%chk=000124918.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124918

0 1
 S   -2.294900       1.334200      2.2000000E-03
 O   -2.450400       2.221300      -1.134500    
 O   -2.624100       1.759600       1.348600    
 O    3.927400      -1.249900     -4.1000001E-02
 C   -1.215200      -1.699600      8.5000005E-03
 C   -2.652000      -1.300500      0.4332000    
 C  -0.2288000     -0.5246000      3.2000002E-02
 C   -3.211800     -0.1330000     -0.3493000    
 C  -0.6087000      0.8269000      3.8800001E-02
 C   -1.232200      -2.296800      -1.416100    
 C  -0.7856000      -2.817700      0.9935000    
 C    1.158700     -0.7823000      1.1000000E-03
 C   0.3338000       1.865400      5.0700001E-02
 C    2.105400      0.2471000      1.2000000E-02
 C    1.691900       1.571900      4.2300001E-02
 C    3.524600     -6.9899999E-02 -1.4000000E-02
 C    4.561900       1.047700     -8.1000002E-03
 H   -2.663900      -1.052700       1.503600    
 H   -3.326400      -2.157900      0.3094000    
 H   -3.188300     -0.3054000      -1.428200    
 H   -4.250100      6.3100003E-02 -6.3000001E-02
 H   -1.977200      -3.096000      -1.501200    
 H   -1.460700      -1.540800      -2.175300    
 H  -0.2602000      -2.728600      -1.683000    
 H   -1.545700      -3.606400       1.048000    
 H   0.1470000      -3.308200      0.6961000    
 H  -0.6442000      -2.420300       2.005600    
 H    1.507900      -1.810900     -4.5699999E-02
 H   1.9400001E-02   2.905900      6.3400000E-02
 H    2.389200       2.403300      5.1800001E-02
 H    4.475800       1.638800      0.9074000    
 H    4.448300       1.674100     -0.8965000    
 H    5.563400      0.6062000     -3.2200001E-02


%chk=000124918-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000124918

0 1
S -2.412125 1.405710 0.221298
O -2.591979 2.726050 -0.728437
O -2.863441 1.467174 1.795609
O 3.904408 -1.346165 -0.130033
C -1.221369 -1.718651 0.028664
C -2.712869 -1.330387 0.281043
C -0.241513 -0.518002 0.068454
C -3.244476 -0.152101 -0.536988
C -0.602109 0.852030 0.105646
C -1.096145 -2.398306 -1.370407
C -0.839146 -2.747590 1.133109
C 1.152572 -0.768073 -0.002105
C 0.320642 1.914188 0.060654
C 2.118565 0.267207 -0.025834
C 1.694512 1.622158 0.000322
C 3.574888 -0.124984 -0.094312
C 4.631650 0.970936 -0.119402
H -2.869952 -1.099352 1.353647
H -3.335592 -2.218130 0.057631
H -2.966863 -0.136488 -1.602191
H -4.322398 0.029478 -0.402794
H -1.742661 -3.294363 -1.414027
H -1.391005 -1.716586 -2.189004
H -0.058164 -2.718798 -1.566291
H -1.561148 -3.585513 1.129304
H 0.165250 -3.174995 0.972490
H -0.857879 -2.280071 2.133784
H 1.533821 -1.794309 -0.041733
H -0.046792 2.945931 0.051001
H 2.419905 2.440402 -0.031763
H 4.571243 1.602691 0.786524
H 4.496017 1.634620 -0.993840
H 5.628454 0.508289 -0.169920


