COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -8.476  -0.742  -0.923  1.00  0.00           F  
HETATM    2  C   UNL     1      -7.899  -0.004   0.116  1.00  0.00           C  
HETATM    3  F   UNL     1      -7.992   1.361  -0.175  1.00  0.00           F  
HETATM    4  F   UNL     1      -8.575  -0.273   1.311  1.00  0.00           F  
HETATM    5  C   UNL     1      -6.449  -0.389   0.261  1.00  0.00           C  
HETATM    6  N   UNL     1      -5.432   0.166  -0.350  1.00  0.00           N  
HETATM    7  C   UNL     1      -4.339  -0.501   0.085  1.00  0.00           C  
HETATM    8  N   UNL     1      -4.753  -1.413   0.926  1.00  0.00           N  
HETATM    9  O   UNL     1      -5.959  -1.358   1.041  1.00  0.00           O  
HETATM   10  C   UNL     1      -2.934  -0.246  -0.317  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.641   0.766  -1.230  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.333   1.005  -1.606  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.308   0.244  -1.082  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.589  -0.773  -0.167  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.906  -1.013   0.221  1.00  0.00           C  
HETATM   16  C   UNL     1       0.510  -1.589   0.394  1.00  0.00           C  
HETATM   17  O   UNL     1       0.264  -2.474   1.191  1.00  0.00           O  
HETATM   18  N   UNL     1       1.783  -1.350   0.023  1.00  0.00           N  
HETATM   19  C   UNL     1       2.872  -2.159   0.579  1.00  0.00           C  
HETATM   20  C   UNL     1       4.206  -1.686  -0.002  1.00  0.00           C  
HETATM   21  C   UNL     1       5.345  -2.530   0.578  1.00  0.00           C  
HETATM   22  C   UNL     1       5.156  -3.989   0.153  1.00  0.00           C  
HETATM   23  O   UNL     1       5.118  -4.067  -1.273  1.00  0.00           O  
HETATM   24  C   UNL     1       4.044  -3.336  -1.869  1.00  0.00           C  
HETATM   25  C   UNL     1       4.188  -1.851  -1.525  1.00  0.00           C  
HETATM   26  C   UNL     1       4.423  -0.237   0.348  1.00  0.00           C  
HETATM   27  N   UNL     1       3.642   0.727   0.003  1.00  0.00           N  
HETATM   28  C   UNL     1       3.979   1.948   0.394  1.00  0.00           C  
HETATM   29  C   UNL     1       5.119   2.000   1.112  1.00  0.00           C  
HETATM   30  S   UNL     1       5.738   0.357   1.264  1.00  0.00           S  
HETATM   31  C   UNL     1       3.174   3.151   0.069  1.00  0.00           C  
HETATM   32  C   UNL     1       3.636   4.417   0.420  1.00  0.00           C  
HETATM   33  C   UNL     1       2.883   5.533   0.115  1.00  0.00           C  
HETATM   34  C   UNL     1       1.672   5.395  -0.538  1.00  0.00           C  
HETATM   35  C   UNL     1       1.208   4.140  -0.889  1.00  0.00           C  
HETATM   36  C   UNL     1       1.955   3.018  -0.593  1.00  0.00           C  
HETATM   37  H   UNL     1      -3.439   1.365  -1.644  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.112   1.791  -2.313  1.00  0.00           H  
HETATM   39  H   UNL     1       0.712   0.436  -1.379  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.127  -1.796   0.932  1.00  0.00           H  
HETATM   41  H   UNL     1       1.980  -0.644  -0.612  1.00  0.00           H  
HETATM   42  H   UNL     1       2.888  -2.049   1.663  1.00  0.00           H  
HETATM   43  H   UNL     1       2.714  -3.206   0.323  1.00  0.00           H  
HETATM   44  H   UNL     1       6.299  -2.162   0.202  1.00  0.00           H  
HETATM   45  H   UNL     1       5.330  -2.463   1.666  1.00  0.00           H  
HETATM   46  H   UNL     1       5.988  -4.587   0.527  1.00  0.00           H  
HETATM   47  H   UNL     1       4.221  -4.369   0.563  1.00  0.00           H  
HETATM   48  H   UNL     1       4.074  -3.463  -2.951  1.00  0.00           H  
HETATM   49  H   UNL     1       3.094  -3.707  -1.485  1.00  0.00           H  
HETATM   50  H   UNL     1       3.346  -1.297  -1.941  1.00  0.00           H  
HETATM   51  H   UNL     1       5.119  -1.468  -1.944  1.00  0.00           H  
HETATM   52  H   UNL     1       5.570   2.890   1.525  1.00  0.00           H  
HETATM   53  H   UNL     1       4.582   4.526   0.930  1.00  0.00           H  
HETATM   54  H   UNL     1       3.241   6.515   0.387  1.00  0.00           H  
HETATM   55  H   UNL     1       1.086   6.271  -0.774  1.00  0.00           H  
HETATM   56  H   UNL     1       0.261   4.039  -1.398  1.00  0.00           H  
HETATM   57  H   UNL     1       1.594   2.039  -0.872  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    4    5                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    2    6    6    9                                       
CONECT    6    5    5    7                                            
CONECT    7    6    8    8   10                                       
CONECT    8    7    7    9                                            
CONECT    9    5    8                                                 
CONECT   10    7   11   11   15                                       
CONECT   11   10   10   12   37                                       
CONECT   12   11   13   13   38                                       
CONECT   13   12   12   14   39                                       
CONECT   14   13   15   15   16                                       
CONECT   15   10   14   14   40                                       
CONECT   16   14   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   41                                            
CONECT   19   18   20   42   43                                       
CONECT   20   19   21   25   26                                       
CONECT   21   20   22   44   45                                       
CONECT   22   21   23   46   47                                       
CONECT   23   22   24                                                 
CONECT   24   23   25   48   49                                       
CONECT   25   20   24   50   51                                       
CONECT   26   20   27   27   30                                       
CONECT   27   26   26   28                                            
CONECT   28   27   29   29   31                                       
CONECT   29   28   28   30   52                                       
CONECT   30   26   29                                                 
CONECT   31   28   32   32   36                                       
CONECT   32   31   31   33   53                                       
CONECT   33   32   34   34   54                                       
CONECT   34   33   33   35   55                                       
CONECT   35   34   36   36   56                                       
CONECT   36   31   35   35   57                                       
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   29                                                      
CONECT   53   32                                                      
CONECT   54   33                                                      
CONECT   55   34                                                      
CONECT   56   35                                                      
CONECT   57   36                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
