%chk=000138691.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138691

0 1
 S    8.059100     -0.1546000     -9.2399999E-02
 O    6.559900      0.4888000     -3.5100002E-02
 O    8.254500     -0.8075000      -1.370800    
 O    8.346000     -0.8204000       1.162100    
 C   -2.199500     -0.4151000      9.9100001E-02
 C   -3.508100      0.3804000      0.1604000    
 C  -0.9484000      0.4667000      0.1170000    
 C   -4.795400     -0.4506000      0.1186000    
 C   0.3271000     -0.3783000      7.8500003E-02
 C   -6.067800      0.3999000      0.1237000    
 C    1.611700      0.4576000      8.1500001E-02
 C   -7.351400     -0.4287000      3.1999999E-03
 C    2.887400     -0.3896000      0.1180000    
 C   -8.653800      0.3734000     -9.0000004E-02
 C    4.168400      0.4439000      5.0900001E-02
 C   -9.906200     -0.5018000     -0.1552000    
 C    5.441900     -0.3894000      8.9999998E-04
 C   -11.16840      0.3410000     -0.2539000    
 C    8.942900       1.384200     -0.1166000    
 H   -2.197800      -1.027500     -0.8110000    
 H   -2.168100      -1.109600      0.9477000    
 H   -3.510500      0.9851000       1.076100    
 H   -3.522500       1.089200     -0.6776000    
 H  -0.9656000       1.146100     -0.7434000    
 H  -0.9496000       1.088100       1.020500    
 H   -4.783400      -1.074900     -0.7832000    
 H   -4.811300      -1.133900      0.9763000    
 H   0.3377000      -1.051900      0.9445000    
 H   0.3167000      -1.013200     -0.8161000    
 H   -6.106400      0.9937000       1.044800    
 H   -6.027000       1.111200     -0.7104000    
 H    1.604600       1.128800      0.9491000    
 H    1.624200       1.094300     -0.8116000    
 H   -7.412500      -1.103400      0.8665000    
 H   -7.275700      -1.069500     -0.8846000    
 H    2.873500      -1.090800     -0.7255000    
 H    2.896100     -0.9943000       1.033000    
 H   -8.723200       1.038800      0.7795000    
 H   -8.611800       1.016800     -0.9775000    
 H    4.139200       1.097300     -0.8306000    
 H    4.213600       1.120000      0.9142000    
 H   -9.847700      -1.168300      -1.023400    
 H   -9.963000      -1.135300      0.7374000    
 H    5.512500      -1.028800      0.8875000    
 H    5.448100      -1.022100     -0.8932000    
 H   -11.27110      0.9972000      0.6163000    
 H   -11.15530      0.9633000      -1.154400    
 H   -12.05170     -0.3036000     -0.2992000    
 H    8.711100       1.939800      0.7940000    
 H    10.01120       1.161600     -0.1563000    
 H    8.646100       1.948800      -1.002500    


%chk=000138691-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000138691

0 1
S 8.261196 -0.214674 0.054240
O 6.588511 0.614589 0.031343
O 8.492829 -1.022562 -1.331704
O 8.478443 -0.973757 1.469740
C -2.249130 -0.414835 0.000927
C -3.550097 0.419245 -0.006279
C -0.967613 0.448921 0.003716
C -4.831500 -0.444669 -0.009304
C 0.332019 -0.387444 0.011438
C -6.132759 0.389043 -0.015385
C 1.613454 0.476461 0.014642
C -7.414122 -0.475208 -0.017390
C 2.909828 -0.364896 0.021081
C -8.716001 0.357706 -0.019820
C 4.185853 0.512330 0.023163
C -9.997146 -0.507559 -0.025767
C 5.456794 -0.347626 0.038235
C -11.292593 0.333221 -0.027289
C 9.207803 1.427343 0.030471
H -2.238172 -1.083642 -0.885220
H -2.245062 -1.078986 0.890618
H -3.561413 1.087838 0.880110
H -3.554469 1.083761 -0.895811
H -0.971470 1.112724 -0.886169
H -0.978508 1.117529 0.889953
H -4.820797 -1.112847 -0.896004
H -4.827003 -1.109757 0.879730
H 0.334596 -1.051102 0.901338
H 0.342304 -1.055903 -0.874792
H -6.143507 1.057765 0.870887
H -6.137848 1.053605 -0.904861
H 1.604072 1.143310 0.901799
H 1.610568 1.140145 -0.874942
H -7.407611 -1.141683 0.870700
H -7.404666 -1.142134 -0.905139
H 2.917962 -1.031129 -0.866115
H 2.911625 -1.026884 0.911503
H -8.728769 1.022493 0.869462
H -8.722968 1.026231 -0.906363
H 4.198137 1.161706 -0.872882
H 4.186325 1.175405 0.909172
H -9.983836 -1.170909 -0.914775
H -9.988873 -1.175579 0.859792
H 5.503953 -0.971898 0.951721
H 5.511280 -0.993240 -0.859859
H -11.343708 0.982774 0.867091
H -11.338523 0.987404 -0.918574
H -12.193644 -0.307671 -0.031556
H 8.895731 1.969051 0.932308
H 10.273688 1.161878 0.040601
H 8.905142 1.937017 -0.892978


