COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.375   0.179   2.228  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.093  -0.114   1.085  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.139  -0.597   0.170  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.460  -0.719   0.613  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.435  -1.171  -0.251  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.109  -1.505  -1.554  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.804  -1.387  -2.000  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.819  -0.931  -1.150  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.672   0.021   0.602  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.465   1.401   0.032  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.086   1.554  -1.289  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.896   2.819  -1.811  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.659   2.514   0.828  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.470   3.780   0.306  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.084   3.932  -1.013  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.712  -0.197   1.773  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.292  -0.183   1.267  1.00  0.00           C  
HETATM   18  C   UNL     1       0.305  -1.358   0.853  1.00  0.00           C  
HETATM   19  C   UNL     1       1.608  -1.346   0.388  1.00  0.00           C  
HETATM   20 BR   UNL     1       2.425  -2.954  -0.180  1.00  0.00          Br  
HETATM   21  C   UNL     1       2.312  -0.156   0.339  1.00  0.00           C  
HETATM   22  C   UNL     1       1.714   1.019   0.754  1.00  0.00           C  
HETATM   23  C   UNL     1       0.411   1.006   1.213  1.00  0.00           C  
HETATM   24  C   UNL     1       3.732  -0.142  -0.167  1.00  0.00           C  
HETATM   25  F   UNL     1       4.542  -0.890   0.695  1.00  0.00           F  
HETATM   26  F   UNL     1       3.776  -0.700  -1.449  1.00  0.00           F  
HETATM   27  P   UNL     1       4.337   1.576  -0.230  1.00  0.00           P  
HETATM   28  O   UNL     1       4.252   2.230   1.239  1.00  0.00           O  
HETATM   29  O   UNL     1       5.742   1.588  -0.695  1.00  0.00           O  
HETATM   30  O   UNL     1       3.428   2.428  -1.250  1.00  0.00           O  
HETATM   31  H   UNL     1      -6.716  -0.459   1.630  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.455  -1.266   0.090  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.876  -1.860  -2.226  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.557  -1.650  -3.019  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.801  -0.839  -1.500  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.479  -0.724  -0.170  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.939   0.684  -1.912  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.600   2.939  -2.843  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.960   2.395   1.859  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.622   4.649   0.928  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.935   4.921  -1.421  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.845   0.600   2.504  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.922  -1.158   2.241  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.246  -2.287   0.892  1.00  0.00           H  
HETATM   45  H   UNL     1       2.265   1.947   0.715  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.058   1.926   1.533  1.00  0.00           H  
HETATM   47  H   UNL     1       4.559   3.146   1.280  1.00  0.00           H  
HETATM   48  H   UNL     1       2.510   2.533  -0.965  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    9                                       
CONECT    3    2    8    8    4                                       
CONECT    4    3    5    5   31                                       
CONECT    5    4    4    6   32                                       
CONECT    6    5    7    7   33                                       
CONECT    7    6    6    8   34                                       
CONECT    8    3    3    7   35                                       
CONECT    9    2   10   16   36                                       
CONECT   10    9   13   13   11                                       
CONECT   11   10   12   12   37                                       
CONECT   12   11   11   15   38                                       
CONECT   13   10   10   14   39                                       
CONECT   14   13   15   15   40                                       
CONECT   15   12   14   14   41                                       
CONECT   16    9   17   42   43                                       
CONECT   17   16   18   18   23                                       
CONECT   18   17   17   19   44                                       
CONECT   19   18   20   21   21                                       
CONECT   20   19                                                      
CONECT   21   19   19   22   24                                       
CONECT   22   21   23   23   45                                       
CONECT   23   17   22   22   46                                       
CONECT   24   21   25   26   27                                       
CONECT   25   24                                                      
CONECT   26   24                                                      
CONECT   27   24   29   29   30                                       
CONECT   27   28                                                      
CONECT   28   27   47                                                 
CONECT   29   27   27                                                 
CONECT   30   27   48                                                 
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   18                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   28                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
