%chk=000056942.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056942

0 1
 S    3.573200     -0.5547000     -0.1455000    
 O   -1.634500     -0.1357000     -0.6062000    
 O  -0.7559000     -0.7001000       1.498400    
 O   -4.051500       1.300800      -1.117900    
 C  -0.6229000     -0.8912000      8.0200002E-02
 C   0.7445000     -0.3919000     -0.3691000    
 C   -2.545900      0.2649000      0.4207000    
 C   -1.655200      0.4015000       1.631600    
 C  -0.8016000      -2.371900     -0.2306000    
 C    1.908500      -1.073600      0.3757000    
 C   0.8863000     -0.4896000      -1.891900    
 C   -3.256000       1.544000      3.2699998E-02
 C    3.459600       1.186300      0.3238000    
 C    4.751500       1.911300     -2.0999999E-03
 H   0.7673000      0.6776000     -0.1238000    
 H   -3.263500     -0.5556000      0.5455000    
 H   -1.065500       1.325000       1.616000    
 H   -2.199500      0.3384000       2.577400    
 H   -1.804900      -2.692300      7.7600002E-02
 H  -0.7335000      -2.589900      -1.300200    
 H  -0.1046000      -3.007900      0.3220000    
 H    1.826100     -0.9129000       1.456000    
 H    1.883900      -2.155000      0.2137000    
 H    1.061100      -1.520000      -2.218600    
 H   1.6000000E-03 -0.1138000      -2.415900    
 H    1.726500      0.1139000      -2.250900    
 H   -2.546500       2.339600     -0.2171000    
 H   -3.910700       1.893200      0.8364000    
 H    2.652900       1.676700     -0.2260000    
 H    3.252500       1.263800       1.395600    
 H   -3.459500      0.9827000      -1.820900    
 H    5.600800       1.484400      0.5423000    
 H    4.972800       1.878200      -1.074400    
 H    4.671000       2.964800      0.2861000    


%chk=000056942-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056942

0 1
S 3.531027 -0.208674 -0.574738
O -1.779049 -0.315593 -0.562473
O -0.567395 -0.598792 1.458705
O -4.083059 1.312212 -1.129567
C -0.604339 -1.023242 0.028291
C 0.667053 -0.507483 -0.704572
C -2.501110 0.395133 0.531655
C -1.391338 0.620156 1.573757
C -0.830240 -2.534200 0.011134
C 1.942255 -1.107842 -0.068765
C 0.608247 -0.753731 -2.227277
C -3.111704 1.652854 -0.089165
C 3.441665 1.264136 0.621158
C 4.704133 2.123568 0.459810
H 0.676866 0.588577 -0.532804
H -3.297864 -0.267104 0.924449
H -0.797234 1.527900 1.337618
H -1.755464 0.665183 2.611751
H -1.785308 -2.769730 0.508411
H -0.868743 -2.910993 -1.024169
H -0.019745 -3.052830 0.551305
H 1.885974 -1.077567 1.033017
H 2.098782 -2.152968 -0.388918
H 0.634412 -1.833933 -2.464998
H -0.311655 -0.324964 -2.659279
H 1.482363 -0.282075 -2.709985
H -2.296174 2.291073 -0.491935
H -3.681489 2.222276 0.665265
H 2.532488 1.847613 0.392366
H 3.358875 0.857237 1.644424
H -3.630757 0.704614 -1.770335
H 5.614276 1.538853 0.682205
H 4.791392 2.516797 -0.568832
H 4.671259 2.984540 1.153091


