COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -5.027  -2.870   1.193  1.00  0.00          Cl  
HETATM    2  C   UNL     1      -3.424  -2.314   0.830  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.342  -3.158   1.012  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.065  -2.718   0.724  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.229  -1.027   0.359  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.409  -0.111   0.162  1.00  0.00           C  
HETATM    7  O   UNL     1      -3.954   1.152  -0.328  1.00  0.00           O  
HETATM    8  C   UNL     1      -5.056   1.932  -0.485  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.317   1.437  -0.186  1.00  0.00           C  
HETATM   10  N   UNL     1      -7.388   2.192  -0.332  1.00  0.00           N  
HETATM   11  C   UNL     1      -7.309   3.431  -0.774  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.088   3.993  -1.099  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.937   3.236  -0.955  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.953  -0.580   0.075  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.867  -1.427   0.251  1.00  0.00           C  
HETATM   16  N   UNL     1       0.426  -0.979  -0.041  1.00  0.00           N  
HETATM   17  C   UNL     1       1.338  -1.835  -0.543  1.00  0.00           C  
HETATM   18  O   UNL     1       1.011  -2.968  -0.838  1.00  0.00           O  
HETATM   19  C   UNL     1       2.730  -1.398  -0.733  1.00  0.00           C  
HETATM   20  C   UNL     1       3.589  -2.261  -1.223  1.00  0.00           C  
HETATM   21  C   UNL     1       5.040  -1.957  -1.462  1.00  0.00           C  
HETATM   22  F   UNL     1       5.809  -2.538  -0.448  1.00  0.00           F  
HETATM   23  C   UNL     1       3.087   0.010  -0.354  1.00  0.00           C  
HETATM   24  C   UNL     1       4.604   0.150  -0.215  1.00  0.00           C  
HETATM   25  C   UNL     1       5.264  -0.443  -1.465  1.00  0.00           C  
HETATM   26  N   UNL     1       4.964   1.569  -0.092  1.00  0.00           N  
HETATM   27  C   UNL     1       6.393   1.614   0.244  1.00  0.00           C  
HETATM   28  C   UNL     1       6.799   3.054   0.558  1.00  0.00           C  
HETATM   29  O   UNL     1       6.087   3.517   1.705  1.00  0.00           O  
HETATM   30  C   UNL     1       4.700   3.517   1.368  1.00  0.00           C  
HETATM   31  C   UNL     1       4.240   2.088   1.076  1.00  0.00           C  
HETATM   32  H   UNL     1      -2.497  -4.162   1.379  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.221  -3.377   0.866  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.096  -0.554  -0.559  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.921   0.031   1.113  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.421   0.426   0.179  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.211   4.016  -0.884  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.033   5.009  -1.460  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.969   3.649  -1.200  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.801   0.424  -0.292  1.00  0.00           H  
HETATM   41  H   UNL     1       0.665  -0.052   0.117  1.00  0.00           H  
HETATM   42  H   UNL     1       3.232  -3.249  -1.472  1.00  0.00           H  
HETATM   43  H   UNL     1       5.341  -2.369  -2.425  1.00  0.00           H  
HETATM   44  H   UNL     1       2.612   0.261   0.595  1.00  0.00           H  
HETATM   45  H   UNL     1       2.730   0.693  -1.125  1.00  0.00           H  
HETATM   46  H   UNL     1       4.942  -0.392   0.669  1.00  0.00           H  
HETATM   47  H   UNL     1       6.333  -0.232  -1.450  1.00  0.00           H  
HETATM   48  H   UNL     1       4.815  -0.008  -2.358  1.00  0.00           H  
HETATM   49  H   UNL     1       6.582   0.986   1.115  1.00  0.00           H  
HETATM   50  H   UNL     1       6.977   1.247  -0.600  1.00  0.00           H  
HETATM   51  H   UNL     1       7.871   3.094   0.755  1.00  0.00           H  
HETATM   52  H   UNL     1       6.565   3.691  -0.296  1.00  0.00           H  
HETATM   53  H   UNL     1       4.125   3.920   2.202  1.00  0.00           H  
HETATM   54  H   UNL     1       4.541   4.137   0.486  1.00  0.00           H  
HETATM   55  H   UNL     1       3.170   2.086   0.870  1.00  0.00           H  
HETATM   56  H   UNL     1       4.444   1.457   1.940  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3    5                                       
CONECT    3    2    2    4   32                                       
CONECT    4    3   15   15   33                                       
CONECT    5    2    6   14   14                                       
CONECT    6    5    7   34   35                                       
CONECT    7    6    8                                                 
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   36                                       
CONECT   10    9   11   11                                            
CONECT   11   10   10   12   37                                       
CONECT   12   11   13   13   38                                       
CONECT   13    8   12   12   39                                       
CONECT   14    5    5   15   40                                       
CONECT   15    4    4   14   16                                       
CONECT   16   15   17   41                                            
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   20   23                                       
CONECT   20   19   19   21   42                                       
CONECT   21   20   22   25   43                                       
CONECT   22   21                                                      
CONECT   23   19   24   44   45                                       
CONECT   24   23   25   26   46                                       
CONECT   25   21   24   47   48                                       
CONECT   26   24   27   31                                            
CONECT   27   26   28   49   50                                       
CONECT   28   27   29   51   52                                       
CONECT   29   28   30                                                 
CONECT   30   29   31   53   54                                       
CONECT   31   26   30   55   56                                       
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
