COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.039   0.731  -0.199  1.00  0.00           C  
HETATM    2  C   UNL     1       0.866  -0.385  -0.041  1.00  0.00           C  
HETATM    3  C   UNL     1       2.328  -0.245  -0.171  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.539   0.735  -0.368  1.00  0.00           C  
HETATM    5  S   UNL     1       3.103   1.184   0.366  1.00  0.00           S  
HETATM    6  N   UNL     1       3.055  -1.243  -0.712  1.00  0.00           N  
HETATM    7  C   UNL     1       0.304  -1.632   0.241  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.330   0.596  -0.076  1.00  0.00           C  
HETATM    9  O   UNL     1      -2.340   1.509  -0.178  1.00  0.00           O  
HETATM   10  O   UNL     1      -3.241  -0.521   0.271  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.885  -0.654   0.200  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.063  -1.760   0.363  1.00  0.00           C  
HETATM   13  H   UNL     1       0.471   1.698  -0.413  1.00  0.00           H  
HETATM   14  H   UNL     1      -4.388   1.218   0.116  1.00  0.00           H  
HETATM   15  H   UNL     1       2.616  -2.053  -1.016  1.00  0.00           H  
HETATM   16  H   UNL     1       4.017  -1.152  -0.797  1.00  0.00           H  
HETATM   17  H   UNL     1       0.940  -2.496   0.364  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.495  -2.725   0.581  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.737   0.589  -1.429  1.00  0.00           H  
CONECT    1    2    2    8   13                                       
CONECT    2    7    3    1    1                                       
CONECT    3    5    5    2    6                                       
CONECT    4   10    9   14   19                                       
CONECT    5    3    3                                                 
CONECT    6    3   15   16                                            
CONECT    7   12   12    2   17                                       
CONECT    8   11   11    1    9                                       
CONECT    9    8    4                                                 
CONECT   10   11    4                                                 
CONECT   11   12   10    8    8                                       
CONECT   12    7    7   11   18                                       
CONECT   13    1                                                      
CONECT   14    4                                                      
CONECT   15    6                                                      
CONECT   16    6                                                      
CONECT   17    7                                                      
CONECT   18   12                                                      
CONECT   19    4                                                      
MASTER        0    0    0    0    0    0    0    0   19    0   19    0
END
