COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.969   0.005   0.001  1.00  0.00           C  
HETATM    2  C   UNL     1       3.680  -1.371  -0.003  1.00  0.00           C  
HETATM    3  C   UNL     1       4.188  -0.122   0.002  1.00  0.00           C  
HETATM    4  C   UNL     1       3.096   0.768   0.002  1.00  0.00           C  
HETATM    5  C   UNL     1       0.582   0.510   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.862   2.317   0.000  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.969   1.491  -0.002  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.787   0.102   0.003  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.482  -0.393   0.004  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.948  -0.816   0.001  1.00  0.00           C  
HETATM   11  N   UNL     1       0.357   1.819   0.001  1.00  0.00           N  
HETATM   12  O   UNL     1       2.340  -1.290  -0.006  1.00  0.00           O  
HETATM   13  O   UNL     1      -4.200  -0.319  -0.005  1.00  0.00           O  
HETATM   14  O   UNL     1      -2.772  -2.018   0.005  1.00  0.00           O  
HETATM   15  H   UNL     1       4.255  -2.284  -0.007  1.00  0.00           H  
HETATM   16  H   UNL     1       5.234   0.146   0.004  1.00  0.00           H  
HETATM   17  H   UNL     1       3.144   1.847   0.003  1.00  0.00           H  
HETATM   18  H   UNL     1      -0.998   3.388   0.000  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.964   1.911  -0.002  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.299  -1.457   0.007  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.926  -0.958  -0.006  1.00  0.00           H  
CONECT    1    4    4   12    5                                       
CONECT    2    3    3   12   15                                       
CONECT    3    4    2    2   16                                       
CONECT    4    3    1    1   17                                       
CONECT    5    1    9    9   11                                       
CONECT    6   11   11    7   18                                       
CONECT    7    8    8    6   19                                       
CONECT    8    9   10    7    7                                       
CONECT    9    5    5    8   20                                       
CONECT   10   14   14   13    8                                       
CONECT   11    5    6    6                                            
CONECT   12    2    1                                                 
CONECT   13   10   21                                                 
CONECT   14   10   10                                                 
CONECT   15    2                                                      
CONECT   16    3                                                      
CONECT   17    4                                                      
CONECT   18    6                                                      
CONECT   19    7                                                      
CONECT   20    9                                                      
CONECT   21   13                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
