COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.600   4.490  -0.116  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.230   3.581   0.942  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.907   2.143   0.626  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.753   1.409  -0.185  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.460   0.094  -0.483  1.00  0.00           C  
HETATM    6  C   UNL     1       0.433  -1.862   0.234  1.00  0.00           C  
HETATM    7  C   UNL     1       1.153  -2.377   1.304  1.00  0.00           C  
HETATM    8  C   UNL     1       2.066  -0.124  -0.023  1.00  0.00           C  
HETATM    9  C   UNL     1       0.893  -0.733  -0.429  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.459   0.250   0.859  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.761   1.565   1.145  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.306  -0.495   0.037  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.985  -1.904  -0.278  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.193  -3.969  -0.889  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.896  -3.793  -0.564  1.00  0.00           C  
HETATM   16  C   UNL     1       2.780  -0.640   1.044  1.00  0.00           C  
HETATM   17  C   UNL     1       4.057   0.026   1.486  1.00  0.00           C  
HETATM   18  C   UNL     1       2.324  -1.765   1.706  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.836  -2.810  -0.705  1.00  0.00           N  
HETATM   20  N   UNL     1      -0.752  -2.485  -0.180  1.00  0.00           N  
HETATM   21 BR   UNL     1       2.693   1.414  -0.925  1.00  0.00          Br  
HETATM   22  H   UNL     1      -1.518   4.352  -0.115  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.998   4.235  -1.098  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.834   5.529   0.113  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.832   3.836   1.924  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.311   3.719   0.941  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.646   1.866  -0.586  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.121  -0.478  -1.116  1.00  0.00           H  
HETATM   29  H   UNL     1       0.797  -3.256   1.822  1.00  0.00           H  
HETATM   30  H   UNL     1       0.335  -0.330  -1.262  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.565  -0.200   1.264  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.102   2.145   1.774  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.638  -4.890  -1.236  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.117  -4.540  -0.604  1.00  0.00           H  
HETATM   35  H   UNL     1       3.831   0.783   2.238  1.00  0.00           H  
HETATM   36  H   UNL     1       4.728  -0.720   1.912  1.00  0.00           H  
HETATM   37  H   UNL     1       4.536   0.499   0.629  1.00  0.00           H  
HETATM   38  H   UNL     1       2.884  -2.166   2.538  1.00  0.00           H  
CONECT    1    2   22   23   24                                       
CONECT    2    1    3   25   26                                       
CONECT    3    4    4   11    2                                       
CONECT    4    5    3    3   27                                       
CONECT    5   12   12    4   28                                       
CONECT    6   20    9    9    7                                       
CONECT    7    6   18   18   29                                       
CONECT    8    9   21   16   16                                       
CONECT    9    6    6    8   30                                       
CONECT   10   12   11   11   31                                       
CONECT   11   10   10    3   32                                       
CONECT   12   13    5    5   10                                       
CONECT   13   19   19   20   12                                       
CONECT   14   19   15   15   33                                       
CONECT   15   14   14   20   34                                       
CONECT   16    8    8   18   17                                       
CONECT   17   16   35   36   37                                       
CONECT   18    7    7   16   38                                       
CONECT   19   14   13   13                                            
CONECT   20   15   13    6                                            
CONECT   21    8                                                      
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
