%chk=000070207.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070207

0 1
 S    4.409600     -0.2444000     -5.8699999E-02
 O   0.6967000      -1.091400      0.2270000    
 O   6.1799999E-02   1.883100     -0.1436000    
 O    4.303200      -1.856500      0.1568000    
 O    5.209400      0.3215000       1.008200    
 O    4.691500      2.5699999E-02  -1.453900    
 O    2.042300      -1.249700      -1.638200    
 O    1.186800       2.666600       1.711000    
 C    2.703900      0.1330000      0.2523000    
 C    2.386400       1.583400     -0.1113000    
 C   -1.420300      -2.174400      0.5718000    
 C   -2.483500      -3.094100     -2.4700001E-02
 C   -2.305600       1.982700     -0.5425000    
 C   -3.664800       2.410500      6.6000000E-03
 C  -0.2530000      -1.970900     -0.3836000    
 C    1.807800     -0.8136000     -0.5190000    
 C   -1.177700       2.321600      0.4218000    
 C   -3.671000      -3.259400      0.9231000    
 C   -4.795500       2.028800     -0.9482000    
 C    1.172500       2.122000      0.6159000    
 C   -4.747000      -4.147300      0.3186000    
 C   -6.153500       2.422800     -0.3894000    
 H    2.562200     -4.2199999E-02   1.326400    
 H    3.220000       2.246000      0.1543000    
 H    2.244500       1.710300      -1.192000    
 H   -1.857200      -1.199300      0.8214000    
 H   -1.048800      -2.586400       1.518200    
 H   -2.832200      -2.679800     -0.9787000    
 H   -2.043600      -4.075500     -0.2401000    
 H   -2.116500       2.466700      -1.508700    
 H   -2.298400      0.9039000     -0.7424000    
 H   -3.671300       3.494700      0.1719000    
 H   -3.832300       1.934100      0.9804000    
 H  -0.6064000      -1.524000      -1.320200    
 H   0.2296000      -2.931100     -0.5997000    
 H   -1.136800       3.404200      0.5889000    
 H   -1.335900       1.812600       1.379800    
 H   -3.333300      -3.695200       1.870500    
 H   -4.103700      -2.278600       1.152900    
 H   -4.646900       2.520600      -1.916600    
 H   -4.782400      0.9474000      -1.127800    
 H   -5.130000      -3.720300     -0.6137000    
 H   -4.355600      -5.146900      0.1039000    
 H   -5.585900      -4.252900       1.013600    
 H   -6.346600       1.919700      0.5635000    
 H   -6.211600       3.503600     -0.2258000    
 H   -6.947100       2.141800      -1.088700    
 H    4.169000      -2.152400       1.087900    


%chk=000070207-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070207

0 1
S 1.968617 -0.572321 0.698406
O -0.397883 -2.667816 0.669923
O -1.494576 2.857117 -0.767269
O 2.267047 -1.697028 -0.754501
O 2.285263 -1.356731 2.068917
O 2.717787 0.835096 0.408625
O -1.029570 -1.767104 -1.393038
O -1.703225 1.701087 1.246318
C 0.007877 -0.356028 0.334188
C -0.182164 0.880124 -0.528221
C -0.479656 -4.992963 1.376795
C -0.817659 -6.458559 1.013969
C -2.598981 4.937428 -1.381227
C -3.549311 6.086102 -0.965472
C -0.775785 -4.045935 0.216395
C -0.522026 -1.655537 -0.255572
C -2.458139 3.896256 -0.272930
C -0.521932 -7.438642 2.172456
C -3.713318 7.150891 -2.074147
C -1.204170 1.822558 0.102450
C -0.853041 -8.903590 1.816168
C -4.646225 8.307852 -1.656337
H -0.356776 -0.217510 1.369579
H 0.767776 1.443688 -0.639218
H -0.505830 0.592525 -1.543197
H -1.065264 -4.679831 2.262168
H 0.588666 -4.906402 1.651063
H -1.888800 -6.538698 0.733885
H -0.236493 -6.766655 0.119937
H -1.599871 5.347080 -1.624107
H -2.978850 4.447140 -2.297894
H -3.164233 6.574391 -0.046257
H -4.546456 5.673182 -0.706571
H -1.845864 -4.034288 -0.061589
H -0.179229 -4.277485 -0.685346
H -2.050830 4.325836 0.660802
H -3.414822 3.394787 -0.037763
H 0.547392 -7.356495 2.453932
H -1.103022 -7.132193 3.065649
H -2.715907 7.555308 -2.340775
H -4.108101 6.665886 -2.989727
H -1.923823 -9.019201 1.562948
H -0.263467 -9.243237 0.943737
H -0.630535 -9.583136 2.658962
H -5.657659 7.933236 -1.409991
H -4.254857 8.829512 -0.762696
H -4.750329 9.054501 -2.464583
H 3.241051 -1.923202 -0.769645


