COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.276   0.766  -2.127  1.00  0.00           C  
HETATM    2  C   UNL     1       2.600   2.411  -0.811  1.00  0.00           C  
HETATM    3  C   UNL     1       2.326   2.084   0.622  1.00  0.00           C  
HETATM    4  N   UNL     1       1.022   1.458   0.753  1.00  0.00           N  
HETATM    5  C   UNL     1       0.036   2.156   1.351  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.329   1.624   1.372  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.384   2.146   2.065  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.489   1.325   1.799  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.067   0.347   0.964  1.00  0.00           C  
HETATM   10  C   UNL     1       0.728   0.132   0.278  1.00  0.00           C  
HETATM   11  C   UNL     1       1.843  -0.786   0.706  1.00  0.00           C  
HETATM   12  C   UNL     1       1.593  -1.803   1.609  1.00  0.00           C  
HETATM   13  C   UNL     1       2.615  -2.646   2.001  1.00  0.00           C  
HETATM   14  F   UNL     1       4.890  -3.296   1.873  1.00  0.00           F  
HETATM   15  C   UNL     1       3.890  -2.472   1.490  1.00  0.00           C  
HETATM   16  C   UNL     1       4.140  -1.454   0.585  1.00  0.00           C  
HETATM   17  C   UNL     1       3.115  -0.615   0.190  1.00  0.00           C  
HETATM   18  C   UNL     1       0.567   0.022  -1.207  1.00  0.00           C  
HETATM   19  C   UNL     1       1.035   0.547  -3.495  1.00  0.00           C  
HETATM   20  C   UNL     1       0.115  -0.379  -3.921  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.371  -0.909  -1.649  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.595  -1.117  -2.992  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.610  -2.135  -3.444  1.00  0.00           C  
HETATM   24  O   UNL     1       3.237   3.420  -1.028  1.00  0.00           O  
HETATM   25  N   UNL     1       2.224   1.722  -1.849  1.00  0.00           N  
HETATM   26  O   UNL     1       0.280   3.227   1.874  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.766   0.535   0.705  1.00  0.00           O  
HETATM   28 BR   UNL     1      -4.138  -1.048   0.271  1.00  0.00          Br  
HETATM   29  H   UNL     1       3.093   1.402   0.989  1.00  0.00           H  
HETATM   30  H   UNL     1       2.348   3.000   1.212  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.369   3.022   2.697  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.489   1.450   2.187  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.195  -0.206   0.749  1.00  0.00           H  
HETATM   34  H   UNL     1       0.599  -1.938   2.007  1.00  0.00           H  
HETATM   35  H   UNL     1       2.420  -3.439   2.707  1.00  0.00           H  
HETATM   36  H   UNL     1       5.134  -1.318   0.186  1.00  0.00           H  
HETATM   37  H   UNL     1       3.308   0.176  -0.519  1.00  0.00           H  
HETATM   38  H   UNL     1       1.585   1.121  -4.226  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.050  -0.534  -4.977  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.927  -1.485  -0.925  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.124  -3.103  -3.568  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.399  -2.218  -2.697  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.041  -1.821  -4.394  1.00  0.00           H  
HETATM   44  H   UNL     1       2.751   1.940  -2.633  1.00  0.00           H  
CONECT    1   19   19   18   25                                       
CONECT    2   25    3   24   24                                       
CONECT    3    2    4   29   30                                       
CONECT    4    3    5   10                                            
CONECT    5   26   26    4    6                                       
CONECT    6    5   27    7    7                                       
CONECT    7    6    6    8   31                                       
CONECT    8    9    9    7   32                                       
CONECT    9   27   28    8    8                                       
CONECT   10   18    4   11   33                                       
CONECT   11   10   17   17   12                                       
CONECT   12   11   13   13   34                                       
CONECT   13   12   12   15   35                                       
CONECT   14   15                                                      
CONECT   15   16   16   13   14                                       
CONECT   16   17   15   15   36                                       
CONECT   17   11   11   16   37                                       
CONECT   18   21   21    1   10                                       
CONECT   19   20    1    1   38                                       
CONECT   20   22   22   19   39                                       
CONECT   21   22   18   18   40                                       
CONECT   22   23   20   20   21                                       
CONECT   23   22   41   42   43                                       
CONECT   24    2    2                                                 
CONECT   25    1    2   44                                            
CONECT   26    5    5                                                 
CONECT   27    6    9                                                 
CONECT   28    9                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
