COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.210   1.445   1.415  1.00  0.00           O  
HETATM    2  C   UNL     1       0.518   0.913   0.310  1.00  0.00           C  
HETATM    3  C   UNL     1       0.622   1.976  -0.784  1.00  0.00           C  
HETATM    4  O   UNL     1       1.933   2.574  -0.689  1.00  0.00           O  
HETATM    5  C   UNL     1       2.595   2.031   0.465  1.00  0.00           C  
HETATM    6  C   UNL     1       4.092   1.980   0.223  1.00  0.00           C  
HETATM    7  O   UNL     1       4.566   3.301   0.029  1.00  0.00           O  
HETATM    8  P   UNL     1       6.145   3.523  -0.251  1.00  0.00           P  
HETATM    9  O   UNL     1       6.560   4.952  -0.444  1.00  0.00           O  
HETATM   10  O   UNL     1       6.456   2.538  -1.495  1.00  0.00           O  
HETATM   11  O   UNL     1       6.843   2.773   1.000  1.00  0.00           O  
HETATM   12  C   UNL     1       1.969   0.663   0.677  1.00  0.00           C  
HETATM   13  O   UNL     1       2.143   0.197   1.998  1.00  0.00           O  
HETATM   14  C   UNL     1       1.460  -1.029   2.206  1.00  0.00           C  
HETATM   15  C   UNL     1       1.700  -1.494   3.629  1.00  0.00           C  
HETATM   16  O   UNL     1       3.094  -1.697   3.822  1.00  0.00           O  
HETATM   17  C   UNL     1       3.381  -2.113   5.150  1.00  0.00           C  
HETATM   18  N   UNL     1       0.424   1.450  -2.136  1.00  0.00           N  
HETATM   19  C   UNL     1       1.390   0.903  -2.940  1.00  0.00           C  
HETATM   20  N   UNL     1       0.910   0.517  -4.103  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.426   0.827  -4.052  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.749   1.408  -2.837  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.956   1.836  -2.437  1.00  0.00           N  
HETATM   24  C   UNL     1      -2.875   1.627  -3.404  1.00  0.00           C  
HETATM   25  N   UNL     1      -2.709   1.075  -4.630  1.00  0.00           N  
HETATM   26  C   UNL     1      -1.462   0.665  -4.967  1.00  0.00           C  
HETATM   27  N   UNL     1      -1.225   0.085  -6.225  1.00  0.00           N  
HETATM   28  H   UNL     1      -1.062   1.768   1.071  1.00  0.00           H  
HETATM   29  H   UNL     1       0.000   0.001  -0.003  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.125   2.769  -0.673  1.00  0.00           H  
HETATM   31  H   UNL     1       2.399   2.693   1.317  1.00  0.00           H  
HETATM   32  H   UNL     1       4.308   1.388  -0.668  1.00  0.00           H  
HETATM   33  H   UNL     1       4.597   1.541   1.085  1.00  0.00           H  
HETATM   34  H   UNL     1       7.351   2.548  -1.896  1.00  0.00           H  
HETATM   35  H   UNL     1       7.814   2.842   1.113  1.00  0.00           H  
HETATM   36  H   UNL     1       2.403  -0.065  -0.019  1.00  0.00           H  
HETATM   37  H   UNL     1       0.394  -0.862   2.020  1.00  0.00           H  
HETATM   38  H   UNL     1       1.848  -1.762   1.493  1.00  0.00           H  
HETATM   39  H   UNL     1       1.187  -2.440   3.827  1.00  0.00           H  
HETATM   40  H   UNL     1       1.362  -0.735   4.342  1.00  0.00           H  
HETATM   41  H   UNL     1       3.405  -1.242   5.809  1.00  0.00           H  
HETATM   42  H   UNL     1       4.345  -2.626   5.172  1.00  0.00           H  
HETATM   43  H   UNL     1       2.598  -2.798   5.484  1.00  0.00           H  
HETATM   44  H   UNL     1       2.421   0.814  -2.623  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.885   1.945  -3.168  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.293  -0.186  -6.475  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.971   0.035  -6.893  1.00  0.00           H  
CONECT    1    2   28                                                 
CONECT    2    1    3   12   29                                       
CONECT    3    2    4   18   30                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   12   31                                       
CONECT    6    5    7   32   33                                       
CONECT    7    6    8                                                 
CONECT    8    7    9    9   10                                       
CONECT    8   11                                                      
CONECT    9    8    8                                                 
CONECT   10    8   34                                                 
CONECT   11    8   35                                                 
CONECT   12    2    5   13   36                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   37   38                                       
CONECT   15   14   16   39   40                                       
CONECT   16   15   17                                                 
CONECT   17   16   41   42   43                                       
CONECT   18    3   19   22                                            
CONECT   19   18   20   20   44                                       
CONECT   20   19   19   21                                            
CONECT   21   20   22   22   26                                       
CONECT   22   18   21   21   23                                       
CONECT   23   22   24   24                                            
CONECT   24   23   23   25   45                                       
CONECT   25   24   26   26                                            
CONECT   26   21   25   25   27                                       
CONECT   27   26   46   47                                            
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   24                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
