COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.282  -0.003   2.733  1.00  0.00           C  
HETATM    2  N   UNL     1       0.625  -0.002   1.423  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.717   0.000   1.356  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.362   0.000   2.387  1.00  0.00           O  
HETATM    5  N   UNL     1      -1.366   0.000   0.177  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.831   0.002   0.147  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.650   0.000  -1.009  1.00  0.00           C  
HETATM    8  C   UNL     1       0.737  -0.002  -0.955  1.00  0.00           C  
HETATM    9  C   UNL     1       1.376   0.001   0.303  1.00  0.00           C  
HETATM   10  O   UNL     1       2.592   0.005   0.376  1.00  0.00           O  
HETATM   11  N   UNL     1       1.175  -0.002  -2.264  1.00  0.00           N  
HETATM   12  C   UNL     1       0.077   0.000  -3.046  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.996   0.000  -2.299  1.00  0.00           N  
HETATM   14  H   UNL     1       0.984  -0.892   3.288  1.00  0.00           H  
HETATM   15  H   UNL     1       2.363  -0.004   2.597  1.00  0.00           H  
HETATM   16  H   UNL     1       0.987   0.887   3.288  1.00  0.00           H  
HETATM   17  H   UNL     1      -3.214   0.002   1.168  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.182   0.892  -0.373  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.185  -0.887  -0.373  1.00  0.00           H  
HETATM   20  H   UNL     1       2.097  -0.003  -2.564  1.00  0.00           H  
HETATM   21  H   UNL     1       0.084  -0.001  -4.126  1.00  0.00           H  
CONECT    1    2   14   15   16                                       
CONECT    2    1    3    9                                            
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3    6    7                                            
CONECT    6    5   17   18   19                                       
CONECT    7    5    8    8   13                                       
CONECT    8    7    7    9   11                                       
CONECT    9    2    8   10   10                                       
CONECT   10    9    9                                                 
CONECT   11    8   12   20                                            
CONECT   12   11   13   13   21                                       
CONECT   13    7   12   12                                            
CONECT   14    1                                                      
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    6                                                      
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20   11                                                      
CONECT   21   12                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
