COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.096  -2.980   0.001  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.805  -2.612   0.001  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.937  -3.453   0.002  1.00  0.00           O  
HETATM    4  C   UNL     1      -5.438  -1.150  -0.001  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.016  -1.016  -0.001  1.00  0.00           O  
HETATM    6  C   UNL     1      -3.516   0.245  -0.003  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.374   1.334   0.001  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.864   2.618  -0.001  1.00  0.00           C  
HETATM    9 CL   UNL     1      -4.944   3.977   0.004  1.00  0.00          Cl  
HETATM   10  C   UNL     1      -2.493   2.828  -0.007  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.626   1.757  -0.011  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.130   0.453  -0.003  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.207  -0.698  -0.001  1.00  0.00           C  
HETATM   14  O   UNL     1      -1.649  -1.831   0.001  1.00  0.00           O  
HETATM   15  N   UNL     1       0.125  -0.493  -0.001  1.00  0.00           N  
HETATM   16  C   UNL     1       1.041  -1.637   0.002  1.00  0.00           C  
HETATM   17  C   UNL     1       2.464  -1.140   0.001  1.00  0.00           C  
HETATM   18  C   UNL     1       3.116  -0.910   1.199  1.00  0.00           C  
HETATM   19  C   UNL     1       4.421  -0.456   1.199  1.00  0.00           C  
HETATM   20  C   UNL     1       5.075  -0.230   0.001  1.00  0.00           C  
HETATM   21 BR   UNL     1       6.861   0.392   0.000  1.00  0.00          Br  
HETATM   22  C   UNL     1       4.422  -0.460  -1.197  1.00  0.00           C  
HETATM   23  C   UNL     1       3.119  -0.920  -1.196  1.00  0.00           C  
HETATM   24  H   UNL     1      -7.281  -3.929   0.002  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.848  -0.674  -0.892  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.848  -0.671   0.888  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.443   1.179   0.005  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.102   3.835  -0.008  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.559   1.924  -0.016  1.00  0.00           H  
HETATM   30  H   UNL     1       0.477   0.410  -0.002  1.00  0.00           H  
HETATM   31  H   UNL     1       0.867  -2.240   0.892  1.00  0.00           H  
HETATM   32  H   UNL     1       0.868  -2.243  -0.887  1.00  0.00           H  
HETATM   33  H   UNL     1       2.605  -1.086   2.134  1.00  0.00           H  
HETATM   34  H   UNL     1       4.930  -0.276   2.134  1.00  0.00           H  
HETATM   35  H   UNL     1       4.932  -0.283  -2.132  1.00  0.00           H  
HETATM   36  H   UNL     1       2.610  -1.103  -2.131  1.00  0.00           H  
CONECT    1    2   24                                                 
CONECT    2    3    3    4    1                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   25   26                                       
CONECT    5    4    6                                                 
CONECT    6    7    5   12   12                                       
CONECT    7    8    8    6   27                                       
CONECT    8    9    7    7   10                                       
CONECT    9    8                                                      
CONECT   10    8   11   11   28                                       
CONECT   11   10   10   12   29                                       
CONECT   12    6    6   11   13                                       
CONECT   13   12   15   14   14                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   30                                            
CONECT   16   15   17   31   32                                       
CONECT   17   16   18   18   23                                       
CONECT   18   17   17   19   33                                       
CONECT   19   18   20   20   34                                       
CONECT   20   19   19   22   21                                       
CONECT   21   20                                                      
CONECT   22   23   23   20   35                                       
CONECT   23   17   22   22   36                                       
CONECT   24    1                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    7                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   15                                                      
CONECT   31   16                                                      
CONECT   32   16                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   22                                                      
CONECT   36   23                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
