%chk=000147843.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147843

0 1
 S   -4.053000      -1.025100     -5.8400001E-02
 O   -3.903800      -1.700000       1.419000    
 O   -5.400800     -0.4976000     -0.1601000    
 O   -3.530500      -1.952500      -1.043200    
 C    1.318700      0.2337000     -4.6999999E-03
 C   0.5562000     -0.9600000     -2.1400001E-02
 C   -1.545100      0.3030000     -2.5599999E-02
 C   0.5925000       1.452200      1.0000000E-03
 C  -0.8488000     -0.9131000     -3.1599998E-02
 C  -0.8146000       1.504700     -9.2000002E-03
 C    2.757100      0.1486000      5.5999998E-03
 C   -2.949800      0.3482000     -3.5700001E-02
 C    3.375700      -1.128900     -1.6000000E-03
 C    1.201400      -2.199700     -2.7899999E-02
 C   -1.507400       2.727800     -3.3000000E-03
 C    1.247200       2.803700      1.7700000E-02
 C   -1.561300      -2.238400     -4.6700001E-02
 C    2.589700      -2.283100     -1.8200001E-02
 C   -3.623000       1.569600     -2.9600000E-02
 C    3.621800       1.272100      2.2600001E-02
 C   -2.902100       2.759000     -1.3300000E-02
 C    4.776100      -1.246700      8.0000004E-03
 C    5.013300       1.141200      3.2000002E-02
 C    5.590500     -0.1189000      2.4599999E-02
 H   0.7355000      -3.171900     -0.1231000    
 H   -1.081100       3.719000      1.0300000E-02
 H    1.811900       2.916500      0.9501000    
 H    1.828900       2.930500     -0.9023000    
 H   0.6629000       3.716100      1.7800000E-02
 H   -2.280400      -2.463500      0.7110000    
 H   -1.612700      -2.674900      -1.050500    
 H  -0.9266000      -2.986400      0.4393000    
 H    3.053000      -3.268200     -4.0899999E-02
 H   -4.703900       1.663600     -3.1199999E-02
 H    3.362000       2.309400      3.1700000E-02
 H   -3.425700       3.710900     -6.8999999E-03
 H    5.248900      -2.227300      2.6000000E-03
 H    5.644100       2.025800      4.5299999E-02
 H    6.670800     -0.2260000      3.2000002E-02
 H   -4.158700      -1.122500       2.176600    


%chk=000147843-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147843

0 1
S -4.064315 -0.916811 -0.814739
O -4.684167 -1.664897 0.793146
O -5.365543 -0.206133 -1.473908
O -3.287363 -2.033347 -1.683437
C 1.378560 0.273764 0.136651
C 0.617066 -0.962688 0.297955
C -1.504413 0.262150 0.153417
C 0.690904 1.506005 0.322522
C -0.808176 -0.971210 0.367676
C -0.745978 1.517123 0.263223
C 2.826217 0.175143 -0.138313
C -2.914392 0.436626 -0.101950
C 3.499552 -1.085883 0.046715
C 1.350064 -2.208529 0.444112
C -1.459575 2.764188 0.311251
C 1.406250 2.800763 0.692938
C -1.530202 -2.252172 0.745662
C 2.724242 -2.260840 0.378179
C -3.586512 1.653436 -0.080818
C 3.597635 1.250873 -0.678376
C -2.842883 2.839979 0.179356
C 4.903849 -1.193096 -0.178397
C 4.976094 1.123669 -0.919459
C 5.646349 -0.096774 -0.638346
H 0.789592 -3.132535 0.600246
H -0.893599 3.692626 0.418035
H 2.427529 2.603637 1.049546
H 1.473098 3.522165 -0.145076
H 0.869264 3.305531 1.515500
H -2.553700 -2.066054 1.101314
H -1.600621 -2.960961 -0.098625
H -1.000141 -2.752904 1.574882
H 3.250257 -3.213397 0.511592
H -4.651803 1.697903 -0.328604
H 3.105471 2.182064 -0.964726
H -3.359207 3.803602 0.213995
H 5.391069 -2.161220 -0.012466
H 5.531600 1.967813 -1.342274
H 6.723499 -0.188259 -0.813657
H -5.496670 -2.200451 0.557061


