COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.184  -0.648   0.717  1.00  0.00           N  
HETATM    2  C   UNL     1       5.215  -0.822  -0.617  1.00  0.00           C  
HETATM    3  O   UNL     1       4.586  -0.070  -1.335  1.00  0.00           O  
HETATM    4  N   UNL     1       5.934  -1.818  -1.168  1.00  0.00           N  
HETATM    5  C   UNL     1       6.637  -2.662  -0.386  1.00  0.00           C  
HETATM    6  O   UNL     1       7.288  -3.563  -0.883  1.00  0.00           O  
HETATM    7  C   UNL     1       6.613  -2.490   1.019  1.00  0.00           C  
HETATM    8  C   UNL     1       5.884  -1.482   1.545  1.00  0.00           C  
HETATM    9  P   UNL     1      -1.173   1.129  -0.450  1.00  0.00           P  
HETATM   10  P   UNL     1      -3.947   0.063  -0.266  1.00  0.00           P  
HETATM   11  P   UNL     1      -6.510  -1.228   0.473  1.00  0.00           P  
HETATM   12  C   UNL     1       4.398   0.449   1.287  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.758   2.611  -0.682  1.00  0.00           O  
HETATM   14  O   UNL     1      -3.760  -0.669  -1.688  1.00  0.00           O  
HETATM   15  O   UNL     1      -7.468   0.040   0.732  1.00  0.00           O  
HETATM   16  C   UNL     1       4.983   1.802   0.837  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.001   0.456  -1.757  1.00  0.00           O  
HETATM   18  O   UNL     1      -4.484   1.425  -0.479  1.00  0.00           O  
HETATM   19  O   UNL     1      -6.728  -1.738  -0.900  1.00  0.00           O  
HETATM   20  C   UNL     1       3.810   2.498   0.105  1.00  0.00           C  
HETATM   21  O   UNL     1       3.756   3.887   0.434  1.00  0.00           O  
HETATM   22  C   UNL     1      -2.335   0.171   0.578  1.00  0.00           C  
HETATM   23  O   UNL     1      -4.973  -0.783   0.642  1.00  0.00           O  
HETATM   24  O   UNL     1      -6.854  -2.386   1.537  1.00  0.00           O  
HETATM   25  C   UNL     1       2.580   1.746   0.674  1.00  0.00           C  
HETATM   26  O   UNL     1       3.045   0.383   0.804  1.00  0.00           O  
HETATM   27  C   UNL     1       1.403   1.822  -0.301  1.00  0.00           C  
HETATM   28  O   UNL     1       0.250   1.224   0.296  1.00  0.00           O  
HETATM   29  H   UNL     1       7.170  -3.156   1.662  1.00  0.00           H  
HETATM   30  H   UNL     1       5.854  -1.335   2.615  1.00  0.00           H  
HETATM   31  H   UNL     1       4.407   0.384   2.375  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.896   3.111   0.134  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.410  -1.568  -1.625  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.378   0.427   1.614  1.00  0.00           H  
HETATM   35  H   UNL     1       5.295   2.388   1.701  1.00  0.00           H  
HETATM   36  H   UNL     1       5.822   1.648   0.158  1.00  0.00           H  
HETATM   37  H   UNL     1       3.887   2.358  -0.974  1.00  0.00           H  
HETATM   38  H   UNL     1       4.545   4.383   0.177  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.939  -0.832   0.735  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.461   0.666   1.541  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.766  -2.704   1.492  1.00  0.00           H  
HETATM   42  H   UNL     1       2.300   2.148   1.647  1.00  0.00           H  
HETATM   43  H   UNL     1       1.191   2.866  -0.534  1.00  0.00           H  
HETATM   44  H   UNL     1       1.655   1.290  -1.218  1.00  0.00           H  
HETATM   45  H   UNL     1       5.945  -1.930  -2.131  1.00  0.00           H  
CONECT    1   12    8    2                                            
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   45                                            
CONECT    5    4    7    6    6                                       
CONECT    6    5    5                                                 
CONECT    7    5    8    8   29                                       
CONECT    8    1    7    7   30                                       
CONECT    9   17   17   22   28                                       
CONECT    9   13                                                      
CONECT   10   18   18   23   14                                       
CONECT   10   22                                                      
CONECT   11   19   19   15   23                                       
CONECT   11   24                                                      
CONECT   12    1   26   16   31                                       
CONECT   13    9   32                                                 
CONECT   14   10   33                                                 
CONECT   15   11   34                                                 
CONECT   16   12   20   35   36                                       
CONECT   17    9    9                                                 
CONECT   18   10   10                                                 
CONECT   19   11   11                                                 
CONECT   20   16   21   25   37                                       
CONECT   21   20   38                                                 
CONECT   22    9   10   39   40                                       
CONECT   23   10   11                                                 
CONECT   24   11   41                                                 
CONECT   25   20   27   26   42                                       
CONECT   26   12   25                                                 
CONECT   27   25   28   43   44                                       
CONECT   28    9   27                                                 
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   16                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   22                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
CONECT   45    4                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
