COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.118   1.751  -0.200  1.00  0.00           C  
HETATM    2  C   UNL     1       1.260  -0.267  -0.092  1.00  0.00           C  
HETATM    3  O   UNL     1      -3.300   1.528  -1.109  1.00  0.00           O  
HETATM    4  C   UNL     1      -2.418   0.987  -0.476  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.499  -0.506  -0.188  1.00  0.00           C  
HETATM    6  N   UNL     1      -1.255  -0.730   0.520  1.00  0.00           N  
HETATM    7  C   UNL     1      -1.003   0.087   1.735  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.419   1.337   1.009  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.373   1.706  -0.038  1.00  0.00           N  
HETATM   10  C   UNL     1       0.915   0.981   0.396  1.00  0.00           C  
HETATM   11  C   UNL     1       1.872   1.992   0.336  1.00  0.00           C  
HETATM   12  C   UNL     1       3.442   0.499  -0.689  1.00  0.00           C  
HETATM   13  C   UNL     1       2.502  -0.514  -0.632  1.00  0.00           C  
HETATM   14  S   UNL     1       0.053  -1.577  -0.033  1.00  0.00           S  
HETATM   15  O   UNL     1       0.446  -2.475   0.996  1.00  0.00           O  
HETATM   16  O   UNL     1      -0.223  -1.965  -1.371  1.00  0.00           O  
HETATM   17  H   UNL     1       3.846   2.548  -0.242  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.355  -0.738   0.445  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.531  -1.082  -1.113  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.926   0.322   2.264  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.269  -0.376   2.395  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.295   2.155   1.718  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.235   2.566  -0.463  1.00  0.00           H  
HETATM   24  H   UNL     1       1.635   2.975   0.715  1.00  0.00           H  
HETATM   25  H   UNL     1       4.419   0.314  -1.112  1.00  0.00           H  
HETATM   26  H   UNL     1       2.745  -1.499  -1.002  1.00  0.00           H  
CONECT    1   11   11   12   17                                       
CONECT    2   14   10   10   13                                       
CONECT    3    4    4                                                 
CONECT    4    9    5    3    3                                       
CONECT    5    6    4   18   19                                       
CONECT    6    7   14    5                                            
CONECT    7    8    6   20   21                                       
CONECT    8    7   10    9   22                                       
CONECT    9    8    4   23                                            
CONECT   10    8    2    2   11                                       
CONECT   11   10    1    1   24                                       
CONECT   12   13   13    1   25                                       
CONECT   13    2   12   12   26                                       
CONECT   14   15   15    6    2                                       
CONECT   14   16   16                                                 
CONECT   15   14   14                                                 
CONECT   16   14   14                                                 
CONECT   17    1                                                      
CONECT   18    5                                                      
CONECT   19    5                                                      
CONECT   20    7                                                      
CONECT   21    7                                                      
CONECT   22    8                                                      
CONECT   23    9                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
