COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.069  -0.662   0.115  1.00  0.00           C  
HETATM    2  C   UNL     1       6.872  -1.255   0.326  1.00  0.00           C  
HETATM    3  C   UNL     1       4.525  -0.611  -0.001  1.00  0.00           C  
HETATM    4  C   UNL     1       2.283   0.155  -0.375  1.00  0.00           C  
HETATM    5  N   UNL     1       0.411  -1.274   0.161  1.00  0.00           N  
HETATM    6  C   UNL     1      -0.464  -0.196   0.244  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.696   0.672   0.249  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.826   1.565   0.261  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.994  -0.134   0.674  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.501  -1.559   0.441  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.731  -0.295  -1.472  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.987   3.079   0.495  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.737   2.093   0.489  1.00  0.00           C  
HETATM   14  O   UNL     1      10.181   1.079  -0.529  1.00  0.00           O  
HETATM   15  C   UNL     1       8.885   1.623  -0.787  1.00  0.00           C  
HETATM   16  C   UNL     1       7.832   0.614  -0.408  1.00  0.00           C  
HETATM   17  N   UNL     1       5.909  -0.387  -0.056  1.00  0.00           N  
HETATM   18  N   UNL     1       6.538   0.779  -0.513  1.00  0.00           N  
HETATM   19  C   UNL     1       3.645   0.374  -0.429  1.00  0.00           C  
HETATM   20  C   UNL     1       1.792  -1.051   0.107  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.824  -0.424   0.164  1.00  0.00           C  
HETATM   22  N   UNL     1      -4.022   0.525   0.179  1.00  0.00           N  
HETATM   23  O   UNL     1      -6.166   1.372   0.186  1.00  0.00           O  
HETATM   24  C   UNL     1      -6.619   0.027   0.021  1.00  0.00           C  
HETATM   25  N   UNL     1      -8.592  -1.818  -1.001  1.00  0.00           N  
HETATM   26  C   UNL     1      -7.275  -1.715  -1.643  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.332   2.865   0.424  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.131   1.965   0.413  1.00  0.00           C  
HETATM   29  N   UNL     1       0.029   1.031   0.403  1.00  0.00           N  
HETATM   30  C   UNL     1       2.673  -2.043   0.525  1.00  0.00           C  
HETATM   31  F   UNL     1       2.197  -3.221   0.983  1.00  0.00           F  
HETATM   32  C   UNL     1       4.036  -1.820   0.476  1.00  0.00           C  
HETATM   33  H   UNL     1       9.038  -1.094   0.319  1.00  0.00           H  
HETATM   34  H   UNL     1       6.713  -2.246   0.727  1.00  0.00           H  
HETATM   35  H   UNL     1       1.599   0.922  -0.708  1.00  0.00           H  
HETATM   36  H   UNL     1       0.064  -2.179   0.141  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.692   0.577   0.233  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.913   0.053   1.745  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.809  -2.269   0.895  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.486  -1.672   0.893  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.409   0.414  -1.947  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.747  -0.224  -1.936  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.589   4.076   0.620  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.292   3.069   0.613  1.00  0.00           H  
HETATM   45  H   UNL     1      10.909   1.676  -0.750  1.00  0.00           H  
HETATM   46  H   UNL     1       8.747   2.530  -0.197  1.00  0.00           H  
HETATM   47  H   UNL     1       8.795   1.862  -1.846  1.00  0.00           H  
HETATM   48  H   UNL     1       4.026   1.313  -0.803  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.208  -1.426   0.038  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.911  -0.656   0.489  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.013  -2.717  -1.182  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.369  -1.943  -2.705  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.589  -2.425  -1.180  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.016   3.698   0.493  1.00  0.00           H  
HETATM   55  H   UNL     1       4.721  -2.586   0.808  1.00  0.00           H  
CONECT    1   16    2    2   33                                       
CONECT    2   17    1    1   34                                       
CONECT    3   32   32   19   17                                       
CONECT    4   20   19   19   35                                       
CONECT    5    6   20   36                                            
CONECT    6   29    5   21   21                                       
CONECT    7   28   21   22   22                                       
CONECT    8   27   27   22   23                                       
CONECT    9   24   10   37   38                                       
CONECT   10    9   25   39   40                                       
CONECT   11   24   26   41   42                                       
CONECT   12   28   28   27   43                                       
CONECT   13   29   29   28   44                                       
CONECT   14   15   45                                                 
CONECT   15   14   16   46   47                                       
CONECT   16   18   18   15    1                                       
CONECT   17    3   18    2                                            
CONECT   18   17   16   16                                            
CONECT   19    4    4    3   48                                       
CONECT   20    5   30   30    4                                       
CONECT   21    6    6    7   49                                       
CONECT   22    7    7    8                                            
CONECT   23    8   24                                                 
CONECT   24   23    9   11   50                                       
CONECT   25   10   26   51                                            
CONECT   26   11   25   52   53                                       
CONECT   27   12    8    8   54                                       
CONECT   28   13   12   12    7                                       
CONECT   29   13   13    6                                            
CONECT   30   31   20   20   32                                       
CONECT   31   30                                                      
CONECT   32   30    3    3   55                                       
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   32                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
