COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.400  -1.707   0.196  1.00  0.00           C1+
HETATM    2  C   UNL     1      -1.589  -0.806   0.356  1.00  0.00           C  
HETATM    3  O   UNL     1      -2.712  -1.378  -0.318  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.282   0.570  -0.245  1.00  0.00           C  
HETATM    5  O   UNL     1      -2.261   1.516   0.188  1.00  0.00           O  
HETATM    6  C   UNL     1       0.109   0.997   0.246  1.00  0.00           C  
HETATM    7  O   UNL     1       0.408   2.309  -0.233  1.00  0.00           O  
HETATM    8  C   UNL     1       1.134   0.001  -0.302  1.00  0.00           C  
HETATM    9  C   UNL     1       2.479   0.229   0.391  1.00  0.00           C  
HETATM   10  O   UNL     1       3.470  -0.609  -0.207  1.00  0.00           O  
HETATM   11  O   UNL     1       0.700  -1.354  -0.066  1.00  0.00           O  
HETATM   12  H   UNL     1      -0.561  -2.767   0.330  1.00  0.00           H  
HETATM   13  H   UNL     1      -1.820  -0.695   1.415  1.00  0.00           H  
HETATM   14  H   UNL     1      -2.876  -2.238   0.092  1.00  0.00           H  
HETATM   15  H   UNL     1      -1.287   0.506  -1.333  1.00  0.00           H  
HETATM   16  H   UNL     1      -3.119   1.193  -0.121  1.00  0.00           H  
HETATM   17  H   UNL     1       0.133   0.988   1.336  1.00  0.00           H  
HETATM   18  H   UNL     1      -0.274   2.897   0.119  1.00  0.00           H  
HETATM   19  H   UNL     1       1.251   0.159  -1.374  1.00  0.00           H  
HETATM   20  H   UNL     1       2.388  -0.014   1.449  1.00  0.00           H  
HETATM   21  H   UNL     1       2.772   1.273   0.282  1.00  0.00           H  
HETATM   22  H   UNL     1       4.300  -0.435   0.258  1.00  0.00           H  
CONECT    1    2   11   12                                            
CONECT    2    1    3    4   13                                       
CONECT    3    2   14                                                 
CONECT    4    2    5    6   15                                       
CONECT    5    4   16                                                 
CONECT    6    4    7    8   17                                       
CONECT    7    6   18                                                 
CONECT    8    6    9   11   19                                       
CONECT    9    8   10   20   21                                       
CONECT   10    9   22                                                 
CONECT   11    1    8                                                 
CONECT   12    1                                                      
CONECT   13    2                                                      
CONECT   14    3                                                      
CONECT   15    4                                                      
CONECT   16    5                                                      
CONECT   17    6                                                      
CONECT   18    7                                                      
CONECT   19    8                                                      
CONECT   20    9                                                      
CONECT   21    9                                                      
CONECT   22   10                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
