COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.748  -2.549   0.144  1.00  0.00           C  
HETATM    2  C   UNL     1       3.703  -3.524  -0.057  1.00  0.00           C  
HETATM    3  C   UNL     1       5.048  -3.195  -0.041  1.00  0.00           C  
HETATM    4 CL   UNL     1       6.242  -4.429  -0.295  1.00  0.00          Cl  
HETATM    5  C   UNL     1       5.444  -1.886   0.177  1.00  0.00           C  
HETATM    6  C   UNL     1       4.500  -0.901   0.379  1.00  0.00           C  
HETATM    7  C   UNL     1       3.141  -1.227   0.364  1.00  0.00           C  
HETATM    8  C   UNL     1       2.126  -0.179   0.579  1.00  0.00           C  
HETATM    9  N   UNL     1       0.851  -0.362   0.554  1.00  0.00           N  
HETATM   10  C   UNL     1       2.422   1.275   0.870  1.00  0.00           C  
HETATM   11  N   UNL     1       3.160   1.882  -0.241  1.00  0.00           N  
HETATM   12  C   UNL     1       2.634   1.793  -1.605  1.00  0.00           C  
HETATM   13  C   UNL     1       1.872   3.077  -1.941  1.00  0.00           C  
HETATM   14  C   UNL     1       4.324   2.520  -0.007  1.00  0.00           C  
HETATM   15  O   UNL     1       4.760   2.593   1.122  1.00  0.00           O  
HETATM   16  C   UNL     1       5.084   3.144  -1.149  1.00  0.00           C  
HETATM   17  O   UNL     1       6.275   3.757  -0.651  1.00  0.00           O  
HETATM   18  C   UNL     1       1.027   1.918   1.006  1.00  0.00           C  
HETATM   19  N   UNL     1       0.106   0.791   0.789  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.260   0.864   0.815  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.856   2.020   1.048  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.195   2.064   1.248  1.00  0.00           C  
HETATM   23  N   UNL     1      -4.318   2.101   1.416  1.00  0.00           N  
HETATM   24  N   UNL     1      -2.009  -0.261   0.600  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.305  -0.150   0.085  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.300  -1.018   0.514  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.599   0.832  -0.851  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.879   0.942  -1.360  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.870   0.076  -0.938  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.582  -0.905   0.002  1.00  0.00           C  
HETATM   31  O   UNL     1      -6.558  -1.754   0.419  1.00  0.00           O  
HETATM   32  C   UNL     1      -7.857  -1.579  -0.151  1.00  0.00           C  
HETATM   33  F   UNL     1      -8.326  -0.294   0.141  1.00  0.00           F  
HETATM   34  F   UNL     1      -7.783  -1.744  -1.539  1.00  0.00           F  
HETATM   35  H   UNL     1       1.700  -2.806   0.127  1.00  0.00           H  
HETATM   36  H   UNL     1       3.400  -4.547  -0.226  1.00  0.00           H  
HETATM   37  H   UNL     1       6.494  -1.636   0.188  1.00  0.00           H  
HETATM   38  H   UNL     1       4.810   0.119   0.550  1.00  0.00           H  
HETATM   39  H   UNL     1       2.983   1.373   1.799  1.00  0.00           H  
HETATM   40  H   UNL     1       0.892   2.333   2.005  1.00  0.00           H  
HETATM   41  H   UNL     1       0.883   2.686   0.247  1.00  0.00           H  
HETATM   42  H   UNL     1       3.460   1.667  -2.305  1.00  0.00           H  
HETATM   43  H   UNL     1       1.960   0.940  -1.680  1.00  0.00           H  
HETATM   44  H   UNL     1       0.972   3.136  -1.329  1.00  0.00           H  
HETATM   45  H   UNL     1       2.507   3.940  -1.740  1.00  0.00           H  
HETATM   46  H   UNL     1       1.594   3.069  -2.995  1.00  0.00           H  
HETATM   47  H   UNL     1       5.347   2.374  -1.874  1.00  0.00           H  
HETATM   48  H   UNL     1       4.461   3.898  -1.631  1.00  0.00           H  
HETATM   49  H   UNL     1       6.814   4.179  -1.333  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.642  -1.135   0.804  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.074  -1.781   1.244  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.827   1.511  -1.182  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.107   1.707  -2.088  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.870   0.164  -1.336  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.540  -2.319   0.267  1.00  0.00           H  
CONECT    1    2    7    7   35                                       
CONECT    2    1    3    3   36                                       
CONECT    3    2    2    4    5                                       
CONECT    4    3                                                      
CONECT    5    3    6    6   37                                       
CONECT    6    5    5    7   38                                       
CONECT    7    1    1    6    8                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8   19                                            
CONECT   10    8   11   18   39                                       
CONECT   11   10   12   14                                            
CONECT   12   11   13   42   43                                       
CONECT   13   12   44   45   46                                       
CONECT   14   11   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   47   48                                       
CONECT   17   16   49                                                 
CONECT   18   10   19   40   41                                       
CONECT   19    9   18   20                                            
CONECT   20   19   21   21   24                                       
CONECT   21   20   20   22                                            
CONECT   22   21   23   23   23                                       
CONECT   23   22   22   22                                            
CONECT   24   20   25   50                                            
CONECT   25   24   26   27   27                                       
CONECT   26   25   30   30   51                                       
CONECT   27   25   25   28   52                                       
CONECT   28   27   29   29   53                                       
CONECT   29   28   28   30   54                                       
CONECT   30   26   26   29   31                                       
CONECT   31   30   32                                                 
CONECT   32   31   33   34   55                                       
CONECT   33   32                                                      
CONECT   34   32                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39   10                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   32                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
