%chk=000079258.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079258

0 1
 S  -0.5224000      -2.469900     -0.9750000    
 S   0.6215000      -2.559000      0.7339000    
 O   -4.654100       1.508200      0.5416000    
 O    4.658000       1.664400     -0.2985000    
 C   -1.763200      -1.274900     -0.5187000    
 C    1.835100      -1.289400      0.4227000    
 C   -3.706100      0.5958000      0.1942000    
 C    3.731900      0.6955000     -6.2399998E-02
 C   -1.897200     -9.4999999E-02  -1.250600    
 C    1.588400      2.2200000E-02  0.8257000    
 C   -2.600600      -1.519500      0.5696000    
 C    3.028500      -1.610200     -0.2224000    
 C   -2.868600      0.8404000     -0.8941000    
 C    2.537500       1.015200      0.5829000    
 C   -3.572100     -0.5841000      0.9261000    
 C    3.977500     -0.6172000     -0.4650000    
 C   -4.736800       2.692400     -0.2501000    
 C    4.342600       2.985100      0.1401000    
 H   -1.252000      0.1124000      -2.101000    
 H   0.6636000      0.2896000       1.331100    
 H   -2.523200      -2.435800       1.149600    
 H    3.237700      -2.627800     -0.5432000    
 H   -2.917800       1.735300      -1.505000    
 H    2.282500       2.013400      0.9221000    
 H   -4.223200     -0.7810000       1.773500    
 H    4.906400     -0.8721000     -0.9681000    
 H   -3.818400       3.285600     -0.1839000    
 H   -5.543200       3.304500      0.1671000    
 H   -5.010800       2.465700      -1.286000    
 H    3.463600       3.382200     -0.3787000    
 H    5.188900       3.625700     -0.1288000    
 H    4.238900       3.033200       1.229400    


%chk=000079258-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079258

0 1
S -0.684067 -2.843826 -0.784990
S 0.818932 -2.711392 1.031168
O -4.714735 1.508280 0.396636
O 4.561235 1.777908 -0.520490
C -1.858884 -1.503394 -0.407014
C 1.901139 -1.333464 0.532897
C -3.727889 0.564817 0.088791
C 3.633761 0.802828 -0.136790
C -1.670299 -0.217396 -0.970458
C 1.624845 -0.019132 0.983581
C -2.993374 -1.743509 0.416433
C 3.053004 -1.567907 -0.267776
C -2.598766 0.819847 -0.731614
C 2.484845 1.052765 0.657046
C -3.921960 -0.719952 0.663763
C 3.914146 -0.510508 -0.601082
C -4.578845 2.851119 -0.176337
C 4.339788 3.151606 -0.058044
H -0.794511 -0.034564 -1.601515
H 0.734405 0.159203 1.595279
H -3.137496 -2.735873 0.855016
H 3.264065 -2.582430 -0.619998
H -2.434451 1.801897 -1.184814
H 2.254723 2.056877 1.025214
H -4.803052 -0.886627 1.290558
H 4.807848 -0.671710 -1.211229
H -3.650497 3.343735 0.171845
H -5.453807 3.407884 0.189290
H -4.592262 2.818255 -1.282727
H 3.384147 3.556237 -0.443670
H 5.180077 3.730245 -0.468300
H 4.350833 3.209081 1.047431


