COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.767  -0.042   1.167  1.00  0.00           N  
HETATM    2  N   UNL     1      -4.763  -0.707  -0.393  1.00  0.00           N  
HETATM    3  C   UNL     1       6.264  -1.306  -1.210  1.00  0.00           C  
HETATM    4  C   UNL     1       0.637   1.965   0.451  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.948  -0.526   0.911  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.589   0.323  -0.020  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.695   1.369  -0.310  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.151   1.335  -1.533  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.062  -1.467  -0.223  1.00  0.00           C  
HETATM   10  C   UNL     1      -9.267  -1.699   0.679  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.585  -3.329   1.188  1.00  0.00           C  
HETATM   12  F   UNL     1      -9.771  -3.546   2.076  1.00  0.00           F  
HETATM   13  C   UNL     1      -6.676  -2.630   0.417  1.00  0.00           C  
HETATM   14  C   UNL     1      -8.882  -2.864   1.321  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.357  -1.002  -0.092  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.068  -0.702  -1.059  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.941  -1.364  -2.433  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.850   0.307  -0.649  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.214   2.329  -1.765  1.00  0.00           C  
HETATM   20 CL   UNL     1      -3.597   3.612  -2.871  1.00  0.00          Cl  
HETATM   21  N   UNL     1      -2.041   2.325  -1.165  1.00  0.00           N  
HETATM   22  N   UNL     1      -0.569   1.133   0.431  1.00  0.00           N  
HETATM   23  C   UNL     1       0.743   2.727   1.791  1.00  0.00           C  
HETATM   24  O   UNL     1       0.260   4.064   1.646  1.00  0.00           O  
HETATM   25  O   UNL     1       1.820   1.138   0.402  1.00  0.00           O  
HETATM   26  C   UNL     1       2.885   1.967   0.915  1.00  0.00           C  
HETATM   27  C   UNL     1       2.256   2.728   2.103  1.00  0.00           C  
HETATM   28  O   UNL     1       2.754   4.066   2.161  1.00  0.00           O  
HETATM   29  C   UNL     1       4.051   1.100   1.395  1.00  0.00           C  
HETATM   30  O   UNL     1       4.645   0.439   0.276  1.00  0.00           O  
HETATM   31  P   UNL     1       5.902  -0.558   0.413  1.00  0.00           P  
HETATM   32  O   UNL     1       5.582  -1.625   1.388  1.00  0.00           O  
HETATM   33  O   UNL     1       7.188   0.267   0.922  1.00  0.00           O  
HETATM   34  P   UNL     1       7.687  -2.434  -1.055  1.00  0.00           P  
HETATM   35  O   UNL     1       7.367  -3.501  -0.080  1.00  0.00           O  
HETATM   36  O   UNL     1       8.006  -3.095  -2.488  1.00  0.00           O  
HETATM   37  O   UNL     1       8.973  -1.610  -0.546  1.00  0.00           O  
HETATM   38  H   UNL     1      -4.538  -1.418   0.228  1.00  0.00           H  
HETATM   39  H   UNL     1       5.393  -1.864  -1.554  1.00  0.00           H  
HETATM   40  H   UNL     1       6.499  -0.520  -1.928  1.00  0.00           H  
HETATM   41  H   UNL     1       0.628   2.664  -0.385  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.367  -1.425   1.337  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.106   1.359  -2.035  1.00  0.00           H  
HETATM   44  H   UNL     1     -10.279  -1.335   0.782  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.283  -4.238   1.688  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.664  -2.993   0.314  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.657  -0.093  -0.592  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.410   0.325  -1.181  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.912  -1.361  -2.929  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.222  -0.811  -3.037  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.599  -2.392  -2.311  1.00  0.00           H  
HETATM   52  H   UNL     1       0.192   2.203   2.572  1.00  0.00           H  
HETATM   53  H   UNL     1       0.304   4.588   2.458  1.00  0.00           H  
HETATM   54  H   UNL     1       3.223   2.667   0.151  1.00  0.00           H  
HETATM   55  H   UNL     1       2.453   2.205   3.039  1.00  0.00           H  
HETATM   56  H   UNL     1       2.348   4.607   2.852  1.00  0.00           H  
HETATM   57  H   UNL     1       4.795   1.729   1.883  1.00  0.00           H  
HETATM   58  H   UNL     1       3.683   0.357   2.103  1.00  0.00           H  
HETATM   59  H   UNL     1       7.455   0.984   0.331  1.00  0.00           H  
HETATM   60  H   UNL     1       8.754  -3.708  -2.481  1.00  0.00           H  
HETATM   61  H   UNL     1       9.240  -0.893  -1.137  1.00  0.00           H  
CONECT    1   22    5    5                                            
CONECT    2   18   16   38                                            
CONECT    3   31   34   39   40                                       
CONECT    4   23   22   25   41                                       
CONECT    5    6    1    1   42                                       
CONECT    6   18   18    7    5                                       
CONECT    7   21   21    6   22                                       
CONECT    8   19   19   18   43                                       
CONECT    9   13   16   15   15                                       
CONECT   10   14   14   15   44                                       
CONECT   11   13   13   14   45                                       
CONECT   12   14                                                      
CONECT   13   11   11    9   46                                       
CONECT   14   11   12   10   10                                       
CONECT   15    9    9   10   47                                       
CONECT   16    2   17    9   48                                       
CONECT   17   16   49   50   51                                       
CONECT   18    8    2    6    6                                       
CONECT   19   20    8    8   21                                       
CONECT   20   19                                                      
CONECT   21   19    7    7                                            
CONECT   22    7    4    1                                            
CONECT   23   24    4   27   52                                       
CONECT   24   23   53                                                 
CONECT   25    4   26                                                 
CONECT   26   27   25   29   54                                       
CONECT   27   23   28   26   55                                       
CONECT   28   27   56                                                 
CONECT   29   26   30   57   58                                       
CONECT   30   29   31                                                 
CONECT   31   30   32   32   33                                       
CONECT   31    3                                                      
CONECT   32   31   31                                                 
CONECT   33   31   59                                                 
CONECT   34   35   35    3   36                                       
CONECT   34   37                                                      
CONECT   35   34   34                                                 
CONECT   36   34   60                                                 
CONECT   37   34   61                                                 
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   33                                                      
CONECT   60   36                                                      
CONECT   61   37                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
