COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.586   1.702   0.001  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.433   0.606   0.000  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.966  -0.625   0.000  1.00  0.00           N  
HETATM    4  C   UNL     1      -1.217   1.501   0.000  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.933  -2.043   0.000  1.00  0.00           N  
HETATM    6  C   UNL     1       0.395  -1.775   0.000  1.00  0.00           C  
HETATM    7  C   UNL     1       0.592  -0.424   0.000  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.747   0.190   0.000  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.663  -0.876   0.000  1.00  0.00           C  
HETATM   10  C   UNL     1       1.882   0.277   0.000  1.00  0.00           C  
HETATM   11  O   UNL     1       1.913   1.492   0.000  1.00  0.00           O  
HETATM   12  O   UNL     1       3.032  -0.427   0.000  1.00  0.00           O  
HETATM   13  C   UNL     1       4.269   0.332   0.000  1.00  0.00           C  
HETATM   14  H   UNL     1      -2.990   2.704  -0.004  1.00  0.00           H  
HETATM   15  H   UNL     1      -4.501   0.765   0.001  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.532   2.337   0.000  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.316  -2.934   0.001  1.00  0.00           H  
HETATM   18  H   UNL     1       1.179  -2.517   0.000  1.00  0.00           H  
HETATM   19  H   UNL     1       4.310   0.960  -0.890  1.00  0.00           H  
HETATM   20  H   UNL     1       4.310   0.960   0.890  1.00  0.00           H  
HETATM   21  H   UNL     1       5.116  -0.354   0.001  1.00  0.00           H  
CONECT    1    2    4    4   14                                       
CONECT    2    1    3    3   15                                       
CONECT    3    2    2    9                                            
CONECT    4    1    1    8   16                                       
CONECT    5    6    9   17                                            
CONECT    6    5    7    7   18                                       
CONECT    7    6    6    8   10                                       
CONECT    8    4    7    9    9                                       
CONECT    9    3    5    8    8                                       
CONECT   10    7   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13                                                 
CONECT   13   12   19   20   21                                       
CONECT   14    1                                                      
CONECT   15    2                                                      
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    6                                                      
CONECT   19   13                                                      
CONECT   20   13                                                      
CONECT   21   13                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
