COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.940  -1.610   1.887  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.085  -2.141   1.361  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.006  -2.809   0.698  1.00  0.00           C  
HETATM    4  C   UNL     1       0.656  -3.866   1.326  1.00  0.00           C  
HETATM    5  C   UNL     1       1.695  -4.506   0.682  1.00  0.00           C  
HETATM    6  C   UNL     1       2.081  -4.103  -0.584  1.00  0.00           C  
HETATM    7  C   UNL     1       1.429  -3.056  -1.213  1.00  0.00           C  
HETATM    8  C   UNL     1       0.385  -2.412  -0.582  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.328  -1.276  -1.271  1.00  0.00           C  
HETATM   10  N   UNL     1       0.060  -0.008  -0.650  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.892   0.838  -0.172  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.567   1.984   0.390  1.00  0.00           N  
HETATM   13  C   UNL     1       0.705   2.359   0.513  1.00  0.00           C  
HETATM   14  C   UNL     1       1.704   1.552   0.052  1.00  0.00           C  
HETATM   15 BR   UNL     1       3.515   2.072   0.220  1.00  0.00          Br  
HETATM   16  C   UNL     1       1.365   0.324  -0.545  1.00  0.00           C  
HETATM   17  O   UNL     1       2.233  -0.425  -0.963  1.00  0.00           O  
HETATM   18  N   UNL     1      -2.213   0.492  -0.278  1.00  0.00           N  
HETATM   19  C   UNL     1      -3.132   0.693   0.851  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.336   1.508   0.368  1.00  0.00           C  
HETATM   21  N   UNL     1      -5.326   1.608   1.448  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.966   0.812  -0.840  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.946   0.736  -1.978  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.739  -0.082  -1.524  1.00  0.00           C  
HETATM   25  H   UNL     1       0.356  -4.181   2.315  1.00  0.00           H  
HETATM   26  H   UNL     1       2.208  -5.323   1.167  1.00  0.00           H  
HETATM   27  H   UNL     1       2.895  -4.607  -1.084  1.00  0.00           H  
HETATM   28  H   UNL     1       1.736  -2.746  -2.201  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.055  -1.263  -2.326  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.405  -1.413  -1.176  1.00  0.00           H  
HETATM   31  H   UNL     1       0.946   3.304   0.977  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.471  -0.274   1.222  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.620   1.231   1.648  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.007   2.507   0.081  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.130   2.142   1.153  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.599   0.693   1.774  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.273  -0.196  -0.560  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.838   1.377  -1.171  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.403   0.262  -2.846  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.621   1.743  -2.243  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.969  -0.053  -2.294  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.046  -1.114  -1.350  1.00  0.00           H  
CONECT    1    2    2    2                                            
CONECT    2    1    1    1    3                                       
CONECT    3    2    8    4    4                                       
CONECT    4    3    3    5   25                                       
CONECT    5    4    6    6   26                                       
CONECT    6    5    5    7   27                                       
CONECT    7    6   28    8    8                                       
CONECT    8    3    7    7    9                                       
CONECT    9    8   29   30   10                                       
CONECT   10    9   16   11                                            
CONECT   11   10   12   12   18                                       
CONECT   12   11   11   13                                            
CONECT   13   12   14   14   31                                       
CONECT   14   13   13   16   15                                       
CONECT   15   14                                                      
CONECT   16   10   14   17   17                                       
CONECT   17   16   16                                                 
CONECT   18   11   24   19                                            
CONECT   19   18   32   33   20                                       
CONECT   20   19   22   34   21                                       
CONECT   21   20   35   36                                            
CONECT   22   20   23   37   38                                       
CONECT   23   22   24   39   40                                       
CONECT   24   18   23   41   42                                       
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   13                                                      
CONECT   32   19                                                      
CONECT   33   19                                                      
CONECT   34   20                                                      
CONECT   35   21                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
