COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1       4.075   1.960   0.417  1.00  0.00          Cl  
HETATM    2  C   UNL     1       4.708   0.345   0.470  1.00  0.00           C  
HETATM    3  C   UNL     1       6.075   0.135   0.425  1.00  0.00           C  
HETATM    4  C   UNL     1       6.578  -1.151   0.467  1.00  0.00           C  
HETATM    5  C   UNL     1       5.716  -2.229   0.553  1.00  0.00           C  
HETATM    6  C   UNL     1       4.351  -2.020   0.598  1.00  0.00           C  
HETATM    7  C   UNL     1       3.846  -0.734   0.563  1.00  0.00           C  
HETATM    8  C   UNL     1       2.358  -0.506   0.618  1.00  0.00           C  
HETATM    9  C   UNL     1       1.817  -0.322  -0.802  1.00  0.00           C  
HETATM   10  C   UNL     1       2.001  -1.625  -1.607  1.00  0.00           C  
HETATM   11  C   UNL     1       0.701  -1.700  -2.450  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.342  -1.112  -1.466  1.00  0.00           C  
HETATM   13  N   UNL     1       0.376  -0.034  -0.754  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.197   1.031  -0.159  1.00  0.00           C  
HETATM   15  O   UNL     1       0.498   1.903   0.325  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.666   1.138  -0.095  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.292   2.378  -0.296  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.531   3.511  -0.556  1.00  0.00           N  
HETATM   19  C   UNL     1      -2.443   0.006   0.159  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.816   0.113   0.217  1.00  0.00           C  
HETATM   21 BR   UNL     1      -4.866  -1.422   0.562  1.00  0.00          Br  
HETATM   22  C   UNL     1      -4.431   1.340   0.025  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.677   2.467  -0.233  1.00  0.00           C  
HETATM   24  H   UNL     1       6.749   0.977   0.357  1.00  0.00           H  
HETATM   25  H   UNL     1       7.645  -1.315   0.432  1.00  0.00           H  
HETATM   26  H   UNL     1       6.110  -3.234   0.586  1.00  0.00           H  
HETATM   27  H   UNL     1       3.678  -2.862   0.665  1.00  0.00           H  
HETATM   28  H   UNL     1       1.875  -1.366   1.082  1.00  0.00           H  
HETATM   29  H   UNL     1       2.148   0.388   1.205  1.00  0.00           H  
HETATM   30  H   UNL     1       2.342   0.496  -1.295  1.00  0.00           H  
HETATM   31  H   UNL     1       2.876  -1.559  -2.253  1.00  0.00           H  
HETATM   32  H   UNL     1       2.080  -2.483  -0.939  1.00  0.00           H  
HETATM   33  H   UNL     1       0.781  -1.086  -3.347  1.00  0.00           H  
HETATM   34  H   UNL     1       0.459  -2.732  -2.704  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.191  -0.703  -2.014  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.674  -1.876  -0.764  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.576   3.430  -0.705  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.955   4.383  -0.588  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.968  -0.953   0.310  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.508   1.415   0.073  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.164   3.419  -0.387  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    7    7    3                                       
CONECT    3    2    4    4   24                                       
CONECT    4    3    3    5   25                                       
CONECT    5    4    6    6   26                                       
CONECT    6    5    5    7   27                                       
CONECT    7    2    2    6    8                                       
CONECT    8    7    9   28   29                                       
CONECT    9    8   10   13   30                                       
CONECT   10    9   11   31   32                                       
CONECT   11   10   12   33   34                                       
CONECT   12   11   13   35   36                                       
CONECT   13    9   12   14                                            
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   19   19   17                                       
CONECT   17   16   23   23   18                                       
CONECT   18   17   37   38                                            
CONECT   19   16   16   20   39                                       
CONECT   20   19   21   22   22                                       
CONECT   21   20                                                      
CONECT   22   20   20   23   40                                       
CONECT   23   17   17   22   41                                       
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    8                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
