COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.144  -0.302   0.097  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.526   0.646  -0.573  1.00  0.00           C  
HETATM    3  C   UNL     1       0.965   0.456  -0.517  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.347  -0.185  -0.062  1.00  0.00           C  
HETATM    5  C   UNL     1       3.456   0.340  -0.358  1.00  0.00           C  
HETATM    6  C   UNL     1       4.629  -0.339   0.353  1.00  0.00           C  
HETATM    7  O   UNL     1       2.107  -1.666  -0.330  1.00  0.00           O  
HETATM    8  O   UNL     1      -3.285  -1.356  -0.696  1.00  0.00           O  
HETATM    9  O   UNL     1      -3.229  -0.003   1.375  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.164   0.793  -0.599  1.00  0.00           O  
HETATM   11  O   UNL     1       1.002   1.820  -0.090  1.00  0.00           O  
HETATM   12  O   UNL     1      -0.383  -0.235   1.365  1.00  0.00           O  
HETATM   13  O   UNL     1       5.854   0.261  -0.072  1.00  0.00           O  
HETATM   14  S   UNL     1      -3.081  -0.115  -0.034  1.00  0.00           S  
HETATM   15  H   UNL     1       2.076  -0.260   1.184  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.458   1.657  -0.173  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.498   0.683  -1.663  1.00  0.00           H  
HETATM   18  H   UNL     1       1.033   0.414  -1.604  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.415  -1.197  -0.463  1.00  0.00           H  
HETATM   20  H   UNL     1       3.565   0.218  -1.436  1.00  0.00           H  
HETATM   21  H   UNL     1       3.446   1.401  -0.111  1.00  0.00           H  
HETATM   22  H   UNL     1       4.519  -0.217   1.431  1.00  0.00           H  
HETATM   23  H   UNL     1       4.639  -1.400   0.106  1.00  0.00           H  
HETATM   24  H   UNL     1       2.163  -1.779  -1.288  1.00  0.00           H  
HETATM   25  H   UNL     1       0.946   1.933   0.868  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.327   0.632   1.791  1.00  0.00           H  
HETATM   27  H   UNL     1       6.642  -0.121   0.339  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.064   0.509  -0.389  1.00  0.00           H  
CONECT    1    5    7    3   15                                       
CONECT    2    4   14   16   17                                       
CONECT    3    1   11    4   18                                       
CONECT    4    3   12    2   19                                       
CONECT    5    6    1   20   21                                       
CONECT    6   13    5   22   23                                       
CONECT    7    1   24                                                 
CONECT    8   14   14                                                 
CONECT    9   14   14                                                 
CONECT   10   14   28                                                 
CONECT   11    3   25                                                 
CONECT   12    4   26                                                 
CONECT   13    6   27                                                 
CONECT   14    2    8    8    9                                       
CONECT   14    9   10                                                 
CONECT   15    1                                                      
CONECT   16    2                                                      
CONECT   17    2                                                      
CONECT   18    3                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
CONECT   28   10                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
