COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.698  -2.097  -1.640  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.826  -2.792  -2.036  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.358  -3.770  -1.217  1.00  0.00           C  
HETATM    4  C   UNL     1       5.126   1.286  -0.822  1.00  0.00           C  
HETATM    5  C   UNL     1       6.692  -0.414  -0.197  1.00  0.00           C  
HETATM    6 BR   UNL     1      -3.929   2.560  -0.493  1.00  0.00          Br  
HETATM    7 BR   UNL     1       8.479  -0.977   0.061  1.00  0.00          Br  
HETATM    8  S   UNL     1      -3.160   0.353   1.705  1.00  0.00           S  
HETATM    9  O   UNL     1      -3.816   1.505   2.216  1.00  0.00           O  
HETATM   10  O   UNL     1      -2.569  -0.637   2.534  1.00  0.00           O  
HETATM   11  O   UNL     1       2.036  -0.458   0.896  1.00  0.00           O  
HETATM   12  N   UNL     1      -4.266  -0.432   0.755  1.00  0.00           N  
HETATM   13  N   UNL     1       2.756   0.826  -0.768  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.882   0.939   0.642  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.872  -1.627   0.006  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.602   0.444   0.768  1.00  0.00           C  
HETATM   17  C   UNL     1       0.408   0.905  -0.079  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.104  -2.380  -0.424  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.168   1.892  -0.322  1.00  0.00           C  
HETATM   20  C   UNL     1       0.114   1.865  -1.049  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.170   2.356  -1.161  1.00  0.00           C  
HETATM   22  C   UNL     1       1.783   0.379   0.051  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.640  -3.354   0.397  1.00  0.00           C  
HETATM   24  C   UNL     1       4.077   0.409  -0.576  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.764  -4.053  -0.002  1.00  0.00           C  
HETATM   26  C   UNL     1       4.344  -0.882  -0.139  1.00  0.00           C  
HETATM   27  C   UNL     1       5.650  -1.290   0.049  1.00  0.00           C  
HETATM   28  C   UNL     1       6.430   0.871  -0.638  1.00  0.00           C  
HETATM   29  H   UNL     1      -5.280  -1.336  -2.281  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.290  -2.571  -2.986  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.239  -4.313  -1.527  1.00  0.00           H  
HETATM   32  H   UNL     1       4.922   2.291  -1.162  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.176  -0.100   0.695  1.00  0.00           H  
HETATM   34  H   UNL     1       2.540   1.436  -1.490  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.301  -1.332  -0.875  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.257  -2.266   0.639  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.380  -0.299   1.520  1.00  0.00           H  
HETATM   38  H   UNL     1       0.891   2.225  -1.707  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.398   3.099  -1.911  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.176  -3.575   1.347  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.180  -4.817   0.638  1.00  0.00           H  
HETATM   42  H   UNL     1       3.530  -1.566   0.054  1.00  0.00           H  
HETATM   43  H   UNL     1       5.857  -2.293   0.393  1.00  0.00           H  
HETATM   44  H   UNL     1       7.246   1.552  -0.830  1.00  0.00           H  
CONECT    1    2    2   18   29                                       
CONECT    2    3    1    1   30                                       
CONECT    3   25   25    2   31                                       
CONECT    4   28   28   24   32                                       
CONECT    5    7   27   27   28                                       
CONECT    6   19                                                      
CONECT    7    5                                                      
CONECT    8   12   14   10   10                                       
CONECT    8    9    9                                                 
CONECT    9    8    8                                                 
CONECT   10    8    8                                                 
CONECT   11   22   22                                                 
CONECT   12   15    8   33                                            
CONECT   13   24   22   34                                            
CONECT   14   16   16   19    8                                       
CONECT   15   18   12   35   36                                       
CONECT   16   17   14   14   37                                       
CONECT   17   22   20   20   16                                       
CONECT   18   23   23    1   15                                       
CONECT   19   21   21   14    6                                       
CONECT   20   17   17   21   38                                       
CONECT   21   20   19   19   39                                       
CONECT   22   11   11   13   17                                       
CONECT   23   25   18   18   40                                       
CONECT   24   26   26    4   13                                       
CONECT   25    3    3   23   41                                       
CONECT   26   27   24   24   42                                       
CONECT   27    5    5   26   43                                       
CONECT   28    5    4    4   44                                       
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40   23                                                      
CONECT   41   25                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
CONECT   44   28                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
