COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  O   UNL     1       3.409  -3.045  -0.993  1.00  0.00           O  
HETATM    2  P   UNL     1       3.194  -2.040   0.246  1.00  0.00           P  
HETATM    3  O   UNL     1       2.894  -2.819   1.468  1.00  0.00           O  
HETATM    4  O   UNL     1       1.966  -1.049  -0.074  1.00  0.00           O  
HETATM    5  C   UNL     1       1.392  -0.180   0.905  1.00  0.00           C  
HETATM    6  C   UNL     1       0.251   0.619   0.271  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.329   1.627   1.288  1.00  0.00           C  
HETATM    8  O   UNL     1       0.220   2.929   1.070  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.846   1.624   0.996  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.281   2.924   0.593  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.003   0.614  -0.162  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.852  -0.253  -0.057  1.00  0.00           O  
HETATM   13  N   UNL     1      -3.239  -0.156  -0.002  1.00  0.00           N  
HETATM   14  C   UNL     1      -4.491   0.221  -0.418  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.353  -0.826  -0.053  1.00  0.00           C  
HETATM   16  N   UNL     1      -4.597  -1.772   0.555  1.00  0.00           N  
HETATM   17  C   UNL     1      -3.355  -1.383   0.582  1.00  0.00           C  
HETATM   18  N   UNL     1      -4.993   1.285  -1.038  1.00  0.00           N  
HETATM   19  C   UNL     1      -6.279   1.359  -1.308  1.00  0.00           C  
HETATM   20  N   UNL     1      -7.127   0.400  -0.985  1.00  0.00           N  
HETATM   21  C   UNL     1      -6.719  -0.699  -0.359  1.00  0.00           C  
HETATM   22  N   UNL     1      -7.615  -1.698  -0.025  1.00  0.00           N  
HETATM   23  N   UNL     1       4.595  -1.138   0.486  1.00  0.00           N  
HETATM   24  C   UNL     1       4.924  -0.349  -0.709  1.00  0.00           C  
HETATM   25  C   UNL     1       5.527   0.967  -0.292  1.00  0.00           C  
HETATM   26  C   UNL     1       5.929  -1.121  -1.568  1.00  0.00           C  
HETATM   27  O   UNL     1       5.668   1.223   0.881  1.00  0.00           O  
HETATM   28  O   UNL     1       5.908   1.856  -1.222  1.00  0.00           O  
HETATM   29  C   UNL     1       6.480   3.103  -0.748  1.00  0.00           C  
HETATM   30  H   UNL     1       3.610  -2.602  -1.829  1.00  0.00           H  
HETATM   31  H   UNL     1       1.004  -0.773   1.734  1.00  0.00           H  
HETATM   32  H   UNL     1       2.154   0.505   1.275  1.00  0.00           H  
HETATM   33  H   UNL     1       0.603   1.138  -0.620  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.133   1.297   2.308  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.110   3.602   1.681  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.402   1.291   1.872  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.149   3.608   1.263  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.000   1.132  -1.121  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.539  -1.946   1.009  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.654   2.237  -1.813  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.555  -1.601  -0.247  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.305  -2.496   0.432  1.00  0.00           H  
HETATM   43  H   UNL     1       4.508  -0.545   1.298  1.00  0.00           H  
HETATM   44  H   UNL     1       4.017  -0.167  -1.286  1.00  0.00           H  
HETATM   45  H   UNL     1       6.835  -1.303  -0.991  1.00  0.00           H  
HETATM   46  H   UNL     1       5.493  -2.073  -1.870  1.00  0.00           H  
HETATM   47  H   UNL     1       6.173  -0.536  -2.454  1.00  0.00           H  
HETATM   48  H   UNL     1       5.752   3.624  -0.126  1.00  0.00           H  
HETATM   49  H   UNL     1       7.374   2.892  -0.161  1.00  0.00           H  
HETATM   50  H   UNL     1       6.744   3.730  -1.600  1.00  0.00           H  
CONECT    1    2   30                                                 
CONECT    2    4    3    3   23                                       
CONECT    2    1                                                      
CONECT    3    2    2                                                 
CONECT    4    5    2                                                 
CONECT    5    6    4   31   32                                       
CONECT    6   12    7    5   33                                       
CONECT    7    9    6    8   34                                       
CONECT    8    7   35                                                 
CONECT    9   11   10    7   36                                       
CONECT   10    9   37                                                 
CONECT   11   13    9   12   38                                       
CONECT   12   11    6                                                 
CONECT   13   14   17   11                                            
CONECT   14   15   15   18   13                                       
CONECT   15   21   16   14   14                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   13   39                                       
CONECT   18   19   19   14                                            
CONECT   19   20   18   18   40                                       
CONECT   20   21   21   19                                            
CONECT   21   22   20   20   15                                       
CONECT   22   21   41   42                                            
CONECT   23    2   24   43                                            
CONECT   24   25   23   26   44                                       
CONECT   25   28   27   27   24                                       
CONECT   26   24   45   46   47                                       
CONECT   27   25   25                                                 
CONECT   28   25   29                                                 
CONECT   29   28   48   49   50                                       
CONECT   30    1                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
