COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.695   0.679   0.944  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.976   2.458  -0.986  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.222   2.570  -0.322  1.00  0.00           C  
HETATM    4  N   UNL     1      -5.547   1.672   0.629  1.00  0.00           N  
HETATM    5  N   UNL     1      -3.508   0.562   0.321  1.00  0.00           N  
HETATM    6  C   UNL     1      -3.140   1.453  -0.650  1.00  0.00           C  
HETATM    7  O   UNL     1      -5.992   3.469  -0.608  1.00  0.00           O  
HETATM    8  O   UNL     1      -5.000  -0.121   1.808  1.00  0.00           O  
HETATM    9  O   UNL     1       6.364  -0.388   1.013  1.00  0.00           O  
HETATM   10  P   UNL     1       5.554   0.922   0.543  1.00  0.00           P  
HETATM   11  O   UNL     1       5.763   2.098   1.623  1.00  0.00           O  
HETATM   12  O   UNL     1       6.059   1.367  -0.775  1.00  0.00           O  
HETATM   13  O   UNL     1       3.987   0.572   0.426  1.00  0.00           O  
HETATM   14  P   UNL     1       3.100  -0.248  -0.639  1.00  0.00           P  
HETATM   15  O   UNL     1       3.786  -1.514  -0.981  1.00  0.00           O  
HETATM   16  O   UNL     1       2.909   0.637  -1.970  1.00  0.00           O  
HETATM   17  O   UNL     1       1.659  -0.574   0.001  1.00  0.00           O  
HETATM   18  C   UNL     1       0.680  -1.380  -0.657  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.567  -1.487   0.223  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.590  -2.456  -0.411  1.00  0.00           C  
HETATM   21  O   UNL     1      -1.497  -3.748   0.192  1.00  0.00           O  
HETATM   22  C   UNL     1      -2.960  -1.811  -0.100  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.694  -1.459  -1.395  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.753  -2.686   0.705  1.00  0.00           O  
HETATM   25  O   UNL     1      -1.250  -0.216   0.284  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.602  -0.530   0.686  1.00  0.00           C  
HETATM   27  H   UNL     1      -3.698   3.168  -1.751  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.399   1.741   1.088  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.186   1.352  -1.146  1.00  0.00           H  
HETATM   30  H   UNL     1       6.085  -0.736   1.871  1.00  0.00           H  
HETATM   31  H   UNL     1       6.685   2.361   1.745  1.00  0.00           H  
HETATM   32  H   UNL     1       2.465   1.483  -1.820  1.00  0.00           H  
HETATM   33  H   UNL     1       0.414  -0.923  -1.610  1.00  0.00           H  
HETATM   34  H   UNL     1       1.088  -2.375  -0.833  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.296  -1.823   1.224  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.436  -2.523  -1.488  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.635  -4.173   0.078  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.874  -2.368  -1.969  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.646  -0.985  -1.156  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.084  -0.773  -1.983  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.957  -3.532   0.283  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.645  -0.718   1.758  1.00  0.00           H  
CONECT    1    5    8    8    4                                       
CONECT    2    6    6    3   27                                       
CONECT    3    2    4    7    7                                       
CONECT    4    1    3   28                                            
CONECT    5   26    6    1                                            
CONECT    6    5    2    2   29                                       
CONECT    7    3    3                                                 
CONECT    8    1    1                                                 
CONECT    9   10   30                                                 
CONECT   10    9   12   12   11                                       
CONECT   10   13                                                      
CONECT   11   10   31                                                 
CONECT   12   10   10                                                 
CONECT   13   10   14                                                 
CONECT   14   16   13   17   15                                       
CONECT   14   15                                                      
CONECT   15   14   14                                                 
CONECT   16   14   32                                                 
CONECT   17   18   14                                                 
CONECT   18   19   17   33   34                                       
CONECT   19   18   20   25   35                                       
CONECT   20   21   19   22   36                                       
CONECT   21   20   37                                                 
CONECT   22   20   24   26   23                                       
CONECT   23   22   38   39   40                                       
CONECT   24   22   41                                                 
CONECT   25   19   26                                                 
CONECT   26   25   22    5   42                                       
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    9                                                      
CONECT   31   11                                                      
CONECT   32   16                                                      
CONECT   33   18                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   21                                                      
CONECT   38   23                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
CONECT   42   26                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
