COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -4.762   1.223   0.403  1.00  0.00          Cl  
HETATM    2  C   UNL     1       3.877   1.905  -1.061  1.00  0.00           C  
HETATM    3  C   UNL     1       4.877   0.951  -0.816  1.00  0.00           C  
HETATM    4  C   UNL     1       4.295  -0.074  -0.150  1.00  0.00           C  
HETATM    5  O   UNL     1       2.996   0.207   0.022  1.00  0.00           O  
HETATM    6  C   UNL     1       2.722   1.409  -0.526  1.00  0.00           C  
HETATM    7  C   UNL     1       1.414   2.070  -0.540  1.00  0.00           C  
HETATM    8  O   UNL     1       1.290   3.163  -1.062  1.00  0.00           O  
HETATM    9  N   UNL     1       0.349   1.469   0.026  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.873   2.148   0.115  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.900   3.534   0.115  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.107   4.203   0.203  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.290   3.493   0.291  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.273   2.110   0.292  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.067   1.431   0.197  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.047   0.031   0.191  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.756  -0.500  -0.981  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.643  -2.027  -0.993  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.614  -0.509   1.435  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.501  -2.035   1.423  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.210  -2.567   0.250  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.189  -4.035   0.244  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.101  -4.535  -0.798  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.828  -4.932  -1.629  1.00  0.00           C  
HETATM   25 BR   UNL     1       5.170  -1.643   0.439  1.00  0.00          Br  
HETATM   26  H   UNL     1       3.999   2.850  -1.569  1.00  0.00           H  
HETATM   27  H   UNL     1       5.915   1.021  -1.105  1.00  0.00           H  
HETATM   28  H   UNL     1       0.428   0.566   0.371  1.00  0.00           H  
HETATM   29  H   UNL     1       0.022   4.092   0.046  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.126   5.283   0.203  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.231   4.020   0.360  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.806  -0.213  -0.933  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.310  -0.096  -1.890  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.193  -2.425  -1.846  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.595  -2.313  -1.070  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.065  -0.110   2.288  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.663  -0.222   1.511  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.451  -2.322   1.374  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.947  -2.440   2.332  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.177  -4.384   0.038  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.511  -4.407   1.217  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.479  -5.288  -2.373  1.00  0.00           H  
CONECT    1   14                                                      
CONECT    2    6    6    3   26                                       
CONECT    3    2    4    4   27                                       
CONECT    4    3    3   25    5                                       
CONECT    5    4    6                                                 
CONECT    6    2    2    5    7                                       
CONECT    7    6    9    8    8                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   28                                            
CONECT   10    9   15   11   11                                       
CONECT   11   10   10   12   29                                       
CONECT   12   11   13   13   30                                       
CONECT   13   12   12   14   31                                       
CONECT   14   13    1   15   15                                       
CONECT   15   10   14   14   16                                       
CONECT   16   15   17   19                                            
CONECT   17   16   18   32   33                                       
CONECT   18   17   21   34   35                                       
CONECT   19   16   20   36   37                                       
CONECT   20   19   21   38   39                                       
CONECT   21   20   18   22                                            
CONECT   22   21   23   40   41                                       
CONECT   23   22   24   24   24                                       
CONECT   24   23   23   23   42                                       
CONECT   25    4                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    9                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   17                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
