COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       9.461  -1.956   2.162  1.00  0.00           N  
HETATM    2  C   UNL     1       8.456  -2.140   1.246  1.00  0.00           C  
HETATM    3  N   UNL     1       7.499  -1.243   1.160  1.00  0.00           N  
HETATM    4  C   UNL     1       6.499  -1.380   0.281  1.00  0.00           C  
HETATM    5  N   UNL     1       5.395  -0.635  -0.032  1.00  0.00           N  
HETATM    6  C   UNL     1       4.729  -1.288  -1.028  1.00  0.00           C  
HETATM    7  N   UNL     1       5.361  -2.382  -1.339  1.00  0.00           N  
HETATM    8  C   UNL     1       6.467  -2.496  -0.563  1.00  0.00           C  
HETATM    9  C   UNL     1       7.503  -3.454  -0.460  1.00  0.00           C  
HETATM   10  O   UNL     1       7.514  -4.441  -1.175  1.00  0.00           O  
HETATM   11  N   UNL     1       8.482  -3.244   0.447  1.00  0.00           N  
HETATM   12  C   UNL     1       4.999   0.631   0.590  1.00  0.00           C  
HETATM   13  O   UNL     1       3.602   0.901   0.348  1.00  0.00           O  
HETATM   14  C   UNL     1       3.413   2.316   0.517  1.00  0.00           C  
HETATM   15  C   UNL     1       2.344   2.818  -0.455  1.00  0.00           C  
HETATM   16  O   UNL     1       1.078   2.258  -0.102  1.00  0.00           O  
HETATM   17  P   UNL     1      -0.277   2.571  -0.914  1.00  0.00           P  
HETATM   18  O   UNL     1      -0.079   2.250  -2.345  1.00  0.00           O  
HETATM   19  O   UNL     1      -0.647   4.130  -0.759  1.00  0.00           O  
HETATM   20  O   UNL     1      -1.476   1.673  -0.323  1.00  0.00           O  
HETATM   21  P   UNL     1      -2.905   1.202  -0.894  1.00  0.00           P  
HETATM   22  O   UNL     1      -2.701  -0.052  -1.884  1.00  0.00           O  
HETATM   23  O   UNL     1      -3.534   2.318  -1.635  1.00  0.00           O  
HETATM   24  O   UNL     1      -3.856   0.768   0.331  1.00  0.00           O  
HETATM   25  C   UNL     1      -5.226   0.399   0.161  1.00  0.00           C  
HETATM   26  O   UNL     1      -5.316  -1.009  -0.064  1.00  0.00           O  
HETATM   27  C   UNL     1      -6.648  -1.482  -0.274  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.493  -1.193   0.969  1.00  0.00           C  
HETATM   29  O   UNL     1      -6.954  -1.900   2.088  1.00  0.00           O  
HETATM   30  C   UNL     1      -7.468   0.312   1.255  1.00  0.00           C  
HETATM   31  O   UNL     1      -8.193   0.582   2.456  1.00  0.00           O  
HETATM   32  C   UNL     1      -6.014   0.765   1.422  1.00  0.00           C  
HETATM   33  O   UNL     1      -5.974   2.180   1.617  1.00  0.00           O  
HETATM   34  C   UNL     1      -6.619  -2.990  -0.531  1.00  0.00           C  
HETATM   35  F   UNL     1      -7.923  -3.454  -0.736  1.00  0.00           F  
HETATM   36  F   UNL     1      -5.846  -3.255  -1.668  1.00  0.00           F  
HETATM   37  F   UNL     1      -6.060  -3.641   0.574  1.00  0.00           F  
HETATM   38  C   UNL     1       4.761   2.998   0.212  1.00  0.00           C  
HETATM   39  O   UNL     1       5.216   3.737   1.347  1.00  0.00           O  
HETATM   40  C   UNL     1       5.721   1.822  -0.089  1.00  0.00           C  
HETATM   41  O   UNL     1       7.003   2.046   0.502  1.00  0.00           O  
HETATM   42  H   UNL     1       9.458  -1.173   2.734  1.00  0.00           H  
HETATM   43  H   UNL     1      10.172  -2.612   2.240  1.00  0.00           H  
HETATM   44  H   UNL     1       3.814  -0.947  -1.490  1.00  0.00           H  
HETATM   45  H   UNL     1       9.203  -3.887   0.536  1.00  0.00           H  
HETATM   46  H   UNL     1       5.210   0.614   1.660  1.00  0.00           H  
HETATM   47  H   UNL     1       3.111   2.530   1.543  1.00  0.00           H  
HETATM   48  H   UNL     1       2.287   3.906  -0.403  1.00  0.00           H  
HETATM   49  H   UNL     1       2.605   2.516  -1.470  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.790   4.411   0.155  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.293  -0.822  -1.464  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.642   0.932  -0.695  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.082  -0.975  -1.135  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.520  -1.513   0.794  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.935  -2.861   1.974  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.925   0.848   0.424  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.218   1.518   2.698  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.573   0.264   2.284  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.082   2.537   1.725  1.00  0.00           H  
HETATM   60  H   UNL     1       4.670   3.651  -0.656  1.00  0.00           H  
HETATM   61  H   UNL     1       6.061   4.187   1.210  1.00  0.00           H  
HETATM   62  H   UNL     1       5.813   1.659  -1.163  1.00  0.00           H  
HETATM   63  H   UNL     1       7.494   2.781   0.110  1.00  0.00           H  
CONECT    1    2   42   43                                            
CONECT    2   11    1    3    3                                       
CONECT    3    2    2    4                                            
CONECT    4    8    8    3    5                                       
CONECT    5    4    6   12                                            
CONECT    6    7    7    5   44                                       
CONECT    7    8    6    6                                            
CONECT    8    9    7    4    4                                       
CONECT    9   10   10   11    8                                       
CONECT   10    9    9                                                 
CONECT   11    9    2   45                                            
CONECT   12    5   13   40   46                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   38   47                                       
CONECT   15   14   16   48   49                                       
CONECT   16   17   15                                                 
CONECT   17   20   18   18   16                                       
CONECT   17   19                                                      
CONECT   18   17   17                                                 
CONECT   19   17   50                                                 
CONECT   20   21   17                                                 
CONECT   21   23   23   24   22                                       
CONECT   21   20                                                      
CONECT   22   21   51                                                 
CONECT   23   21   21                                                 
CONECT   24   25   21                                                 
CONECT   25   26   24   32   52                                       
CONECT   26   27   25                                                 
CONECT   27   34   28   26   53                                       
CONECT   28   27   29   30   54                                       
CONECT   29   28   55                                                 
CONECT   30   28   31   32   56                                       
CONECT   31   30   57                                                 
CONECT   32   25   30   33   58                                       
CONECT   33   32   59                                                 
CONECT   34   35   37   36   27                                       
CONECT   35   34                                                      
CONECT   36   34                                                      
CONECT   37   34                                                      
CONECT   38   14   40   39   60                                       
CONECT   39   38   61                                                 
CONECT   40   12   41   38   62                                       
CONECT   41   40   63                                                 
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    6                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   19                                                      
CONECT   51   22                                                      
CONECT   52   25                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
CONECT   60   38                                                      
CONECT   61   39                                                      
CONECT   62   40                                                      
CONECT   63   41                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
