0.2183000    
 C   0.5780000       1.634300     -0.8254000    
 C   0.5869000      0.8301000       1.452800    
 C    1.854400       1.105600      -1.016900    
 C    1.863500      0.3015000       1.261200    
 C   -2.259000      -2.494500     -0.3881000    
 C   -1.143100      -3.210800      0.3479000    
 H   -3.833700       2.788700      0.5857000    
 H   -4.257500       2.034200     -0.9583000    
 H   -2.003800       3.037500      -1.042100    
 H   -1.940300       1.270000      -1.263000    
 H   -4.893200      0.6044000      0.9917000    
 H   -3.236700      0.5925000       1.563300    
 H   0.1245000       2.169700      -1.653800    
 H   9.4700001E-02  0.7176000       2.414600    
 H    2.328600       1.223600      -1.987200    
 H    2.340100     -0.2211000       2.085700    
 H   -3.134700      -3.148300     -0.4636000    
 H   -1.923200      -2.207900      -1.391400    
 H  -0.8589000      -4.137200     -0.1591000    
 H   -1.440300      -3.441700       1.375100    
 H    3.365400      -1.822000      -1.605500    
 H   0.2644000      -2.154700     -0.4949000    


%chk=000113044-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113044

0 1
S 5.162213 1.223412 -0.235535
O -0.798229 1.511516 0.570237
O -3.945373 -1.940908 0.959042
O -3.590452 -0.979274 -1.134654
O 5.295713 -0.633746 -0.266861
O 5.586008 1.782753 -1.694674
O 5.901138 1.763815 1.099598
O -3.181714 -3.605642 -1.878482
C -3.153356 1.626297 0.030069
C -1.747452 1.550969 -0.569633
C -3.519707 0.412910 0.907095
C 0.564813 1.436984 0.297882
C 3.318732 1.294102 -0.022123
C -3.681817 -0.876289 0.119219
C 1.117026 1.391285 -1.010853
C 1.408588 1.417551 1.441717
C 2.515673 1.314584 -1.172246
C 2.801785 1.340981 1.287129
C -4.264356 -3.289947 0.364606
C -3.125038 -3.918238 -0.459228
H -3.232795 2.543439 0.641580
H -3.870949 1.717080 -0.806302
H -1.535993 2.446671 -1.186192
H -1.626112 0.641575 -1.187553
H -4.467044 0.596472 1.448478
H -2.752527 0.250433 1.686196
H 0.478678 1.408207 -1.897399
H 0.951188 1.461783 2.433912
H 2.968839 1.286981 -2.168061
H 3.472802 1.335040 2.151388
H -4.486787 -3.878962 1.268254
H -5.171784 -3.191099 -0.259434
H -3.226811 -5.016635 -0.400145
H -2.149344 -3.643026 -0.000842
H 6.261987 -0.861375 -0.400423
H -3.281844 -2.614298 -1.958463


