COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.141   1.419   0.239  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.227  -1.307  -1.316  1.00  0.00           C  
HETATM    3  C   UNL     1       0.537   0.615  -2.691  1.00  0.00           C  
HETATM    4  C   UNL     1       0.201  -0.852  -2.711  1.00  0.00           C  
HETATM    5  C   UNL     1       1.361  -2.515   0.199  1.00  0.00           C  
HETATM    6  C   UNL     1       0.973  -1.331  -0.405  1.00  0.00           C  
HETATM    7  C   UNL     1       2.790  -0.193   0.663  1.00  0.00           C  
HETATM    8  O   UNL     1      -4.219  -0.389   1.356  1.00  0.00           O  
HETATM    9  C   UNL     1      -3.989  -0.353   2.766  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.218   0.068   0.554  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.272  -0.817   0.049  1.00  0.00           C  
HETATM   12  O   UNL     1      -2.346  -2.140   0.356  1.00  0.00           O  
HETATM   13  C   UNL     1      -3.208  -2.946  -0.450  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.254  -0.351  -0.767  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.179   1.000  -1.082  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.122   1.884  -0.578  1.00  0.00           C  
HETATM   17  O   UNL     1      -4.069   2.285   0.729  1.00  0.00           O  
HETATM   18  C   UNL     1      -3.929   3.660   0.365  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.149   1.467  -1.907  1.00  0.00           N  
HETATM   20  O   UNL     1       1.435   1.034  -3.390  1.00  0.00           O  
HETATM   21  C   UNL     1       3.177  -1.376   1.267  1.00  0.00           C  
HETATM   22  C   UNL     1       2.464  -2.536   1.035  1.00  0.00           C  
HETATM   23  F   UNL     1       0.659  -3.648  -0.023  1.00  0.00           F  
HETATM   24  C   UNL     1       1.688  -0.171  -0.173  1.00  0.00           C  
HETATM   25 BR   UNL     1       3.767   1.394   0.980  1.00  0.00          Br  
HETATM   26  H   UNL     1      -0.657  -2.307  -1.376  1.00  0.00           H  
HETATM   27  H   UNL     1       1.078  -1.420  -3.023  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.612  -1.028  -3.415  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.171  -1.027   3.018  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.728   0.662   3.065  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.892  -0.665   3.289  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.110  -3.990  -0.155  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.240  -2.624  -0.312  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.931  -2.837  -1.499  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.063   2.934  -0.822  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.731   4.240   0.820  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.967   4.032   0.716  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.982   3.756  -0.720  1.00  0.00           H  
HETATM   39  H   UNL     1       0.072   2.412  -1.914  1.00  0.00           H  
HETATM   40  H   UNL     1       4.038  -1.392   1.919  1.00  0.00           H  
HETATM   41  H   UNL     1       2.766  -3.460   1.507  1.00  0.00           H  
HETATM   42  H   UNL     1       1.386   0.752  -0.644  1.00  0.00           H  
CONECT    1   16   17   10   10                                       
CONECT    2   14    4    6   26                                       
CONECT    3   19   20   20    4                                       
CONECT    4    3    2   27   28                                       
CONECT    5    6   23   22   22                                       
CONECT    6    2   24   24    5                                       
CONECT    7   24   25   21   21                                       
CONECT    8   10    9                                                 
CONECT    9    8   29   30   31                                       
CONECT   10    1    1    8   11                                       
CONECT   11   10   14   14   12                                       
CONECT   12   11   13                                                 
CONECT   13   12   32   33   34                                       
CONECT   14   15   11   11    2                                       
CONECT   15   16   16   19   14                                       
CONECT   16   15   15    1   35                                       
CONECT   17   18    1                                                 
CONECT   18   17   36   37   38                                       
CONECT   19   15    3   39                                            
CONECT   20    3    3                                                 
CONECT   21    7    7   22   40                                       
CONECT   22    5    5   21   41                                       
CONECT   23    5                                                      
CONECT   24    6    6    7   42                                       
CONECT   25    7                                                      
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   16                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
