%chk=000116634.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116634

0 1
 S    8.768200     -0.9599000     -0.1299000    
 O    7.650800      3.5200000E-02  0.5152000    
 O    10.04280     -0.8260000      0.8808000    
 O    9.167600     -0.4437000      -1.426200    
 O    8.257500      -2.313100     -1.1100000E-02
 C   -2.083100      0.2810000      0.4424000    
 C   -3.391500      0.4603000     -0.3312000    
 C  -0.8822000      0.7500000     -0.3842000    
 C   -4.632100      2.8000001E-02  0.4575000    
 C   0.4220000      0.6068000      0.4039000    
 C   -5.936600      0.1888000     -0.3277000    
 C    1.656200       1.090000     -0.3644000    
 C   -7.183800     -0.1753000      0.4850000    
 C    2.968600      0.8754000      0.3974000    
 C   -8.483900     -8.7200001E-02 -0.3182000    
 C    4.203400       1.297600     -0.4070000    
 C   -9.693200     -0.4519000      0.5472000    
 C    5.492000       1.063000      0.3258000    
 C   -10.97270     -0.3375000     -0.2276000    
 C    6.465000      0.2642000     -0.1272000    
 C   -11.83490      -1.345600     -0.4005000    
 H   -1.957400     -0.7744000      0.7122000    
 H   -2.132500      0.8512000       1.377800    
 H   -3.341100     -0.1170000      -1.262800    
 H   -3.501300       1.513700     -0.6176000    
 H  -0.8186000      0.1653000      -1.309700    
 H   -1.019600       1.799200     -0.6722000    
 H   -4.521200      -1.020700      0.7594000    
 H   -4.691800      0.6186000       1.380000    
 H   0.3448000       1.170100       1.342100    
 H   0.5602000     -0.4465000      0.6781000    
 H   -5.893300     -0.4408000      -1.225000    
 H   -6.026700       1.226100     -0.6728000    
 H    1.708700      0.5589000      -1.323000    
 H    1.542900       2.155600     -0.5984000    
 H   -7.070900      -1.195300      0.8733000    
 H   -7.248200      0.4892000       1.355600    
 H    2.934000       1.436400       1.339900    
 H    3.057900     -0.1852000      0.6652000    
 H   -8.426600     -0.7618000      -1.181600    
 H   -8.598800      0.9302000     -0.7125000    
 H    4.132800       2.366500     -0.6424000    
 H    4.207100      0.7662000      -1.367000    
 H   -9.569000      -1.465800      0.9467000    
 H   -9.749000      0.2259000       1.407500    
 H    5.632400       1.585400       1.268500    
 H   -11.21300      0.6318000     -0.6566000    
 H    6.375700     -0.2754000      -1.060800    
 H   -12.74850      -1.195900     -0.9654000    
 H   -11.64750      -2.330100      1.3300000E-02
 H    10.82980      -1.369200      0.6407000    


%chk=000116634-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000116634

0 1
S 6.425426 -1.543464 0.979318
O 7.046669 3.057920 -1.118037
O 4.805538 -2.387095 0.892201
O 6.346863 -0.334768 -0.500843
O 6.370875 -0.546542 2.252116
C -1.641199 0.000615 0.200254
C -3.032755 0.530779 -0.212404
C -0.475595 0.867192 -0.327158
C -4.198432 -0.341764 0.305171
C 0.915990 0.333801 0.081098
C -5.589752 0.185528 -0.112412
C 2.081432 1.191976 -0.459614
C -6.754961 -0.690115 0.400787
C 3.470536 0.652118 -0.051422
C -8.144793 -0.163580 -0.021485
C 4.631803 1.478892 -0.639725
C -9.309126 -1.048337 0.499945
C 6.018366 1.051350 -0.127806
C -10.672608 -0.499187 0.136881
C 7.181462 1.904364 -0.656089
C -11.625587 -1.156861 -0.570968
H -1.521152 -1.038816 -0.171107
H -1.584631 -0.056764 1.307615
H -3.086703 0.593784 -1.319522
H -3.156604 1.567999 0.163711
H -0.534314 0.924675 -1.434173
H -0.593785 1.906491 0.044549
H -4.072784 -1.379322 -0.069520
H -4.147003 -0.403419 1.412540
H 0.977032 0.285066 1.189040
H 1.028030 -0.708510 -0.285462
H -5.639807 0.249652 -1.219537
H -5.717255 1.222078 0.264357
H 2.019530 1.238635 -1.566462
H 1.970823 2.234474 -0.096533
H -6.626477 -1.727218 0.026151
H -6.707699 -0.752225 1.508498
H 3.542555 0.647528 1.058967
H 3.562706 -0.395554 -0.404857
H -8.202372 -0.103655 -1.126725
H -8.276233 0.872237 0.355259
H 4.507504 2.548850 -0.383303
H 4.617823 1.416816 -1.743899
H -9.200793 -2.077737 0.105725
H -9.222866 -1.119034 1.605729
H 6.050680 1.135402 0.992222
H -10.879908 0.526800 0.483126
H 8.176007 1.397788 -0.591487
H -12.592747 -0.696171 -0.802624
H -11.463759 -2.178124 -0.938875
H 4.075447 -1.762250 1.179287


