COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.087   5.250  -1.504  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.318   4.438  -0.998  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.491   3.525  -1.829  1.00  0.00           C  
HETATM    4  C   UNL     1       0.317   2.655  -1.210  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.607   3.631  -3.316  1.00  0.00           C  
HETATM    6  N   UNL     1      -1.141   4.296   0.369  1.00  0.00           N  
HETATM    7  S   UNL     1      -0.231   3.428   2.695  1.00  0.00           S  
HETATM    8  C   UNL     1      -0.296   3.395   1.014  1.00  0.00           C  
HETATM    9  C   UNL     1       2.282  -0.292  -1.921  1.00  0.00           C  
HETATM   10  O   UNL     1       3.063   0.476  -2.819  1.00  0.00           O  
HETATM   11  P   UNL     1       2.787   0.324  -4.407  1.00  0.00           P  
HETATM   12  O   UNL     1       1.198   0.588  -4.548  1.00  0.00           O  
HETATM   13  O   UNL     1       3.659   1.172  -5.286  1.00  0.00           O  
HETATM   14  C   UNL     1       2.725   0.023  -0.498  1.00  0.00           C  
HETATM   15  O   UNL     1       2.470   1.422  -0.246  1.00  0.00           O  
HETATM   16  C   UNL     1       1.373   1.543   0.675  1.00  0.00           C  
HETATM   17  N   UNL     1       0.452   2.524   0.177  1.00  0.00           N  
HETATM   18  C   UNL     1       0.748   0.163   0.786  1.00  0.00           C  
HETATM   19  C   UNL     1       1.940  -0.742   0.560  1.00  0.00           C  
HETATM   20  O   UNL     1       2.742  -0.809   1.739  1.00  0.00           O  
HETATM   21  O   UNL     1       0.137  -0.058   2.041  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.332  -1.396   2.174  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.951  -1.569   3.547  1.00  0.00           C  
HETATM   24  O   UNL     1       0.039  -1.320   4.537  1.00  0.00           O  
HETATM   25  C   UNL     1      -0.494  -1.447   5.849  1.00  0.00           C  
HETATM   26  O   UNL     1       2.921  -1.270  -4.647  1.00  0.00           O  
HETATM   27  H   UNL     1       0.934   1.978  -1.792  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.945   2.681  -3.727  1.00  0.00           H  
HETATM   29  H   UNL     1       0.362   3.885  -3.744  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.322   4.412  -3.574  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.684   4.915   0.964  1.00  0.00           H  
HETATM   32  H   UNL     1       1.229  -0.035  -2.051  1.00  0.00           H  
HETATM   33  H   UNL     1       2.428  -1.352  -2.133  1.00  0.00           H  
HETATM   34  H   UNL     1       0.799   0.616  -5.443  1.00  0.00           H  
HETATM   35  H   UNL     1       3.804  -0.139  -0.410  1.00  0.00           H  
HETATM   36  H   UNL     1       1.754   1.910   1.633  1.00  0.00           H  
HETATM   37  H   UNL     1       0.000   0.004   0.000  1.00  0.00           H  
HETATM   38  H   UNL     1       1.675  -1.764   0.277  1.00  0.00           H  
HETATM   39  H   UNL     1       3.447  -0.153   1.628  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.066  -1.580   1.383  1.00  0.00           H  
HETATM   41  H   UNL     1       0.520  -2.071   2.050  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.324  -2.588   3.686  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.768  -0.855   3.691  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.854  -0.474   6.192  1.00  0.00           H  
HETATM   45  H   UNL     1       0.281  -1.819   6.523  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.326  -2.155   5.827  1.00  0.00           H  
HETATM   47  H   UNL     1       2.886  -1.617  -5.563  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    6                                       
CONECT    3    2    4    4    5                                       
CONECT    4    3    3   17   27                                       
CONECT    5    3   28   29   30                                       
CONECT    6    2    8   31                                            
CONECT    7    8    8                                                 
CONECT    8    6    7    7   17                                       
CONECT    9   10   14   32   33                                       
CONECT   10    9   11                                                 
CONECT   11   10   12   13   13                                       
CONECT   11   26                                                      
CONECT   12   11   34                                                 
CONECT   13   11   11                                                 
CONECT   14    9   15   19   35                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   18   36                                       
CONECT   17    4    8   16                                            
CONECT   18   16   19   21   37                                       
CONECT   19   14   18   20   38                                       
CONECT   20   19   39                                                 
CONECT   21   18   22                                                 
CONECT   22   21   23   40   41                                       
CONECT   23   22   24   42   43                                       
CONECT   24   23   25                                                 
CONECT   25   24   44   45   46                                       
CONECT   26   11   47                                                 
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   12                                                      
CONECT   35   14                                                      
CONECT   36   16                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
