%chk=000080066.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080066

0 1
 S   -1.860200      0.3066000      0.4988000    
 S    2.002500     -0.9842000      0.1326000    
 S  -0.9679000     -0.8011000      -1.047600    
 S   0.8542000      0.1312000      -1.221100    
 O   -1.440200       1.694800      0.3625000    
 O   -1.627700     -0.4018000       1.749800    
 O    1.498900     -0.7428000       1.470200    
 O    2.136700      -2.335200     -0.3772000    
 C   -3.561800      0.2085000      0.1203000    
 C    3.587400     -0.2106000      1.3800000E-02
 C   -4.332100     -0.8343000      0.6357000    
 C    3.888200      0.8468000      0.8550000    
 C   -4.151200       1.172500     -0.6977000    
 C    4.498700     -0.6762000     -0.9184000    
 C   -5.691300     -0.9129000      0.3328000    
 C    5.138600       1.457700      0.7609000    
 C   -5.510600       1.093700      -1.000400    
 C    5.749200     -6.5300003E-02  -1.012300    
 C   -6.280500      5.0900001E-02 -0.4851000    
 C    6.069100       1.001700     -0.1726000    
 H   -3.893100      -1.599600       1.269500    
 H    3.175100       1.221000       1.583100    
 H   -3.569500       1.989400      -1.115400    
 H    4.266200      -1.500400      -1.585600    
 H   -6.290800      -1.725600      0.7325000    
 H    5.387200       2.289700       1.413300    
 H   -5.969400       1.843100      -1.638700    
 H    6.473300     -0.4189000      -1.740400    
 H   -7.338800     -1.0900000E-02 -0.7215000    
 H    7.042500       1.477900     -0.2465000    


%chk=000080066-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080066

0 1
S -1.485038 -0.373885 0.934381
S 2.499472 -2.124528 0.020321
S -0.946539 -2.704143 -0.255555
S 0.416257 -2.014943 -1.712612
O -0.404206 0.633561 0.211673
O -1.590570 -0.496049 2.560234
O 1.595815 -2.147759 1.390661
O 3.582430 -3.317363 -0.270099
C -3.191495 0.141771 0.300224
C 3.424865 -0.476264 -0.117150
C -4.299742 -0.130620 1.119345
C 2.728170 0.710664 0.159085
C -3.268990 0.771477 -0.953324
C 4.777724 -0.547853 -0.491319
C -5.572255 0.260592 0.641265
C 3.465314 1.915787 0.065707
C -4.552109 1.153415 -1.409373
C 5.487335 0.672487 -0.573439
C -5.696083 0.894192 -0.617717
C 4.833181 1.896184 -0.295889
H -4.170533 -0.605407 2.097153
H 1.662281 0.710905 0.420020
H -2.364928 0.978174 -1.534091
H 5.252489 -1.513047 -0.693000
H -6.459563 0.071225 1.253882
H 2.961486 2.865038 0.274553
H -4.653252 1.652756 -2.378409
H 6.546105 0.661004 -0.852074
H -6.685675 1.191782 -0.980377
H 5.390755 2.836547 -0.363775


