COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.987   2.624  -0.190  1.00  0.00           O  
HETATM    2  P   UNL     1      -2.186   4.000  -0.430  1.00  0.00           P  
HETATM    3  O   UNL     1      -2.251   4.830   0.793  1.00  0.00           O  
HETATM    4  O   UNL     1      -0.647   3.671  -0.774  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.497  -1.672   0.034  1.00  0.00           C  
HETATM    6  N   UNL     1      -2.235  -2.393  -0.144  1.00  0.00           N  
HETATM    7  C   UNL     1      -1.059  -1.717  -0.047  1.00  0.00           C  
HETATM    8  C   UNL     1       0.125  -2.409  -0.217  1.00  0.00           C  
HETATM    9  C   UNL     1       1.388  -1.742  -0.124  1.00  0.00           C  
HETATM   10  C   UNL     1       2.424  -1.195  -0.049  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.145  -4.421  -0.569  1.00  0.00           N  
HETATM   12  C   UNL     1       0.048  -3.848  -0.493  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.258  -3.712  -0.394  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.335  -4.279  -0.467  1.00  0.00           O  
HETATM   15  N   UNL     1       1.192  -4.588  -0.671  1.00  0.00           N  
HETATM   16  O   UNL     1      -3.319  -0.291  -0.301  1.00  0.00           O  
HETATM   17  C   UNL     1      -3.646   0.534   0.829  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.444  -0.376   2.066  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.938  -1.743   1.512  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.706   1.739   0.896  1.00  0.00           C  
HETATM   21  C   UNL     1       3.688  -0.528   0.043  1.00  0.00           C  
HETATM   22  C   UNL     1       3.738   0.844   0.314  1.00  0.00           C  
HETATM   23  C   UNL     1       4.944   1.479   0.402  1.00  0.00           C  
HETATM   24  C   UNL     1       6.128   0.759   0.221  1.00  0.00           C  
HETATM   25  C   UNL     1       6.080  -0.611  -0.050  1.00  0.00           C  
HETATM   26  C   UNL     1       4.875  -1.249  -0.131  1.00  0.00           C  
HETATM   27  C   UNL     1       7.392   1.426   0.313  1.00  0.00           C  
HETATM   28  C   UNL     1       8.428   1.973   0.388  1.00  0.00           C  
HETATM   29  H   UNL     1      -0.528   3.129  -1.566  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.266  -2.110  -0.602  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.051  -0.656   0.157  1.00  0.00           H  
HETATM   32  H   UNL     1       2.060  -4.159  -0.614  1.00  0.00           H  
HETATM   33  H   UNL     1       1.131  -5.538  -0.854  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.683   0.865   0.769  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.392  -0.424   2.351  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.060  -0.046   2.902  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.022  -1.825   1.592  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.446  -2.570   2.025  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.673   1.398   0.828  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.854   2.263   1.840  1.00  0.00           H  
HETATM   41  H   UNL     1       2.823   1.400   0.454  1.00  0.00           H  
HETATM   42  H   UNL     1       4.982   2.538   0.611  1.00  0.00           H  
HETATM   43  H   UNL     1       6.995  -1.166  -0.190  1.00  0.00           H  
HETATM   44  H   UNL     1       4.838  -2.309  -0.336  1.00  0.00           H  
HETATM   45  H   UNL     1       9.355   2.462   0.455  1.00  0.00           H  
HETATM   46  O   UNL     1      -2.851   4.800  -1.658  1.00  0.00           O  
HETATM   47  H   UNL     1      -2.417   5.641  -1.860  1.00  0.00           H  
CONECT    1   20    2                                                 
CONECT    2    4    1    3    3                                       
CONECT    2   46                                                      
CONECT    3    2    2                                                 
CONECT    4    2   29                                                 
CONECT    5   19   16    6   30                                       
CONECT    6    5    7   13                                            
CONECT    7    6    8    8   31                                       
CONECT    8    7    7    9   12                                       
CONECT    9    8   10   10   10                                       
CONECT   10    9    9    9   21                                       
CONECT   11   13   12   12                                            
CONECT   12    8   11   11   15                                       
CONECT   13    6   14   14   11                                       
CONECT   14   13   13                                                 
CONECT   15   12   32   33                                            
CONECT   16   17    5                                                 
CONECT   17   20   18   16   34                                       
CONECT   18   17   19   35   36                                       
CONECT   19   18    5   37   38                                       
CONECT   20   17    1   39   40                                       
CONECT   21   10   22   22   26                                       
CONECT   22   21   21   23   41                                       
CONECT   23   22   24   24   42                                       
CONECT   24   23   23   25   27                                       
CONECT   25   26   26   24   43                                       
CONECT   26   21   25   25   44                                       
CONECT   27   24   28   28   28                                       
CONECT   28   27   27   27   45                                       
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32   15                                                      
CONECT   33   15                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   25                                                      
CONECT   44   26                                                      
CONECT   45   28                                                      
CONECT   46    2   47                                                 
CONECT   47   46                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
