COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       5.719  -0.016   0.697  1.00  0.00           P  
HETATM    2  O   UNL     1       6.989   0.910   0.349  1.00  0.00           O  
HETATM    3  O   UNL     1       5.866  -0.587   2.055  1.00  0.00           O  
HETATM    4  C   UNL     1       4.295  -1.804  -0.673  1.00  0.00           C  
HETATM    5  O   UNL     1       5.586  -1.209  -0.395  1.00  0.00           O  
HETATM    6  C   UNL     1       3.334  -0.659  -0.927  1.00  0.00           C  
HETATM    7  O   UNL     1       1.998  -1.014  -1.274  1.00  0.00           O  
HETATM    8  C   UNL     1       3.133   0.136   0.391  1.00  0.00           C  
HETATM    9  O   UNL     1       4.347   0.863   0.606  1.00  0.00           O  
HETATM   10  C   UNL     1       1.924   1.006   0.024  1.00  0.00           C  
HETATM   11  O   UNL     1       2.352   2.266  -0.497  1.00  0.00           O  
HETATM   12  C   UNL     1       1.213   0.185  -1.060  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.762   1.622  -0.651  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.749   2.292  -1.170  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.526   1.806  -1.210  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.261   0.599  -0.720  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.305  -0.154  -0.157  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.593   0.408  -0.138  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.771  -1.328   0.259  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.497  -1.342  -0.005  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.134  -0.176  -0.610  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.661  -0.286   0.404  1.00  0.00           N  
HETATM   23  C   UNL     1      -5.899   0.498   0.314  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.888   1.594   1.382  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.230   2.328   1.372  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.819  -1.596  -0.241  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.714  -2.486   0.623  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.901  -3.841  -0.062  1.00  0.00           C  
HETATM   29  H   UNL     1       7.832   0.436   0.347  1.00  0.00           H  
HETATM   30  H   UNL     1       4.360  -2.440  -1.555  1.00  0.00           H  
HETATM   31  H   UNL     1       3.962  -2.388   0.185  1.00  0.00           H  
HETATM   32  H   UNL     1       3.746   0.000  -1.691  1.00  0.00           H  
HETATM   33  H   UNL     1       2.918  -0.527   1.228  1.00  0.00           H  
HETATM   34  H   UNL     1       1.273   1.149   0.887  1.00  0.00           H  
HETATM   35  H   UNL     1       1.630   2.827  -0.812  1.00  0.00           H  
HETATM   36  H   UNL     1       1.156   0.760  -1.985  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.930   3.276  -1.576  1.00  0.00           H  
HETATM   38  H   UNL     1       0.174  -2.158   0.221  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.969   0.954  -0.674  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.756  -0.156   0.473  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.727   1.145   2.361  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.086   2.300   1.169  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.222   3.109   2.133  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.392   2.778   0.393  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.033   1.622   1.585  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.275  -1.465  -1.222  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.841  -2.066  -0.355  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.248  -2.633   1.597  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.685  -2.008   0.754  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.539  -4.475   0.553  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.367  -3.694  -1.037  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.930  -4.319  -0.193  1.00  0.00           H  
CONECT    1    9    3    3    5                                       
CONECT    1    2                                                      
CONECT    2    1   29                                                 
CONECT    3    1    1                                                 
CONECT    4    6    5   30   31                                       
CONECT    5    1    4                                                 
CONECT    6    8    7    4   32                                       
CONECT    7   12    6                                                 
CONECT    8   10    9    6   33                                       
CONECT    9    8    1                                                 
CONECT   10   11   12    8   34                                       
CONECT   11   10   35                                                 
CONECT   12   21   10    7   36                                       
CONECT   13   18   18   14                                            
CONECT   14   13   15   15   37                                       
CONECT   15   14   14   16                                            
CONECT   16   17   17   15   21                                       
CONECT   17   18   19   16   16                                       
CONECT   18   22   13   13   17                                       
CONECT   19   17   20   20                                            
CONECT   20   19   19   21   38                                       
CONECT   21   20   16   12                                            
CONECT   22   26   23   18                                            
CONECT   23   24   22   39   40                                       
CONECT   24   25   23   41   42                                       
CONECT   25   24   43   44   45                                       
CONECT   26   27   22   46   47                                       
CONECT   27   26   28   48   49                                       
CONECT   28   27   50   51   52                                       
CONECT   29    2                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   20                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
