COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.228   1.974   0.534  1.00  0.00           N  
HETATM    2  C   UNL     1       2.703   0.634   2.553  1.00  0.00           C  
HETATM    3  C   UNL     1       3.300   2.970   0.468  1.00  0.00           C  
HETATM    4  O   UNL     1       0.544  -1.064   1.180  1.00  0.00           O  
HETATM    5  C   UNL     1       0.934   0.044   0.881  1.00  0.00           C  
HETATM    6  O   UNL     1       0.535   3.150  -0.390  1.00  0.00           O  
HETATM    7  C   UNL     1       0.960   2.128   0.111  1.00  0.00           C  
HETATM    8  C   UNL     1       2.330   0.605   1.069  1.00  0.00           C  
HETATM    9  C   UNL     1       3.337  -0.197   0.287  1.00  0.00           C  
HETATM   10  C   UNL     1       3.962  -1.282   0.874  1.00  0.00           C  
HETATM   11  C   UNL     1       4.887  -2.018   0.159  1.00  0.00           C  
HETATM   12  C   UNL     1       5.187  -1.669  -1.150  1.00  0.00           C  
HETATM   13  C   UNL     1       4.559  -0.581  -1.737  1.00  0.00           C  
HETATM   14  C   UNL     1       3.631   0.149  -1.019  1.00  0.00           C  
HETATM   15  O   UNL     1       6.097  -2.392  -1.855  1.00  0.00           O  
HETATM   16  N   UNL     1       0.220   1.030   0.304  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.130   0.922  -0.046  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.748   1.947  -0.754  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.076   1.843  -1.101  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.804   0.706  -0.740  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.180  -0.322  -0.028  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.849  -0.214   0.310  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.186   0.594  -1.098  1.00  0.00           C  
HETATM   24  N   UNL     1      -6.282   0.506  -1.382  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.960  -1.551   0.363  1.00  0.00           C  
HETATM   26  F   UNL     1      -4.444  -2.182  -0.788  1.00  0.00           F  
HETATM   27  F   UNL     1      -3.126  -2.430   1.062  1.00  0.00           F  
HETATM   28  F   UNL     1      -5.035  -1.180   1.179  1.00  0.00           F  
HETATM   29  H   UNL     1       1.937   1.175   3.110  1.00  0.00           H  
HETATM   30  H   UNL     1       2.773  -0.386   2.930  1.00  0.00           H  
HETATM   31  H   UNL     1       3.663   1.134   2.677  1.00  0.00           H  
HETATM   32  H   UNL     1       3.885   2.815  -0.438  1.00  0.00           H  
HETATM   33  H   UNL     1       2.866   3.970   0.455  1.00  0.00           H  
HETATM   34  H   UNL     1       3.946   2.866   1.340  1.00  0.00           H  
HETATM   35  H   UNL     1       3.728  -1.553   1.893  1.00  0.00           H  
HETATM   36  H   UNL     1       5.375  -2.865   0.618  1.00  0.00           H  
HETATM   37  H   UNL     1       4.791  -0.307  -2.755  1.00  0.00           H  
HETATM   38  H   UNL     1       3.138   0.994  -1.477  1.00  0.00           H  
HETATM   39  H   UNL     1       5.714  -3.130  -2.349  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.185   2.825  -1.032  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.555   2.640  -1.650  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.365  -1.010   0.856  1.00  0.00           H  
CONECT    1    3    7    8                                            
CONECT    2    8   29   30   31                                       
CONECT    3    1   32   33   34                                       
CONECT    4    5    5                                                 
CONECT    5   16    8    4    4                                       
CONECT    6    7    7                                                 
CONECT    7    6    6    1   16                                       
CONECT    8    1    2    5    9                                       
CONECT    9    8   14   14   10                                       
CONECT   10    9   11   11   35                                       
CONECT   11   10   10   12   36                                       
CONECT   12   13   13   11   15                                       
CONECT   13   14   12   12   37                                       
CONECT   14    9    9   13   38                                       
CONECT   15   12   39                                                 
CONECT   16    7   17    5                                            
CONECT   17   18   16   22   22                                       
CONECT   18   19   19   17   40                                       
CONECT   19   18   18   20   41                                       
CONECT   20   23   19   21   21                                       
CONECT   21   20   20   22   25                                       
CONECT   22   17   17   21   42                                       
CONECT   23   24   24   24   20                                       
CONECT   24   23   23   23                                            
CONECT   25   26   28   21   27                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   22                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
