COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1       7.785  -0.639  -0.956  1.00  0.00          Cl  
HETATM    2  C   UNL     1       7.098   0.898  -0.531  1.00  0.00           C  
HETATM    3  C   UNL     1       7.841   2.054  -0.679  1.00  0.00           C  
HETATM    4  C   UNL     1       7.294   3.278  -0.341  1.00  0.00           C  
HETATM    5  C   UNL     1       6.001   3.355   0.147  1.00  0.00           C  
HETATM    6  C   UNL     1       5.248   2.210   0.300  1.00  0.00           C  
HETATM    7  C   UNL     1       5.790   0.970  -0.045  1.00  0.00           C  
HETATM    8  C   UNL     1       4.987  -0.260   0.110  1.00  0.00           C  
HETATM    9  O   UNL     1       5.463  -1.338  -0.186  1.00  0.00           O  
HETATM   10  N   UNL     1       3.726  -0.186   0.580  1.00  0.00           N  
HETATM   11  C   UNL     1       2.929  -1.406   0.733  1.00  0.00           C  
HETATM   12  C   UNL     1       3.239  -2.051   2.086  1.00  0.00           C  
HETATM   13  C   UNL     1       1.464  -1.061   0.665  1.00  0.00           C  
HETATM   14  N   UNL     1       0.505  -1.731  -0.044  1.00  0.00           N  
HETATM   15  C   UNL     1       0.693  -2.917  -0.883  1.00  0.00           C  
HETATM   16  N   UNL     1       0.874  -0.073   1.276  1.00  0.00           N  
HETATM   17  N   UNL     1      -0.381  -0.068   0.999  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.663  -1.065   0.192  1.00  0.00           C  
HETATM   19  S   UNL     1      -2.250  -1.469  -0.459  1.00  0.00           S  
HETATM   20  C   UNL     1      -3.242  -0.157   0.295  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.701  -0.308  -0.139  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.485   0.728   0.456  1.00  0.00           O  
HETATM   23  C   UNL     1      -6.814   0.738   0.170  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.634   1.716   0.715  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.351  -0.225  -0.671  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.701  -0.213  -0.962  1.00  0.00           C  
HETATM   27  C   UNL     1      -9.519   0.760  -0.413  1.00  0.00           C  
HETATM   28  F   UNL     1     -10.840   0.771  -0.698  1.00  0.00           F  
HETATM   29  C   UNL     1      -8.984   1.725   0.422  1.00  0.00           C  
HETATM   30  H   UNL     1       8.850   2.000  -1.059  1.00  0.00           H  
HETATM   31  H   UNL     1       7.879   4.178  -0.458  1.00  0.00           H  
HETATM   32  H   UNL     1       5.582   4.315   0.410  1.00  0.00           H  
HETATM   33  H   UNL     1       4.240   2.273   0.681  1.00  0.00           H  
HETATM   34  H   UNL     1       3.345   0.674   0.816  1.00  0.00           H  
HETATM   35  H   UNL     1       3.175  -2.104  -0.067  1.00  0.00           H  
HETATM   36  H   UNL     1       2.646  -2.959   2.200  1.00  0.00           H  
HETATM   37  H   UNL     1       4.299  -2.301   2.135  1.00  0.00           H  
HETATM   38  H   UNL     1       2.993  -1.353   2.886  1.00  0.00           H  
HETATM   39  H   UNL     1       0.560  -3.815  -0.279  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.039  -2.911  -1.690  1.00  0.00           H  
HETATM   41  H   UNL     1       1.698  -2.909  -1.304  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.177  -0.231   1.381  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.866   0.814  -0.026  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.767  -0.234  -1.225  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.078  -1.279   0.182  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.217   2.469   1.367  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.713  -0.984  -1.099  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.623   2.486   0.846  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.119  -0.963  -1.617  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    7    7                                       
CONECT    3    2    4    4   30                                       
CONECT    4    3    3    5   31                                       
CONECT    5    4    6    6   32                                       
CONECT    6    5    5    7   33                                       
CONECT    7    2    2    6    8                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   34                                            
CONECT   11   10   12   13   35                                       
CONECT   12   11   36   37   38                                       
CONECT   13   11   14   16   16                                       
CONECT   14   13   15   18                                            
CONECT   15   14   39   40   41                                       
CONECT   16   13   13   17                                            
CONECT   17   16   18   18                                            
CONECT   18   14   17   17   19                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   42   43                                       
CONECT   21   20   22   44   45                                       
CONECT   22   21   23                                                 
CONECT   23   22   24   25   25                                       
CONECT   24   23   29   29   46                                       
CONECT   25   23   23   26   47                                       
CONECT   26   25   27   27   49                                       
CONECT   27   26   26   28   29                                       
CONECT   28   27                                                      
CONECT   29   24   24   27   48                                       
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   29                                                      
CONECT   49   26                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
