%chk=000077768.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077768

0 1
 S   -3.804700       1.093400      0.3999000    
 O   -1.210700      -1.495100      0.5043000    
 O   2.7999999E-03   1.883800      0.3858000    
 O   -2.723000      -1.489200      -1.234000    
 O   -1.408500       1.601400      -1.413500    
 C    1.030100      -2.361400      0.4588000    
 C    2.396900       1.846300      0.3674000    
 C    2.110800      -3.030200     -0.3859000    
 C    3.650900       1.700300     -0.4900000    
 C  -0.2472000      -2.136600     -0.3379000    
 C    1.128900       1.724400     -0.4659000    
 C    3.398800      -3.213600      0.4005000    
 C    4.914700       1.865700      0.3387000    
 C   -3.299300     -0.5551000      0.9453000    
 C   -2.294800       1.993000      0.8259000    
 C   -2.419300      -1.226600     -7.8800000E-02
 C   -1.226300       1.799500     -0.2205000    
 H    1.390000      -1.399100      0.8437000    
 H   0.8059000      -2.971500       1.342600    
 H    2.399400       2.815600      0.8818000    
 H    2.387400       1.087200       1.159500    
 H    2.318100      -2.422200      -1.274400    
 H    1.758500      -4.007400     -0.7359000    
 H    3.646100       2.450600      -1.289100    
 H    3.660100      0.7146000     -0.9698000    
 H  -4.5400001E-02  -1.499500      -1.206600    
 H  -0.6501000      -3.096800     -0.6808000    
 H    1.112600       2.501500      -1.239000    
 H    1.089500      0.7407000     -0.9470000    
 H    3.795200      -2.248900      0.7336000    
 H    4.158300      -3.695700     -0.2229000    
 H    3.234100      -3.841000       1.282300    
 H    5.800400       1.756000     -0.2949000    
 H    4.951300       2.855100      0.8056000    
 H    4.966600       1.110000       1.129000    
 H   -2.814000     -0.5059000       1.925200    
 H   -4.189500      -1.180800       1.068400    
 H   -2.521300       3.062400      0.8758000    
 H   -1.940000       1.672200       1.809900    


%chk=000077768-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077768

0 1
S -3.744144 1.119944 0.359190
O -1.628796 -1.581228 0.524111
O 0.302210 1.771802 0.378465
O -3.283191 -2.234010 -0.992226
O -1.042977 0.902497 -1.316718
C 0.723451 -2.198537 0.438626
C 2.731421 1.937550 0.336938
C 1.888959 -2.779132 -0.397605
C 4.037703 1.772192 -0.476087
C -0.605573 -2.281886 -0.312081
C 1.496347 1.645226 -0.514289
C 3.250281 -2.647950 0.318332
C 5.295834 2.077781 0.364364
C -3.823122 -0.708054 0.873166
C -2.003075 1.560790 0.896158
C -2.933960 -1.588956 0.019289
C -0.920255 1.354876 -0.161129
H 0.934338 -1.140309 0.687435
H 0.642951 -2.741301 1.400236
H 2.667015 2.966430 0.739771
H 2.742499 1.252440 1.207158
H 1.933012 -2.259845 -1.376823
H 1.689368 -3.846354 -0.621451
H 4.012187 2.440875 -1.360313
H 4.098587 0.736584 -0.869461
H -0.568507 -1.766629 -1.289607
H -0.935801 -3.324179 -0.474560
H 1.380968 2.360566 -1.349714
H 1.512212 0.623291 -0.937551
H 3.492047 -1.586321 0.519479
H 4.068537 -3.071620 -0.291740
H 3.241985 -3.178353 1.288827
H 6.217157 1.954201 -0.233035
H 5.276247 3.115922 0.745371
H 5.364855 1.401181 1.236764
H -3.554571 -0.780499 1.938521
H -4.876564 -0.985441 0.719486
H -2.028020 2.625377 1.185378
H -1.738313 0.978180 1.794426


