COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.643   1.219   0.068  1.00  0.00           C  
HETATM    2  C   UNL     1       2.644  -1.264  -0.068  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.928   0.000   0.002  1.00  0.00           C  
HETATM    4  C   UNL     1       0.480   0.000   0.001  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.117   1.178   0.061  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.643  -1.219  -0.064  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.945  -2.415  -0.129  1.00  0.00           C  
HETATM    8  C   UNL     1       0.444  -2.419  -0.131  1.00  0.00           C  
HETATM    9  C   UNL     1       1.167  -1.235  -0.065  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.117  -1.178  -0.060  1.00  0.00           C  
HETATM   11  C   UNL     1       2.644   1.264   0.068  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.766   0.000  -0.007  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.945   2.414   0.132  1.00  0.00           C  
HETATM   14  C   UNL     1       1.166   1.235   0.067  1.00  0.00           C  
HETATM   15  C   UNL     1       0.444   2.419   0.130  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.750   2.214   0.118  1.00  0.00           O  
HETATM   17  O   UNL     1      -3.750  -2.214  -0.116  1.00  0.00           O  
HETATM   18  O   UNL     1       3.260   0.804   1.008  1.00  0.00           O  
HETATM   19  O   UNL     1       3.309  -1.802   0.973  1.00  0.00           O  
HETATM   20  O   UNL     1       3.307   1.801  -0.975  1.00  0.00           O  
HETATM   21  O   UNL     1       3.259  -0.803  -1.009  1.00  0.00           O  
HETATM   22  H   UNL     1      -1.485  -3.349  -0.179  1.00  0.00           H  
HETATM   23  H   UNL     1       0.972  -3.360  -0.181  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.736   0.000  -0.006  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.485   3.349   0.182  1.00  0.00           H  
HETATM   26  H   UNL     1       0.972   3.360   0.180  1.00  0.00           H  
HETATM   27  H   UNL     1       4.275  -1.798   0.926  1.00  0.00           H  
HETATM   28  H   UNL     1       4.273   1.798  -0.929  1.00  0.00           H  
CONECT    1    5    3    3   13                                       
CONECT    2    9   21   21   19                                       
CONECT    3    6    1    1    4                                       
CONECT    4    3    9   14   14                                       
CONECT    5   12   16   16    1                                       
CONECT    6   10    7    7    3                                       
CONECT    7    6    6    8   22                                       
CONECT    8    7    9    9   23                                       
CONECT    9    8    8    4    2                                       
CONECT   10   17   17   12    6                                       
CONECT   11   14   18   18   20                                       
CONECT   12   10    5   24                                            
CONECT   13    1   15   15   25                                       
CONECT   14    4    4   15   11                                       
CONECT   15   13   13   14   26                                       
CONECT   16    5    5                                                 
CONECT   17   10   10                                                 
CONECT   18   11   11                                                 
CONECT   19    2   27                                                 
CONECT   20   11   28                                                 
CONECT   21    2    2                                                 
CONECT   22    7                                                      
CONECT   23    8                                                      
CONECT   24   12                                                      
CONECT   25   13                                                      
CONECT   26   15                                                      
CONECT   27   19                                                      
CONECT   28   20                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
