COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.037  -1.046   0.000  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.349  -0.693   0.000  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.413   0.664   0.001  1.00  0.00           N  
HETATM    4  N   UNL     1      -1.104   1.161   0.001  1.00  0.00           N  
HETATM    5  C   UNL     1      -0.273   0.138   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1       1.204   0.218   0.001  1.00  0.00           C  
HETATM    7  S   UNL     1       2.296  -1.160   0.000  1.00  0.00           S  
HETATM    8  C   UNL     1       3.694  -0.093   0.000  1.00  0.00           C  
HETATM    9  C   UNL     1       3.289   1.181   0.001  1.00  0.00           C  
HETATM   10  C   UNL     1       1.921   1.359  -0.004  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.638   1.468   0.001  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.434  -1.566  -0.001  1.00  0.00           N  
HETATM   13  H   UNL     1      -0.649  -2.054   0.003  1.00  0.00           H  
HETATM   14  H   UNL     1       4.724  -0.417   0.000  1.00  0.00           H  
HETATM   15  H   UNL     1       3.982   2.009   0.001  1.00  0.00           H  
HETATM   16  H   UNL     1       1.461   2.336  -0.008  1.00  0.00           H  
HETATM   17  H   UNL     1      -3.942   1.667   1.028  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.453   2.412  -0.513  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.430   0.923  -0.514  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.285  -2.524  -0.002  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.338  -1.215  -0.001  1.00  0.00           H  
CONECT    1    2    2    5   13                                       
CONECT    2    1    1    3   12                                       
CONECT    3    2    4   11                                            
CONECT    4    3    5    5                                            
CONECT    5    1    4    4    6                                       
CONECT    6    5    7   10   10                                       
CONECT    7    6    8                                                 
CONECT    8    7    9    9   14                                       
CONECT    9    8    8   10   15                                       
CONECT   10    6    6    9   16                                       
CONECT   11    3   17   18   19                                       
CONECT   12    2   20   21                                            
CONECT   13    1                                                      
CONECT   14    8                                                      
CONECT   15    9                                                      
CONECT   16   10                                                      
CONECT   17   11                                                      
CONECT   18   11                                                      
CONECT   19   11                                                      
CONECT   20   12                                                      
CONECT   21   12                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
