COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.776  -0.460   0.355  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.727   0.320   0.051  1.00  0.00           C  
HETATM    3  O   UNL     1      -2.901   1.377  -0.507  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.331  -0.124   0.404  1.00  0.00           C  
HETATM    5  O   UNL     1      -0.395   0.904   0.061  1.00  0.00           O  
HETATM    6  C   UNL     1       0.919   0.553   0.042  1.00  0.00           C  
HETATM    7  C   UNL     1       1.889   1.544   0.079  1.00  0.00           C  
HETATM    8  C   UNL     1       3.228   1.203   0.056  1.00  0.00           C  
HETATM    9  C   UNL     1       3.605  -0.125  -0.006  1.00  0.00           C  
HETATM   10  C   UNL     1       2.644  -1.118  -0.042  1.00  0.00           C  
HETATM   11  C   UNL     1       1.298  -0.783  -0.017  1.00  0.00           C  
HETATM   12  O   UNL     1       0.363  -1.771  -0.045  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.971  -1.385  -0.393  1.00  0.00           C  
HETATM   14  H   UNL     1      -4.652  -0.133   0.109  1.00  0.00           H  
HETATM   15  H   UNL     1      -1.271  -0.335   1.472  1.00  0.00           H  
HETATM   16  H   UNL     1       1.597   2.583   0.126  1.00  0.00           H  
HETATM   17  H   UNL     1       3.982   1.976   0.085  1.00  0.00           H  
HETATM   18  H   UNL     1       4.652  -0.388  -0.026  1.00  0.00           H  
HETATM   19  H   UNL     1       2.941  -2.155  -0.090  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.663  -2.189  -0.142  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.025  -1.173  -1.461  1.00  0.00           H  
CONECT    1    2   14                                                 
CONECT    2    4    3    3    1                                       
CONECT    3    2    2                                                 
CONECT    4    5   13    2   15                                       
CONECT    5    6    4                                                 
CONECT    6    7    7   11    5                                       
CONECT    7    8    6    6   16                                       
CONECT    8    9    9    7   17                                       
CONECT    9    8    8   10   18                                       
CONECT   10    9   11   11   19                                       
CONECT   11   10   10    6   12                                       
CONECT   12   11   13                                                 
CONECT   13   12    4   20   21                                       
CONECT   14    1                                                      
CONECT   15    4                                                      
CONECT   16    7                                                      
CONECT   17    8                                                      
CONECT   18    9                                                      
CONECT   19   10                                                      
CONECT   20   13                                                      
CONECT   21   13                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
