COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.805   0.767  -0.002  1.00  0.00           C  
HETATM    2  O   UNL     1       3.039  -0.439  -0.001  1.00  0.00           O  
HETATM    3  C   UNL     1       1.687  -0.310  -0.001  1.00  0.00           C  
HETATM    4  C   UNL     1       0.883  -1.443   0.000  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.489  -1.316   0.001  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.071  -0.047   0.000  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.260   1.089  -0.001  1.00  0.00           C  
HETATM    8  C   UNL     1       1.112   0.954   0.004  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.543   0.094   0.000  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.299  -0.968   0.000  1.00  0.00           N  
HETATM   11  N   UNL     1      -3.116   1.347  -0.001  1.00  0.00           N  
HETATM   12  H   UNL     1       3.567   1.348  -0.892  1.00  0.00           H  
HETATM   13  H   UNL     1       3.567   1.350   0.888  1.00  0.00           H  
HETATM   14  H   UNL     1       4.867   0.522  -0.002  1.00  0.00           H  
HETATM   15  H   UNL     1       1.333  -2.424   0.001  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.114  -2.197   0.001  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.706   2.072  -0.001  1.00  0.00           H  
HETATM   18  H   UNL     1       1.740   1.833   0.004  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.896  -1.850   0.000  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.553   2.137  -0.001  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.082   1.439  -0.001  1.00  0.00           H  
CONECT    1    2   12   13   14                                       
CONECT    2    3    1                                                 
CONECT    3    4    4    8    2                                       
CONECT    4    5    3    3   15                                       
CONECT    5    6    6    4   16                                       
CONECT    6    9    5    5    7                                       
CONECT    7    6    8    8   17                                       
CONECT    8    7    7    3   18                                       
CONECT    9   10   10   11    6                                       
CONECT   10    9    9   19                                            
CONECT   11    9   20   21                                            
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    1                                                      
CONECT   15    4                                                      
CONECT   16    5                                                      
CONECT   17    7                                                      
CONECT   18    8                                                      
CONECT   19   10                                                      
CONECT   20   11                                                      
CONECT   21   11                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
