COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.433   3.317   0.218  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.573   2.355  -0.155  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.926   2.455  -0.499  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.708   1.339  -0.517  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.117   0.102  -0.184  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.288  -2.177   0.124  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.942  -2.281   0.466  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.155  -1.165   0.486  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.696  -1.253   0.853  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.371  -1.354  -0.055  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.519   0.028   0.894  1.00  0.00           C  
HETATM   12  C   UNL     1       0.318  -0.231  -0.360  1.00  0.00           C  
HETATM   13  C   UNL     1       2.569   0.132  -1.174  1.00  0.00           C  
HETATM   14  C   UNL     1       4.023   0.138  -0.777  1.00  0.00           C  
HETATM   15  C   UNL     1       4.772  -1.019  -0.881  1.00  0.00           C  
HETATM   16  C   UNL     1       6.108  -1.015  -0.516  1.00  0.00           C  
HETATM   17  C   UNL     1       5.941   1.308   0.058  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.743   0.071   0.154  1.00  0.00           C  
HETATM   19  O   UNL     1      -5.808   3.474  -0.140  1.00  0.00           O  
HETATM   20  N   UNL     1      -8.833  -1.025  -0.185  1.00  0.00           N  
HETATM   21  O   UNL     1      -4.480  -2.403   1.673  1.00  0.00           O  
HETATM   22  C   UNL     1      -3.856  -1.371  -0.421  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.004   0.012   0.529  1.00  0.00           C  
HETATM   24  N   UNL     1       1.745  -0.215  -0.009  1.00  0.00           N  
HETATM   25  F   UNL     1       6.840  -2.145  -0.618  1.00  0.00           F  
HETATM   26  C   UNL     1       6.693   0.149  -0.046  1.00  0.00           C  
HETATM   27 BR   UNL     1       8.516   0.157   0.454  1.00  0.00          Br  
HETATM   28  F   UNL     1       6.511   2.446   0.511  1.00  0.00           F  
HETATM   29  C   UNL     1       4.607   1.302  -0.313  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.048  -1.597  -0.944  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.534  -1.614  -1.310  1.00  0.00           C  
HETATM   32  N   UNL     1      -6.027   1.200   0.160  1.00  0.00           N  
HETATM   33  H   UNL     1      -3.937   4.287   0.190  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.365   2.902   1.224  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.950   2.641  -0.487  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.351   3.416  -0.748  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.754   1.400  -0.780  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.899  -3.068   0.113  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.520  -3.243   0.716  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.404  -0.357   1.399  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.169  -2.131   0.683  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.317  -0.748   1.632  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.258   1.001   1.310  1.00  0.00           H  
HETATM   44  H   UNL     1       0.117   0.545  -1.098  1.00  0.00           H  
HETATM   45  H   UNL     1       2.288   1.120  -1.537  1.00  0.00           H  
HETATM   46  H   UNL     1       2.412  -0.604  -1.963  1.00  0.00           H  
HETATM   47  H   UNL     1       4.316  -1.926  -1.247  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.719  -3.239   1.250  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.095  -2.305  -0.929  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.077  -0.532  -1.081  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.205   0.788  -0.209  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.600   0.197   1.422  1.00  0.00           H  
HETATM   53  H   UNL     1       2.030  -1.099   0.385  1.00  0.00           H  
HETATM   54  H   UNL     1       4.020   2.205  -0.233  1.00  0.00           H  
HETATM   55  H   UNL     1       0.548  -1.782  -1.838  1.00  0.00           H  
HETATM   56  H   UNL     1       0.153  -2.374  -0.206  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.795  -2.587  -1.726  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.735  -0.837  -2.048  1.00  0.00           H  
CONECT    1   19   33   34   35                                       
CONECT    2   32   19    3    3                                       
CONECT    3    2    2    4   36                                       
CONECT    4    5    5    3   37                                       
CONECT    5   18   20    4    4                                       
CONECT    6    7   20   20   38                                       
CONECT    7    8    8    6   39                                       
CONECT    8    9    7    7   18                                       
CONECT    9   22   21    8   40                                       
CONECT   10   23   31   22   41                                       
CONECT   11   12   23   42   43                                       
CONECT   12   24   11   30   44                                       
CONECT   13   14   24   45   46                                       
CONECT   14   15   15   29   13                                       
CONECT   15   16   14   14   47                                       
CONECT   16   25   26   26   15                                       
CONECT   17   26   28   29   29                                       
CONECT   18    8   32   32    5                                       
CONECT   19    1    2                                                 
CONECT   20    6    6    5                                            
CONECT   21    9   48                                                 
CONECT   22   10    9   49   50                                       
CONECT   23   11   10   51   52                                       
CONECT   24   13   12   53                                            
CONECT   25   16                                                      
CONECT   26   27   16   16   17                                       
CONECT   27   26                                                      
CONECT   28   17                                                      
CONECT   29   17   17   14   54                                       
CONECT   30   12   31   55   56                                       
CONECT   31   30   10   57   58                                       
CONECT   32   18   18    2                                            
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
