COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.303  -0.623   0.052  1.00  0.00           O  
HETATM    2 BR   UNL     1       4.768  -1.922   0.170  1.00  0.00          Br  
HETATM    3  C   UNL     1       6.587   1.788  -0.125  1.00  0.00           C  
HETATM    4  C   UNL     1       5.518   2.661  -0.213  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.678  -0.836   0.562  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.264  -1.611  -0.512  1.00  0.00           C  
HETATM    7  C   UNL     1       6.364   0.428  -0.012  1.00  0.00           C  
HETATM    8  C   UNL     1       4.224   2.177  -0.180  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.848   0.133   1.084  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.029  -1.432  -1.067  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.095   0.603  -0.055  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.226   1.630  -0.144  1.00  0.00           C  
HETATM   13  C   UNL     1       1.670   1.295  -0.106  1.00  0.00           C  
HETATM   14  N   UNL     1      -5.545   1.192   0.805  1.00  0.00           N  
HETATM   15  N   UNL     1      -0.804   1.293  -0.111  1.00  0.00           N  
HETATM   16  N   UNL     1      -4.914  -0.052  -0.872  1.00  0.00           N  
HETATM   17  O   UNL     1       2.726   0.336  -0.023  1.00  0.00           O  
HETATM   18  C   UNL     1       0.341   0.585  -0.049  1.00  0.00           C  
HETATM   19  C   UNL     1       5.072  -0.062   0.015  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.555   0.921  -0.087  1.00  0.00           C  
HETATM   21  C   UNL     1       3.997   0.814  -0.060  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.591   0.333   0.531  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.168  -0.460  -0.550  1.00  0.00           C  
HETATM   24  H   UNL     1       7.597   2.168  -0.151  1.00  0.00           H  
HETATM   25  H   UNL     1       5.694   3.722  -0.305  1.00  0.00           H  
HETATM   26  H   UNL     1      -9.658  -0.991   0.989  1.00  0.00           H  
HETATM   27  H   UNL     1      -8.926  -2.364  -0.914  1.00  0.00           H  
HETATM   28  H   UNL     1       7.201  -0.252   0.056  1.00  0.00           H  
HETATM   29  H   UNL     1       3.390   2.860  -0.248  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.175   0.733   1.920  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.717  -2.041  -1.902  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.175   0.056   0.884  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.171  -0.093  -0.890  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.150   2.327   0.691  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.147   2.178  -1.083  1.00  0.00           H  
HETATM   36  H   UNL     1       1.745   1.992   0.729  1.00  0.00           H  
HETATM   37  H   UNL     1       1.749   1.843  -1.045  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.773   2.259  -0.192  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.522   1.864   1.504  1.00  0.00           H  
CONECT    1   18   18                                                 
CONECT    2   19                                                      
CONECT    3    7    7    4   24                                       
CONECT    4    3    8    8   25                                       
CONECT    5    9    9    6   26                                       
CONECT    6    5   10   10   27                                       
CONECT    7    3    3   19   28                                       
CONECT    8    4    4   21   29                                       
CONECT    9    5    5   22   30                                       
CONECT   10    6    6   23   31                                       
CONECT   11   15   12   32   33                                       
CONECT   12   11   20   34   35                                       
CONECT   13   18   17   36   37                                       
CONECT   14   20   22   39                                            
CONECT   15   11   18   38                                            
CONECT   16   20   20   23                                            
CONECT   17   13   21                                                 
CONECT   18    1    1   13   15                                       
CONECT   19    2    7   21   21                                       
CONECT   20   12   14   16   16                                       
CONECT   21    8   17   19   19                                       
CONECT   22    9   14   23   23                                       
CONECT   23   10   16   22   22                                       
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   14                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
