COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.277  -2.101   1.416  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.344  -1.252  -0.316  1.00  0.00           C  
HETATM    3  C   UNL     1       2.656   0.126  -1.070  1.00  0.00           C  
HETATM    4  C   UNL     1       2.664  -3.519   1.503  1.00  0.00           C  
HETATM    5  C   UNL     1       2.231  -3.833   0.058  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.446  -0.088  -0.054  1.00  0.00           C  
HETATM    7  C   UNL     1       6.815   1.164   0.026  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.641   2.383   0.393  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.595  -2.499  -0.568  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.744  -1.265  -0.298  1.00  0.00           C  
HETATM   11  C   UNL     1       3.623  -1.988  -0.091  1.00  0.00           C  
HETATM   12  C   UNL     1       4.752   0.257  -0.397  1.00  0.00           C  
HETATM   13  C   UNL     1       0.752  -4.118   0.016  1.00  0.00           C  
HETATM   14  C   UNL     1       5.250   2.546  -0.948  1.00  0.00           C  
HETATM   15  N   UNL     1       5.990   0.139   0.061  1.00  0.00           N  
HETATM   16  N   UNL     1       3.673  -0.584  -0.506  1.00  0.00           N  
HETATM   17  C   UNL     1       4.335   1.493  -0.930  1.00  0.00           C  
HETATM   18  N   UNL     1       3.045   1.343  -1.319  1.00  0.00           N  
HETATM   19  O   UNL     1       2.530  -2.674  -0.739  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.659  -0.058  -0.088  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.368   1.112   0.150  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.764   1.095   0.161  1.00  0.00           C  
HETATM   23  N   UNL     1       6.460   2.341  -0.456  1.00  0.00           N  
HETATM   24  O   UNL     1      -4.194  -3.538  -0.767  1.00  0.00           O  
HETATM   25  O   UNL     1       4.456  -2.005   2.217  1.00  0.00           O  
HETATM   26  N   UNL     1      -2.247  -2.485  -0.579  1.00  0.00           N  
HETATM   27  C   UNL     1      -0.025  -3.437  -0.789  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.248   2.405   0.378  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.350   3.559   0.632  1.00  0.00           C  
HETATM   30  O   UNL     1       3.642  -4.461   1.947  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.416  -2.424  -0.519  1.00  0.00           O  
HETATM   32  O   UNL     1      -7.806  -0.099  -0.041  1.00  0.00           O  
HETATM   33  C   UNL     1      -2.285   4.757   0.836  1.00  0.00           C  
HETATM   34  C   UNL     1      -1.577   3.590   0.599  1.00  0.00           C  
HETATM   35  C   UNL     1      -3.671   4.738   0.858  1.00  0.00           C  
HETATM   36  F   UNL     1      -1.624   5.913   1.058  1.00  0.00           F  
HETATM   37  C   UNL     1      -1.504  -3.722  -0.830  1.00  0.00           C  
HETATM   38  C   UNL     1       4.862   3.894  -1.500  1.00  0.00           C  
HETATM   39  C   UNL     1       4.287   4.759  -0.377  1.00  0.00           C  
HETATM   40  H   UNL     1       2.549  -1.343   1.706  1.00  0.00           H  
HETATM   41  H   UNL     1       1.673  -0.265  -1.285  1.00  0.00           H  
HETATM   42  H   UNL     1       1.802  -3.522   2.171  1.00  0.00           H  
HETATM   43  H   UNL     1       2.785  -4.694  -0.317  1.00  0.00           H  
HETATM   44  H   UNL     1       7.818   1.039   0.407  1.00  0.00           H  
HETATM   45  H   UNL     1       4.569  -2.484  -0.306  1.00  0.00           H  
HETATM   46  H   UNL     1       0.332  -4.885   0.651  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.579  -0.044  -0.096  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.312   2.006   0.351  1.00  0.00           H  
HETATM   49  H   UNL     1       4.305  -2.158   3.160  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.770  -1.656  -0.421  1.00  0.00           H  
HETATM   51  H   UNL     1       0.395  -2.670  -1.423  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.695   1.496   0.193  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.430   3.547   0.640  1.00  0.00           H  
HETATM   54  H   UNL     1       3.312  -5.367   2.020  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.623  -2.587  -1.450  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.209   0.061  -0.906  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.497   3.608   0.587  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.219   5.650   1.043  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.754  -4.457  -0.065  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.771  -4.114  -1.811  1.00  0.00           H  
HETATM   61  H   UNL     1       5.742   4.382  -1.920  1.00  0.00           H  
HETATM   62  H   UNL     1       4.111   3.765  -2.280  1.00  0.00           H  
HETATM   63  H   UNL     1       3.408   4.271   0.043  1.00  0.00           H  
HETATM   64  H   UNL     1       5.038   4.888   0.403  1.00  0.00           H  
HETATM   65  H   UNL     1       4.007   5.733  -0.776  1.00  0.00           H  
CONECT    1   11    4   25   40                                       
CONECT    2   10    9   20   20                                       
CONECT    3   18   18   16   41                                       
CONECT    4    5    1   30   42                                       
CONECT    5   19   13    4   43                                       
CONECT    6   32   10   10   22                                       
CONECT    7   23   15   15   44                                       
CONECT    8   21   28   28   29                                       
CONECT    9   26    2   24   24                                       
CONECT   10   31    6    6    2                                       
CONECT   11   16   19    1   45                                       
CONECT   12   17   17   15   16                                       
CONECT   13   27   27    5   46                                       
CONECT   14   38   23   23   17                                       
CONECT   15    7    7   12                                            
CONECT   16   12    3   11                                            
CONECT   17   14   18   12   12                                       
CONECT   18   17    3    3                                            
CONECT   19   11    5                                                 
CONECT   20    2    2   21   47                                       
CONECT   21   22   22   20    8                                       
CONECT   22    6   21   21   48                                       
CONECT   23   14   14    7                                            
CONECT   24    9    9                                                 
CONECT   25    1   49                                                 
CONECT   26   37    9   50                                            
CONECT   27   37   13   13   51                                       
CONECT   28    8    8   34   52                                       
CONECT   29    8   35   35   53                                       
CONECT   30    4   54                                                 
CONECT   31   10   55                                                 
CONECT   32    6   56                                                 
CONECT   33   34   34   35   36                                       
CONECT   34   28   33   33   57                                       
CONECT   35   29   29   33   58                                       
CONECT   36   33                                                      
CONECT   37   27   26   59   60                                       
CONECT   38   39   14   61   62                                       
CONECT   39   38   63   64   65                                       
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   34                                                      
CONECT   58   35                                                      
CONECT   59   37                                                      
CONECT   60   37                                                      
CONECT   61   38                                                      
CONECT   62   38                                                      
CONECT   63   39                                                      
CONECT   64   39                                                      
CONECT   65   39                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
