COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  N   UNK     1       1.723  -0.315   1.910  1.00  0.00           N  
HETATM    2  C   UNK     1       0.415   0.353   1.936  1.00  0.00           C  
HETATM    3  C   UNK     1      -0.415  -0.103   0.736  1.00  0.00           C  
HETATM    4  S   UNK     1       0.451   0.324  -0.798  1.00  0.00           S  
HETATM    5  C   UNK     1      -0.729  -0.316  -2.017  1.00  0.00           C  
HETATM    6  C   UNK     1      -0.203  -0.064  -3.406  1.00  0.00           C  
HETATM    7  O   UNK     1       0.859   0.490  -3.559  1.00  0.00           O  
HETATM    8  O   UNK     1      -0.915  -0.457  -4.474  1.00  0.00           O  
HETATM    9  C   UNK     1      -0.304  -0.002   3.211  1.00  0.00           C  
HETATM   10  O   UNK     1      -0.107  -1.071   3.738  1.00  0.00           O  
HETATM   11  O   UNK     1      -1.165   0.868   3.761  1.00  0.00           O  
HETATM   12  H   UNK     1       2.123  -0.134   1.001  1.00  0.00           H  
HETATM   13  H   UNK     1       1.542  -1.306   1.955  1.00  0.00           H  
HETATM   14  H   UNK     1       0.558   1.433   1.889  1.00  0.00           H  
HETATM   15  H   UNK     1      -0.558  -1.183   0.783  1.00  0.00           H  
HETATM   16  H   UNK     1      -1.385   0.392   0.756  1.00  0.00           H  
HETATM   17  H   UNK     1      -0.860  -1.388  -1.866  1.00  0.00           H  
HETATM   18  H   UNK     1      -1.687   0.187  -1.894  1.00  0.00           H  
HETATM   19  H   UNK     1      -0.577  -0.295  -5.366  1.00  0.00           H  
HETATM   20  H   UNK     1      -1.628   0.640   4.579  1.00  0.00           H  
CONECT    1    2   12   13                                            
CONECT    2    1    3    9   14                                       
CONECT    3    2    4   15   16                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   17   18                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6   19                                                 
CONECT    9    2   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   20                                                 
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    2                                                      
CONECT   15    3                                                      
CONECT   16    3                                                      
CONECT   17    5                                                      
CONECT   18    5                                                      
CONECT   19    8                                                      
CONECT   20   11                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
