COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.802   2.415  -0.108  1.00  0.00           N  
HETATM    2  C   UNL     1       0.562   2.533   0.427  1.00  0.00           C  
HETATM    3  C   UNL     1       1.412   1.413  -0.115  1.00  0.00           C  
HETATM    4  O   UNL     1       1.154   0.923  -1.194  1.00  0.00           O  
HETATM    5  C   UNL     1       1.158   3.877   0.004  1.00  0.00           C  
HETATM    6  C   UNL     1       6.622  -1.865   1.926  1.00  0.00           C  
HETATM    7  C   UNL     1       4.340  -1.895  -1.161  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.059   4.848  -0.033  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.553   0.820  -0.729  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.246  -0.886  -1.415  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.767  -0.504   1.007  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.655   3.504   0.389  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.382   1.104   0.213  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.849  -2.251  -1.081  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.371  -1.870   1.341  1.00  0.00           C  
HETATM   16  C   UNL     1       6.065  -2.265   0.584  1.00  0.00           C  
HETATM   17  C   UNL     1       4.890  -1.578   0.046  1.00  0.00           C  
HETATM   18  C   UNL     1       3.244  -0.075   0.099  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.157  -0.546  -0.395  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.459  -2.210   0.321  1.00  0.00           C  
HETATM   21  F   UNL     1      -6.011  -3.458   0.627  1.00  0.00           F  
HETATM   22  F   UNL     1      -6.461  -1.234   0.366  1.00  0.00           F  
HETATM   23  N   UNL     1       4.269  -0.588   0.699  1.00  0.00           N  
HETATM   24  N   UNL     1       0.305   4.966   0.501  1.00  0.00           N  
HETATM   25  N   UNL     1       2.460   0.956   0.599  1.00  0.00           N  
HETATM   26  O   UNL     1       6.590  -3.156  -0.050  1.00  0.00           O  
HETATM   27  S   UNL     1       2.992  -0.882  -1.444  1.00  0.00           S  
HETATM   28  H   UNL     1       0.532   2.474   1.515  1.00  0.00           H  
HETATM   29  H   UNL     1       2.159   3.979   0.424  1.00  0.00           H  
HETATM   30  H   UNL     1       1.212   3.925  -1.084  1.00  0.00           H  
HETATM   31  H   UNL     1       6.024  -1.054   2.342  1.00  0.00           H  
HETATM   32  H   UNL     1       6.594  -2.720   2.601  1.00  0.00           H  
HETATM   33  H   UNL     1       7.653  -1.531   1.806  1.00  0.00           H  
HETATM   34  H   UNL     1       4.701  -2.659  -1.833  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.030   4.907  -1.121  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.674   5.659   0.358  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.312   1.592  -0.609  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.198   0.817  -1.760  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.811  -0.915  -2.414  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.026  -0.125  -1.381  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.547   0.256   1.042  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.991  -0.262   1.734  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.656   3.402  -0.030  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.710   3.456   1.477  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.623   0.331   0.092  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.737   1.106   1.244  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.625  -2.493  -1.808  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.069  -3.012  -1.115  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.591  -2.631   1.307  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.805  -1.840   2.341  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.377  -1.306  -0.430  1.00  0.00           H  
HETATM   52  H   UNL     1       0.703   5.867   0.280  1.00  0.00           H  
HETATM   53  H   UNL     1       2.667   1.348   1.462  1.00  0.00           H  
CONECT    1   13   12    2                                            
CONECT    2    1    3    5   28                                       
CONECT    3   25    2    4    4                                       
CONECT    4    3    3                                                 
CONECT    5    2   24   29   30                                       
CONECT    6   16   31   32   33                                       
CONECT    7   17   17   27   34                                       
CONECT    8   12   24   35   36                                       
CONECT    9   19   13   37   38                                       
CONECT   10   14   19   39   40                                       
CONECT   11   15   19   41   42                                       
CONECT   12    1    8   43   44                                       
CONECT   13    9    1   45   46                                       
CONECT   14   20   10   47   48                                       
CONECT   15   20   11   49   50                                       
CONECT   16    6   17   26   26                                       
CONECT   17   16    7    7   23                                       
CONECT   18   27   23   23   25                                       
CONECT   19   10   11    9   51                                       
CONECT   20   21   14   22   15                                       
CONECT   21   20                                                      
CONECT   22   20                                                      
CONECT   23   17   18   18                                            
CONECT   24    8    5   52                                            
CONECT   25   18    3   53                                            
CONECT   26   16   16                                                 
CONECT   27    7   18                                                 
CONECT   28    2                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   19                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
