COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.920  -4.719  34.118  1.00  0.00           C  
HETATM    2  C   UNL     1      -8.387  -3.772  35.020  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.708  -4.152  36.322  1.00  0.00           C  
HETATM    4 BR   UNL     1      -9.336  -2.837  37.529  1.00  0.00          Br  
HETATM    5  C   UNL     1      -8.575  -5.482  36.728  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.113  -6.433  35.820  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.775  -6.044  34.519  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.281  -7.061  33.494  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.790  -7.449  33.593  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.875  -6.276  33.167  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.793  -6.094  33.724  1.00  0.00           O  
HETATM   12  O   UNL     1      -5.251  -5.433  32.156  1.00  0.00           O  
HETATM   13  C   UNL     1      -4.174  -5.119  31.253  1.00  0.00           C  
HETATM   14  N   UNL     1      -5.424  -7.962  34.941  1.00  0.00           N  
HETATM   15  C   UNL     1      -5.939  -9.058  35.527  1.00  0.00           C  
HETATM   16  O   UNL     1      -6.804  -9.790  35.044  1.00  0.00           O  
HETATM   17  C   UNL     1      -5.371  -9.364  36.918  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.127 -10.856  37.157  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.769 -11.082  37.828  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.820 -10.946  39.357  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.317 -12.216  40.061  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.263 -13.313  40.054  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.011 -13.938  41.436  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.899 -14.329  41.750  1.00  0.00           O  
HETATM   25  N   UNL     1      -4.046 -14.024  42.247  1.00  0.00           N  
HETATM   26  O   UNL     1      -3.869 -14.564  43.457  1.00  0.00           O  
HETATM   27  H   UNL     1      -7.670  -4.428  33.108  1.00  0.00           H  
HETATM   28  H   UNL     1      -8.501  -2.743  34.713  1.00  0.00           H  
HETATM   29  H   UNL     1      -8.828  -5.771  37.737  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.016  -7.466  36.119  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.870  -7.980  33.633  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.403  -6.582  32.511  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.630  -8.277  32.887  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.737  -7.449  35.455  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.566  -5.039  30.228  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.717  -4.162  31.546  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.417  -5.916  31.295  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.411  -8.838  37.021  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.115  -9.031  37.657  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.920 -11.250  37.810  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.134 -11.376  36.188  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.429 -12.099  37.584  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.083 -10.309  37.451  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.804 -10.728  39.717  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.531 -10.140  39.592  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.562 -11.969  41.104  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.201 -12.585  39.521  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.604 -14.109  39.376  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.318 -12.852  39.730  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.946 -13.692  41.963  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.827 -15.510  43.379  1.00  0.00           H  
CONECT    1    2    7    7   27                                       
CONECT    2    1    3    3   28                                       
CONECT    3    2    2    4    5                                       
CONECT    4    3                                                      
CONECT    5    3    6    6   29                                       
CONECT    6    5    5    7   30                                       
CONECT    7    1    1    6    8                                       
CONECT    8    7    9   31   32                                       
CONECT    9    8   10   14   33                                       
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13                                                 
CONECT   13   12   35   36   37                                       
CONECT   14    9   15   34                                            
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   38   39                                       
CONECT   18   17   19   40   41                                       
CONECT   19   18   20   42   43                                       
CONECT   20   19   21   44   45                                       
CONECT   21   20   22   46   47                                       
CONECT   22   21   23   48   49                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   50                                            
CONECT   26   25   51                                                 
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   14                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
