COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.286   0.005  -2.020  1.00  0.00           C  
HETATM    2  O   UNL     1      -0.749   0.016  -2.656  1.00  0.00           O  
HETATM    3  O   UNL     1       1.471  -0.007  -2.662  1.00  0.00           O  
HETATM    4  C   UNL     1       0.246   0.004  -0.550  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.987   0.017   0.121  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.014   0.010   1.504  1.00  0.00           C  
HETATM    7  C   UNL     1       0.177   0.002   2.220  1.00  0.00           C  
HETATM    8  C   UNL     1       1.399  -0.009   1.549  1.00  0.00           C  
HETATM    9  C   UNL     1       1.436  -0.008   0.185  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.146   0.030  -0.583  1.00  0.00           O  
HETATM   11  N   UNL     1       0.149   0.001   3.610  1.00  0.00           N  
HETATM   12  H   UNL     1       1.498  -0.006  -3.628  1.00  0.00           H  
HETATM   13  H   UNL     1      -1.959   0.019   2.027  1.00  0.00           H  
HETATM   14  H   UNL     1       2.320  -0.019   2.112  1.00  0.00           H  
HETATM   15  H   UNL     1       2.387  -0.017  -0.327  1.00  0.00           H  
HETATM   16  H   UNL     1      -2.395  -0.892  -0.729  1.00  0.00           H  
HETATM   17  H   UNL     1       0.980  -0.007   4.111  1.00  0.00           H  
HETATM   18  H   UNL     1      -0.699   0.014   4.078  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   12                                                 
CONECT    4    1    5    9    9                                       
CONECT    5    4    6    6   10                                       
CONECT    6    5    5    7   13                                       
CONECT    7    6    8    8   11                                       
CONECT    8    7    7    9   14                                       
CONECT    9    4    4    8   15                                       
CONECT   10    5   16                                                 
CONECT   11    7   17   18                                            
CONECT   12    3                                                      
CONECT   13    6                                                      
CONECT   14    8                                                      
CONECT   15    9                                                      
CONECT   16   10                                                      
CONECT   17   11                                                      
CONECT   18   11                                                      
MASTER        0    0    0    0    0    0    0    0   18    0   18    0
END
