COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.619   1.460  -1.441  1.00  0.00           C  
HETATM    2  N   UNL     1       7.510   1.405  -2.144  1.00  0.00           N  
HETATM    3  C   UNL     1       5.496   1.530  -0.556  1.00  0.00           C  
HETATM    4  C   UNL     1       4.887   0.358  -0.101  1.00  0.00           C  
HETATM    5  C   UNL     1       5.007   2.769  -0.138  1.00  0.00           C  
HETATM    6  C   UNL     1       3.928   2.829   0.719  1.00  0.00           C  
HETATM    7  C   UNL     1       3.330   1.664   1.166  1.00  0.00           C  
HETATM    8  C   UNL     1       3.806   0.432   0.751  1.00  0.00           C  
HETATM    9  C   UNL     1       3.148  -0.832   1.243  1.00  0.00           C  
HETATM   10  C   UNL     1       2.041  -1.222   0.297  1.00  0.00           C  
HETATM   11  O   UNL     1       1.810  -0.541  -0.680  1.00  0.00           O  
HETATM   12  N   UNL     1       1.309  -2.328   0.537  1.00  0.00           N  
HETATM   13  C   UNL     1       1.481  -3.242   1.681  1.00  0.00           C  
HETATM   14  C   UNL     1       0.895  -4.593   1.201  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.314  -4.123   0.350  1.00  0.00           C  
HETATM   16  C   UNL     1       0.201  -2.819  -0.296  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.902  -1.794  -0.338  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.783  -0.750   0.267  1.00  0.00           O  
HETATM   19  N   UNL     1      -2.022  -2.037  -1.048  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.086  -1.138  -1.002  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.952   0.004  -0.345  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.934   0.883  -0.278  1.00  0.00           C  
HETATM   23 BR   UNL     1      -3.679   2.496   0.676  1.00  0.00          Br  
HETATM   24  C   UNL     1      -5.146   0.639  -0.895  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.327  -0.546  -1.593  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.276  -1.446  -1.650  1.00  0.00           C  
HETATM   27  H   UNL     1       5.262  -0.604  -0.417  1.00  0.00           H  
HETATM   28  H   UNL     1       5.473   3.680  -0.486  1.00  0.00           H  
HETATM   29  H   UNL     1       3.552   3.787   1.046  1.00  0.00           H  
HETATM   30  H   UNL     1       2.486   1.716   1.837  1.00  0.00           H  
HETATM   31  H   UNL     1       3.886  -1.632   1.288  1.00  0.00           H  
HETATM   32  H   UNL     1       2.733  -0.663   2.237  1.00  0.00           H  
HETATM   33  H   UNL     1       2.539  -3.351   1.922  1.00  0.00           H  
HETATM   34  H   UNL     1       0.931  -2.874   2.547  1.00  0.00           H  
HETATM   35  H   UNL     1       1.617  -5.134   0.589  1.00  0.00           H  
HETATM   36  H   UNL     1       0.566  -5.201   2.044  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.560  -4.863  -0.413  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.178  -3.923   0.983  1.00  0.00           H  
HETATM   39  H   UNL     1       0.558  -3.021  -1.306  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.087  -2.839  -1.591  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.945   1.364  -0.835  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.265  -0.761  -2.084  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.381  -2.376  -2.188  1.00  0.00           H  
CONECT    1    3    2    2    2                                       
CONECT    2    1    1    1                                            
CONECT    3    5    5    4    1                                       
CONECT    4    8    8    3   27                                       
CONECT    5    6    3    3   28                                       
CONECT    6    7    7    5   29                                       
CONECT    7    6    6    8   30                                       
CONECT    8    7    9    4    4                                       
CONECT    9   10    8   31   32                                       
CONECT   10   11   11   12    9                                       
CONECT   11   10   10                                                 
CONECT   12   16   10   13                                            
CONECT   13   12   14   33   34                                       
CONECT   14   15   13   35   36                                       
CONECT   15   16   14   37   38                                       
CONECT   16   17   12   15   39                                       
CONECT   17   19   16   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   20   17   40                                            
CONECT   20   21   19   26   26                                       
CONECT   21   22   22   20                                            
CONECT   22   23   21   21   24                                       
CONECT   23   22                                                      
CONECT   24   22   25   25   41                                       
CONECT   25   24   24   26   42                                       
CONECT   26   20   20   25   43                                       
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   19                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
