COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.018  -0.634  -2.401  1.00  0.00           C  
HETATM    2  C   UNL     1       2.733  -0.818  -0.722  1.00  0.00           C  
HETATM    3  C   UNL     1       4.991  -1.850  -0.483  1.00  0.00           C  
HETATM    4  C   UNL     1       5.490  -3.289   1.368  1.00  0.00           C  
HETATM    5  C   UNL     1       4.206  -3.127   1.855  1.00  0.00           C  
HETATM    6  C   UNL     1       3.301  -2.331   1.177  1.00  0.00           C  
HETATM    7  C   UNL     1       2.693   0.605  -0.350  1.00  0.00           C  
HETATM    8  C   UNL     1       3.956   2.574   0.251  1.00  0.00           C  
HETATM    9  C   UNL     1       2.780   3.296   0.372  1.00  0.00           C  
HETATM   10  O   UNL     1      -8.761  -0.703  -1.242  1.00  0.00           O  
HETATM   11  C   UNL     1      -8.385  -0.558  -0.095  1.00  0.00           C  
HETATM   12  O   UNL     1      -9.235  -0.784   0.926  1.00  0.00           O  
HETATM   13  C   UNL     1      -7.000  -0.135   0.179  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.116   0.100  -0.879  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.824   0.495  -0.620  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.396   0.660   0.694  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.088   1.061   0.953  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.060   0.651   0.119  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.323  -0.210  -0.854  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.366  -0.629  -1.666  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.075  -0.153  -1.491  1.00  0.00           C  
HETATM   22  N   UNL     1       2.007  -1.373  -1.624  1.00  0.00           N  
HETATM   23  C   UNL     1       3.691  -1.681   0.002  1.00  0.00           C  
HETATM   24  F   UNL     1       5.377  -1.226  -1.617  1.00  0.00           F  
HETATM   25  C   UNL     1       5.882  -2.654   0.203  1.00  0.00           C  
HETATM   26  F   UNL     1       2.047  -2.174   1.654  1.00  0.00           F  
HETATM   27  C   UNL     1       3.918   1.243  -0.105  1.00  0.00           C  
HETATM   28 CL   UNL     1       5.482   3.347   0.550  1.00  0.00          Cl  
HETATM   29  C   UNL     1       1.568   2.686   0.134  1.00  0.00           C  
HETATM   30  C   UNL     1       1.510   1.335  -0.230  1.00  0.00           C  
HETATM   31  C   UNL     1       0.170   0.756  -0.474  1.00  0.00           C  
HETATM   32  N   UNL     1      -0.843   1.130   0.313  1.00  0.00           N  
HETATM   33  C   UNL     1      -5.273   0.428   1.750  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.568   0.038   1.497  1.00  0.00           C  
HETATM   35  H   UNL     1       0.595  -1.285  -3.166  1.00  0.00           H  
HETATM   36  H   UNL     1       1.497   0.222  -2.878  1.00  0.00           H  
HETATM   37  H   UNL     1       6.886  -2.786  -0.171  1.00  0.00           H  
HETATM   38  H   UNL     1       6.192  -3.912   1.902  1.00  0.00           H  
HETATM   39  H   UNL     1       3.908  -3.626   2.764  1.00  0.00           H  
HETATM   40  H   UNL     1       4.839   0.687  -0.197  1.00  0.00           H  
HETATM   41  H   UNL     1       2.813   4.338   0.653  1.00  0.00           H  
HETATM   42  H   UNL     1       0.654   3.254   0.230  1.00  0.00           H  
HETATM   43  H   UNL     1     -10.134  -1.059   0.696  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.448  -0.029  -1.899  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.249  -0.139   2.317  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.141   0.676  -1.437  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.896   1.626   1.717  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.937   0.557   2.768  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.587  -1.332  -2.455  1.00  0.00           H  
CONECT    1   21   22   35   36                                       
CONECT    2    7   22   22   23                                       
CONECT    3   23   24   25   25                                       
CONECT    4    5    5   25   38                                       
CONECT    5    4    4    6   39                                       
CONECT    6    5   23   23   26                                       
CONECT    7    2   27   30   30                                       
CONECT    8    9   27   27   28                                       
CONECT    9    8   29   29   41                                       
CONECT   10   11   11                                                 
CONECT   11   10   10   12   13                                       
CONECT   12   11   43                                                 
CONECT   13   11   14   34   34                                       
CONECT   14   13   15   15   44                                       
CONECT   15   14   14   16   46                                       
CONECT   16   15   17   33   33                                       
CONECT   17   16   18   47                                            
CONECT   18   17   19   19   32                                       
CONECT   19   18   18   20                                            
CONECT   20   19   21   21   49                                       
CONECT   21    1   20   20   31                                       
CONECT   22    1    2    2                                            
CONECT   23    2    3    6    6                                       
CONECT   24    3                                                      
CONECT   25    3    3    4   37                                       
CONECT   26    6                                                      
CONECT   27    7    8    8   40                                       
CONECT   28    8                                                      
CONECT   29    9    9   30   42                                       
CONECT   30    7    7   29   31                                       
CONECT   31   21   30   32   32                                       
CONECT   32   18   31   31                                            
CONECT   33   16   16   34   48                                       
CONECT   34   13   13   33   45                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37   25                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40   27                                                      
CONECT   41    9                                                      
CONECT   42   29                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   34                                                      
CONECT   46   15                                                      
CONECT   47   17                                                      
CONECT   48   33                                                      
CONECT   49   20                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
