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      -2.112   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      -0.968  -1.583   3.544  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.127  -0.716   3.746  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.410  -1.030   3.443  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.224  -0.042   3.742  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.411   0.937   4.256  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.096   0.535   4.267  1.00  0.00           C  
HETATM   27  C   UNL     1       1.940  -0.742   0.560  1.00  0.00           C  
HETATM   28  O   UNL     1       2.742  -0.809   1.739  1.00  0.00           O  
HETATM   29  O   UNL     1       3.659   1.172  -5.286  1.00  0.00           O  
HETATM   30  H   UNL     1       0.799   0.616  -5.443  1.00  0.00           H  
HETATM   31  H   UNL     1       2.886  -1.617  -5.563  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       3.804  -0.139  -0.410  1.00  0.00           H  
HETATM   35  H   UNL     1       1.754   1.910   1.633  1.00  0.00           H  
HETATM   36  H   UNL     1       0.928   1.995  -1.790  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.709   4.843   1.045  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.057   2.748  -3.690  1.00  0.00           H  
HETATM   39  H   UNL     1       0.324   3.866  -3.719  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.320   4.497  -3.510  1.00  0.00           H  
HETATM   41  H   UNL     1       0.000   0.004   0.000  1.00  0.00           H  
HETATM   42  H   UNL     1       0.529  -2.064   2.070  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.039  -1.602   1.364  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.251  -1.368   4.346  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.313  -2.615   3.669  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.700  -1.979   3.011  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.814   1.881   4.592  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.186   1.020   4.591  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       3.447  -0.153   1.628  1.00  0.00           H  
CONECT    1    2    3    4   29                                       
CONECT    1   29                                                      
CONECT    2    1   30                                                 
CONECT    3    1   31                                                 
CONECT    4    1    5                                                 
CONECT    5    4    6   32   33                                       
CONECT    6    5    7   27   34                                       
CONECT    7    6    8                                                 
CONECT    8    7    9   18   35                                       
CONECT    9    8   10   11                                            
CONECT   10    9   16   16   36                                       
CONECT   11    9   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   37                                            
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   10   10   14   17                                       
CONECT   17   16   38   39   40                                       
CONECT   18    8   19   27   41                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   42   43                                       
CONECT   21   20   22   44   45                                       
CONECT   22   21   23   26                                            
CONECT   23   22   24   24   46                                       
CONECT   24   23   23   25                                            
CONECT   25   24   26   26   47                                       
CONECT   26   22   25   25   48                                       
CONECT   27    6   18   28   49                                       
CONECT   28   27   50                                                 
CONECT   29    1    1                                                 
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
