COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.912   4.663  -3.442  1.00  0.00           O  
HETATM    2  C   UNL     1       0.691  -1.131  -0.937  1.00  0.00           C  
HETATM    3  C   UNL     1       1.783  -0.732  -1.707  1.00  0.00           C  
HETATM    4  C   UNL     1       3.076  -0.845  -1.197  1.00  0.00           C  
HETATM    5  C   UNL     1       3.277  -1.358   0.085  1.00  0.00           C  
HETATM    6  C   UNL     1       2.185  -1.757   0.856  1.00  0.00           C  
HETATM    7  C   UNL     1       0.900  -1.641   0.339  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.275  -2.071   1.169  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.796  -0.979   1.984  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.305  -0.764   3.268  1.00  0.00           C  
HETATM   11  O   UNL     1       0.563  -1.403   3.855  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.773  -0.163   1.484  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.048  -0.828   1.104  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.218  -2.037   1.230  1.00  0.00           O  
HETATM   15  N   UNL     1      -3.996   0.036   0.606  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.786   1.396   0.473  1.00  0.00           C  
HETATM   17  N   UNL     1      -4.836   2.112  -0.040  1.00  0.00           N  
HETATM   18  N   UNL     1      -2.661   1.954   0.813  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.633   1.176   1.327  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.496   1.770   1.666  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.289   3.191   1.521  1.00  0.00           C  
HETATM   22  C   UNL     1       0.092   3.545   0.075  1.00  0.00           C  
HETATM   23  C   UNL     1       0.876   3.672   2.386  1.00  0.00           C  
HETATM   24  C   UNL     1       2.076   3.601   1.451  1.00  0.00           C  
HETATM   25  O   UNL     1       3.142   4.408   1.914  1.00  0.00           O  
HETATM   26  C   UNL     1       1.505   4.141   0.142  1.00  0.00           C  
HETATM   27  C   UNL     1       2.359   3.795  -1.069  1.00  0.00           C  
HETATM   28  O   UNL     1       1.720   4.291  -2.233  1.00  0.00           O  
HETATM   29  P   UNL     1       2.432   4.051  -3.667  1.00  0.00           P  
HETATM   30  O   UNL     1       2.691   2.455  -3.704  1.00  0.00           O  
HETATM   31  O   UNL     1       1.688   4.608  -4.845  1.00  0.00           O  
HETATM   32  H   UNL     1      -0.313  -1.039  -1.343  1.00  0.00           H  
HETATM   33  H   UNL     1       1.626  -0.333  -2.705  1.00  0.00           H  
HETATM   34  H   UNL     1       3.926  -0.534  -1.797  1.00  0.00           H  
HETATM   35  H   UNL     1       4.284  -1.446   0.482  1.00  0.00           H  
HETATM   36  H   UNL     1       2.352  -2.155   1.853  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.088  -2.432   0.529  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.002  -2.891   1.842  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.793   0.094   3.760  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.894  -0.343   0.324  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.646   2.991  -0.463  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.749   1.726   0.031  1.00  0.00           H  
HETATM   43  H   UNL     1       0.253   1.191   2.042  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.214   3.698   1.814  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.602   4.285  -0.340  1.00  0.00           H  
HETATM   46  H   UNL     1       0.057   2.666  -0.580  1.00  0.00           H  
HETATM   47  H   UNL     1       0.712   4.708   2.710  1.00  0.00           H  
HETATM   48  H   UNL     1       1.029   3.073   3.290  1.00  0.00           H  
HETATM   49  H   UNL     1       2.432   2.570   1.343  1.00  0.00           H  
HETATM   50  H   UNL     1       3.059   4.465   2.881  1.00  0.00           H  
HETATM   51  H   UNL     1       1.438   5.235   0.194  1.00  0.00           H  
HETATM   52  H   UNL     1       2.469   2.712  -1.155  1.00  0.00           H  
HETATM   53  H   UNL     1       3.345   4.255  -0.978  1.00  0.00           H  
HETATM   54  H   UNL     1       3.060   2.054  -4.520  1.00  0.00           H  
HETATM   55  H   UNL     1       4.523   4.721  -4.207  1.00  0.00           H  
CONECT    1   29   55                                                 
CONECT    2    7    3    3   32                                       
CONECT    3    2    2    4   33                                       
CONECT    4    3    5    5   34                                       
CONECT    5    4    4    6   35                                       
CONECT    6    5    7    7   36                                       
CONECT    7    2    6    6    8                                       
CONECT    8    7    9   37   38                                       
CONECT    9    8   10   12                                            
CONECT   10    9   11   11   39                                       
CONECT   11   10   10                                                 
CONECT   12    9   13   19   19                                       
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   40                                            
CONECT   16   15   18   18   17                                       
CONECT   17   16   41   42                                            
CONECT   18   16   16   19                                            
CONECT   19   12   12   18   20                                       
CONECT   20   19   21   43                                            
CONECT   21   20   23   22   44                                       
CONECT   22   21   26   45   46                                       
CONECT   23   21   24   47   48                                       
CONECT   24   23   26   25   49                                       
CONECT   25   24   50                                                 
CONECT   26   22   24   27   51                                       
CONECT   27   26   28   52   53                                       
CONECT   28   27   29                                                 
CONECT   29    1   28   31   31                                       
CONECT   29   30                                                      
CONECT   30   29   54                                                 
CONECT   31   29   29                                                 
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39   10                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   30                                                      
CONECT   55    1                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
