COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.333  -0.353  -0.633  1.00  0.00           C  
HETATM    2  C   UNL     1       1.240  -0.454   0.739  1.00  0.00           C  
HETATM    3  C   UNL     1       0.010  -0.309   1.367  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.137  -0.064   0.597  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.027   0.040  -0.791  1.00  0.00           C  
HETATM    6  C   UNL     1       0.202  -0.105  -1.396  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.449   0.091   1.251  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.525   0.114   2.463  1.00  0.00           O  
HETATM    9  O   UNL     1      -3.564   0.209   0.504  1.00  0.00           O  
HETATM   10  N   UNL     1      -0.084  -0.410   2.751  1.00  0.00           N  
HETATM   11  C   UNL     1       0.909   0.058   3.531  1.00  0.00           C  
HETATM   12  O   UNL     1       1.911   0.519   3.025  1.00  0.00           O  
HETATM   13  C   UNL     1       0.776   0.012   5.018  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.224  -0.447   5.523  1.00  0.00           O  
HETATM   15  O   UNL     1       1.769   0.481   5.796  1.00  0.00           O  
HETATM   16  I   UNL     1       0.363   0.044  -3.479  1.00  0.00           I  
HETATM   17  H   UNL     1       2.292  -0.466  -1.116  1.00  0.00           H  
HETATM   18  H   UNL     1       2.126  -0.647   1.326  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.905   0.233  -1.390  1.00  0.00           H  
HETATM   20  H   UNL     1      -4.425   0.311   0.933  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.866  -0.819   3.155  1.00  0.00           H  
HETATM   22  H   UNL     1       1.683   0.451   6.759  1.00  0.00           H  
CONECT    1    2    2    6   17                                       
CONECT    2    1    1    3   18                                       
CONECT    3    2    4    4   10                                       
CONECT    4    3    3    5    7                                       
CONECT    5    4    6    6   19                                       
CONECT    6    1    5    5   16                                       
CONECT    7    4    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   20                                                 
CONECT   10    3   11   21                                            
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   22                                                 
CONECT   16    6                                                      
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    5                                                      
CONECT   20    9                                                      
CONECT   21   10                                                      
CONECT   22   15                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
