COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.870  -0.557  -0.455  1.00  0.00           C  
HETATM    2  C   UNL     1       1.727   0.145   0.280  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.072  -0.241   0.030  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.865   0.445  -0.571  1.00  0.00           O  
HETATM    5  O   UNL     1      -0.729   1.740   0.175  1.00  0.00           O  
HETATM    6  C   UNL     1      -0.756   0.343   0.475  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.364  -1.523   0.302  1.00  0.00           O  
HETATM    8  C   UNL     1       0.387  -0.359  -0.261  1.00  0.00           C  
HETATM    9  C   UNL     1       4.210  -0.053   0.086  1.00  0.00           C  
HETATM   10  H   UNL     1       2.797  -1.633  -0.298  1.00  0.00           H  
HETATM   11  H   UNL     1       2.804  -0.340  -1.521  1.00  0.00           H  
HETATM   12  H   UNL     1       1.793  -0.072   1.346  1.00  0.00           H  
HETATM   13  H   UNL     1       1.800   1.221   0.123  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.828   1.942  -0.766  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.639   0.200   1.549  1.00  0.00           H  
HETATM   16  H   UNL     1      -3.220  -1.852  -0.003  1.00  0.00           H  
HETATM   17  H   UNL     1       0.321  -0.142  -1.327  1.00  0.00           H  
HETATM   18  H   UNL     1       0.314  -1.435  -0.104  1.00  0.00           H  
HETATM   19  H   UNL     1       4.283   1.023  -0.072  1.00  0.00           H  
HETATM   20  H   UNL     1       4.276  -0.270   1.152  1.00  0.00           H  
HETATM   21  H   UNL     1       5.025  -0.553  -0.438  1.00  0.00           H  
CONECT    1    2    9   10   11                                       
CONECT    2    8    1   12   13                                       
CONECT    3    6    4    4    7                                       
CONECT    4    3    3                                                 
CONECT    5    6   14                                                 
CONECT    6    8    3    5   15                                       
CONECT    7    3   16                                                 
CONECT    8    6    2   17   18                                       
CONECT    9    1   19   20   21                                       
CONECT   10    1                                                      
CONECT   11    1                                                      
CONECT   12    2                                                      
CONECT   13    2                                                      
CONECT   14    5                                                      
CONECT   15    6                                                      
CONECT   16    7                                                      
CONECT   17    8                                                      
CONECT   18    8                                                      
CONECT   19    9                                                      
CONECT   20    9                                                      
CONECT   21    9                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
