COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       2.787   0.324  -4.407  1.00  0.00           P  
HETATM    2  O   UNL     1       1.198   0.588  -4.548  1.00  0.00           O  
HETATM    3  O   UNL     1       2.921  -1.270  -4.647  1.00  0.00           O  
HETATM    4  O   UNL     1       3.063   0.476  -2.819  1.00  0.00           O  
HETATM    5  C   UNL     1       2.282  -0.292  -1.921  1.00  0.00           C  
HETATM    6  C   UNL     1       2.725   0.023  -0.498  1.00  0.00           C  
HETATM    7  O   UNL     1       2.470   1.422  -0.246  1.00  0.00           O  
HETATM    8  C   UNL     1       1.373   1.543   0.675  1.00  0.00           C  
HETATM    9  N   UNL     1       0.452   2.524   0.177  1.00  0.00           N  
HETATM   10  C   UNL     1       0.309   2.663  -1.199  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.300   3.336   1.055  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.225   3.269   2.283  1.00  0.00           O  
HETATM   13  N   UNL     1      -1.159   4.248   0.431  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.338   4.427  -0.932  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.111   5.251  -1.413  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.514   3.537  -1.792  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.651   3.669  -3.275  1.00  0.00           C  
HETATM   18  C   UNL     1       0.748   0.163   0.786  1.00  0.00           C  
HETATM   19  O   UNL     1       0.137  -0.058   2.041  1.00  0.00           O  
HETATM   20  C   UNL     1      -0.332  -1.396   2.174  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.951  -1.569   3.547  1.00  0.00           C  
HETATM   22  O   UNL     1       0.039  -1.320   4.537  1.00  0.00           O  
HETATM   23  N   UNL     1      -0.589  -1.495   5.839  1.00  0.00           N  
HETATM   24  C   UNL     1       0.419  -1.087   6.809  1.00  0.00           C  
HETATM   25  O   UNL     1       1.486  -2.019   6.927  1.00  0.00           O  
HETATM   26  C   UNL     1       1.940  -0.742   0.560  1.00  0.00           C  
HETATM   27  O   UNL     1       2.742  -0.809   1.739  1.00  0.00           O  
HETATM   28  O   UNL     1       3.659   1.172  -5.286  1.00  0.00           O  
HETATM   29  H   UNL     1       0.799   0.616  -5.443  1.00  0.00           H  
HETATM   30  H   UNL     1       2.886  -1.617  -5.563  1.00  0.00           H  
HETATM   31  H   UNL     1       1.229  -0.035  -2.051  1.00  0.00           H  
HETATM   32  H   UNL     1       2.428  -1.352  -2.133  1.00  0.00           H  
HETATM   33  H   UNL     1       3.804  -0.139  -0.410  1.00  0.00           H  
HETATM   34  H   UNL     1       1.754   1.910   1.633  1.00  0.00           H  
HETATM   35  H   UNL     1       0.928   1.995  -1.790  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.709   4.843   1.045  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.057   2.748  -3.690  1.00  0.00           H  
HETATM   38  H   UNL     1       0.324   3.866  -3.719  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.320   4.497  -3.510  1.00  0.00           H  
HETATM   40  H   UNL     1       0.000   0.004   0.000  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.066  -1.580   1.383  1.00  0.00           H  
HETATM   42  H   UNL     1       0.520  -2.071   2.050  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.324  -2.588   3.686  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.768  -0.855   3.691  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.325  -0.791   5.798  1.00  0.00           H  
HETATM   46  H   UNL     1       0.835  -0.107   6.551  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.048  -0.995   7.794  1.00  0.00           H  
HETATM   48  H   UNL     1       1.810  -2.189   6.026  1.00  0.00           H  
HETATM   49  H   UNL     1       1.675  -1.764   0.277  1.00  0.00           H  
HETATM   50  H   UNL     1       3.344  -1.558   1.619  1.00  0.00           H  
CONECT    1    2    3    4   28                                       
CONECT    1   28                                                      
CONECT    2    1   29                                                 
CONECT    3    1   30                                                 
CONECT    4    1    5                                                 
CONECT    5    4    6   31   32                                       
CONECT    6    5    7   26   33                                       
CONECT    7    6    8                                                 
CONECT    8    7    9   18   34                                       
CONECT    9    8   10   11                                            
CONECT   10    9   16   16   35                                       
CONECT   11    9   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   36                                            
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   10   10   14   17                                       
CONECT   17   16   37   38   39                                       
CONECT   18    8   19   26   40                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   41   42                                       
CONECT   21   20   22   43   44                                       
CONECT   22   21   23                                                 
CONECT   23   22   24   45                                            
CONECT   24   23   25   46   47                                       
CONECT   25   24   48                                                 
CONECT   26    6   18   27   49                                       
CONECT   27   26   50                                                 
CONECT   28    1    1                                                 
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   13                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
