COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.072  -3.961   0.107  1.00  0.00           O  
HETATM    2  C   UNL     1       2.067  -3.047  -0.020  1.00  0.00           C  
HETATM    3  C   UNL     1       3.353  -3.446  -0.354  1.00  0.00           C  
HETATM    4  N   UNL     1       4.322  -2.562  -0.480  1.00  0.00           N  
HETATM    5  C   UNL     1       4.125  -1.271  -0.297  1.00  0.00           C  
HETATM    6  C   UNL     1       2.881  -0.781   0.038  1.00  0.00           C  
HETATM    7  C   UNL     1       2.671   0.697   0.244  1.00  0.00           C  
HETATM    8  O   UNL     1       3.905   1.387   0.037  1.00  0.00           O  
HETATM    9  P   UNL     1       4.051   2.984   0.175  1.00  0.00           P  
HETATM   10  O   UNL     1       3.570   3.410   1.509  1.00  0.00           O  
HETATM   11  O   UNL     1       5.598   3.399   0.005  1.00  0.00           O  
HETATM   12  O   UNL     1       3.174   3.704  -0.967  1.00  0.00           O  
HETATM   13  C   UNL     1       1.811  -1.677   0.178  1.00  0.00           C  
HETATM   14  C   UNL     1       0.466  -1.202   0.534  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.605  -1.594  -0.195  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.895  -1.138   0.147  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.088  -1.575  -0.664  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.337  -0.952  -0.096  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.176  -1.512   0.790  1.00  0.00           C  
HETATM   20  N   UNL     1      -6.199  -0.648   1.073  1.00  0.00           N  
HETATM   21  C   UNL     1      -6.039   0.518   0.358  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.863   0.381  -0.401  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.443   1.423  -1.229  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.175   2.575  -1.295  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.335   2.716  -0.545  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.772   1.697   0.272  1.00  0.00           C  
HETATM   27  O   UNL     1      -2.045  -0.394   1.094  1.00  0.00           O  
HETATM   28  C   UNL     1       3.646  -4.907  -0.576  1.00  0.00           C  
HETATM   29  H   UNL     1       0.978  -4.318   1.001  1.00  0.00           H  
HETATM   30  H   UNL     1       4.952  -0.586  -0.411  1.00  0.00           H  
HETATM   31  H   UNL     1       1.928   1.062  -0.467  1.00  0.00           H  
HETATM   32  H   UNL     1       2.320   0.877   1.260  1.00  0.00           H  
HETATM   33  H   UNL     1       5.761   4.349   0.077  1.00  0.00           H  
HETATM   34  H   UNL     1       3.435   3.471  -1.868  1.00  0.00           H  
HETATM   35  H   UNL     1       0.333  -0.540   1.377  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.472  -2.257  -1.037  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.961  -1.255  -1.699  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.174  -2.661  -0.628  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.062  -2.498   1.215  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.929  -0.830   1.686  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.541   1.321  -1.815  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.850   3.381  -1.936  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.903   3.632  -0.607  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.675   1.817   0.853  1.00  0.00           H  
HETATM   45  H   UNL     1       3.490  -5.154  -1.627  1.00  0.00           H  
HETATM   46  H   UNL     1       4.680  -5.116  -0.303  1.00  0.00           H  
HETATM   47  H   UNL     1       2.978  -5.509   0.041  1.00  0.00           H  
CONECT    1    2   29                                                 
CONECT    2    3    3   13    1                                       
CONECT    3    4   28    2    2                                       
CONECT    4    5    5    3                                            
CONECT    5    4    4    6   30                                       
CONECT    6    5    7   13   13                                       
CONECT    7    8    6   31   32                                       
CONECT    8    9    7                                                 
CONECT    9   10   10   12   11                                       
CONECT    9    8                                                      
CONECT   10    9    9                                                 
CONECT   11    9   33                                                 
CONECT   12    9   34                                                 
CONECT   13    6    6    2   14                                       
CONECT   14   13   15   15   35                                       
CONECT   15   14   14   16   36                                       
CONECT   16   15   17   27   27                                       
CONECT   17   16   18   37   38                                       
CONECT   18   17   19   19   22                                       
CONECT   19   18   18   20   39                                       
CONECT   20   19   21   40                                            
CONECT   21   20   22   22   26                                       
CONECT   22   18   21   21   23                                       
CONECT   23   22   24   24   41                                       
CONECT   24   23   23   25   42                                       
CONECT   25   26   26   24   43                                       
CONECT   26   21   25   25   44                                       
CONECT   27   16   16                                                 
CONECT   28    3   45   46   47                                       
CONECT   29    1                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   26                                                      
CONECT   45   28                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
