COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.375  -0.462   0.447  1.00  0.00           N  
HETATM    2  C   UNL     1       5.579  -0.373  -0.879  1.00  0.00           C  
HETATM    3  O   UNL     1       5.053   0.525  -1.508  1.00  0.00           O  
HETATM    4  N   UNL     1       6.357  -1.265  -1.521  1.00  0.00           N  
HETATM    5  C   UNL     1       6.947  -2.267  -0.839  1.00  0.00           C  
HETATM    6  O   UNL     1       7.652  -3.073  -1.419  1.00  0.00           O  
HETATM    7  C   UNL     1       6.740  -2.372   0.558  1.00  0.00           C  
HETATM    8  C   UNL     1       7.388  -3.483   1.344  1.00  0.00           C  
HETATM    9  C   UNL     1       5.955  -1.464   1.176  1.00  0.00           C  
HETATM   10  P   UNL     1      -0.879   1.656  -0.841  1.00  0.00           P  
HETATM   11  P   UNL     1      -3.593   0.510  -0.523  1.00  0.00           P  
HETATM   12  P   UNL     1      -6.023  -1.067   0.164  1.00  0.00           P  
HETATM   13  C   UNL     1       4.528   0.526   1.119  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.555   1.341  -2.386  1.00  0.00           O  
HETATM   15  O   UNL     1      -3.885   0.331  -1.963  1.00  0.00           O  
HETATM   16  O   UNL     1      -6.340  -1.261  -1.402  1.00  0.00           O  
HETATM   17  C   UNL     1       5.130   1.941   0.969  1.00  0.00           C  
HETATM   18  O   UNL     1      -1.375   3.045  -0.714  1.00  0.00           O  
HETATM   19  O   UNL     1      -4.312   1.849   0.008  1.00  0.00           O  
HETATM   20 CL   UNL     1      -3.417  -2.427  -0.188  1.00  0.00          Cl  
HETATM   21  O   UNL     1      -6.578  -2.336   0.985  1.00  0.00           O  
HETATM   22  C   UNL     1       3.898   2.857   0.794  1.00  0.00           C  
HETATM   23  O   UNL     1       3.829   3.811   1.855  1.00  0.00           O  
HETATM   24  O   UNL     1      -2.003   0.634  -0.309  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.222  -0.927   0.407  1.00  0.00           C  
HETATM   26  O   UNL     1      -6.684   0.164   0.652  1.00  0.00           O  
HETATM   27  C   UNL     1       2.697   1.887   0.859  1.00  0.00           C  
HETATM   28  O   UNL     1       3.238   0.604   0.475  1.00  0.00           O  
HETATM   29  C   UNL     1       1.608   2.322  -0.123  1.00  0.00           C  
HETATM   30  O   UNL     1       0.462   1.484   0.035  1.00  0.00           O  
HETATM   31 CL   UNL     1      -3.867  -0.710   2.161  1.00  0.00          Cl  
HETATM   32  H   UNL     1       6.493  -1.186  -2.478  1.00  0.00           H  
HETATM   33  H   UNL     1       7.978  -4.107   0.672  1.00  0.00           H  
HETATM   34  H   UNL     1       8.038  -3.056   2.108  1.00  0.00           H  
HETATM   35  H   UNL     1       6.617  -4.089   1.819  1.00  0.00           H  
HETATM   36  H   UNL     1       5.787  -1.528   2.241  1.00  0.00           H  
HETATM   37  H   UNL     1       4.411   0.272   2.173  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.224   0.446  -2.544  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.938  -2.050  -1.790  1.00  0.00           H  
HETATM   40  H   UNL     1       5.686   2.216   1.865  1.00  0.00           H  
HETATM   41  H   UNL     1       5.772   1.992   0.090  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.164   2.029   0.947  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.532  -2.472   0.902  1.00  0.00           H  
HETATM   44  H   UNL     1       3.931   3.360  -0.172  1.00  0.00           H  
HETATM   45  H   UNL     1       4.589   4.408   1.898  1.00  0.00           H  
HETATM   46  H   UNL     1       2.298   1.845   1.872  1.00  0.00           H  
HETATM   47  H   UNL     1       1.331   3.357   0.076  1.00  0.00           H  
HETATM   48  H   UNL     1       1.983   2.237  -1.143  1.00  0.00           H  
CONECT    1    2   13    9                                            
CONECT    2    3    3    4    1                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   32                                            
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5    9    9    8                                       
CONECT    8    7   33   34   35                                       
CONECT    9    1    7    7   36                                       
CONECT   10   30   24   18   18                                       
CONECT   10   14                                                      
CONECT   11   15   15   24   19                                       
CONECT   11   25                                                      
CONECT   12   25   26   26   16                                       
CONECT   12   21                                                      
CONECT   13   17    1   28   37                                       
CONECT   14   10   38                                                 
CONECT   15   11   11                                                 
CONECT   16   12   39                                                 
CONECT   17   13   22   40   41                                       
CONECT   18   10   10                                                 
CONECT   19   11   42                                                 
CONECT   20   25                                                      
CONECT   21   12   43                                                 
CONECT   22   17   23   27   44                                       
CONECT   23   22   45                                                 
CONECT   24   11   10                                                 
CONECT   25   11   20   31   12                                       
CONECT   26   12   12                                                 
CONECT   27   22   28   29   46                                       
CONECT   28   13   27                                                 
CONECT   29   27   30   47   48                                       
CONECT   30   29   10                                                 
CONECT   31   25                                                      
CONECT   32    4                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   27                                                      
CONECT   47   29                                                      
CONECT   48   29                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
