COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.713  -1.094   0.347  1.00  0.00           C  
HETATM    2  C   UNL     1       7.582  -1.178  -0.679  1.00  0.00           C  
HETATM    3  C   UNL     1       8.595  -0.034  -0.749  1.00  0.00           C  
HETATM    4  C   UNL     1       6.189  -0.846  -0.208  1.00  0.00           C  
HETATM    5  C   UNL     1       5.913   0.408   0.303  1.00  0.00           C  
HETATM    6  C   UNL     1       4.634   0.714   0.730  1.00  0.00           C  
HETATM    7  C   UNL     1       3.632  -0.234   0.645  1.00  0.00           C  
HETATM    8  C   UNL     1       2.238   0.100   1.110  1.00  0.00           C  
HETATM    9  C   UNL     1       1.448   0.671  -0.038  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.481   0.902   1.458  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.809   0.161   1.268  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.889   0.307   0.167  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.343  -0.766  -0.091  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.959  -0.317   1.166  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.696   0.235   1.302  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.945   0.836  -1.057  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.623   1.605  -0.963  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.907   3.084  -0.695  1.00  0.00           C  
HETATM   19  C   UNL     1       3.908  -1.488   0.133  1.00  0.00           C  
HETATM   20  C   UNL     1       5.187  -1.794  -0.293  1.00  0.00           C  
HETATM   21  N   UNL     1       0.166   1.044   0.145  1.00  0.00           N  
HETATM   22  N   UNL     1      -2.612   0.853   0.251  1.00  0.00           N  
HETATM   23  N   UNL     1      -4.341  -0.153  -0.990  1.00  0.00           N  
HETATM   24  N   UNL     1      -5.512  -0.664  -1.110  1.00  0.00           N  
HETATM   25  O   UNL     1       1.966   0.796  -1.128  1.00  0.00           O  
HETATM   26 CL   UNL     1      -7.915  -1.468  -0.320  1.00  0.00          Cl  
HETATM   27  H   UNL     1       8.450  -0.799   1.363  1.00  0.00           H  
HETATM   28  H   UNL     1       9.524  -1.817   0.263  1.00  0.00           H  
HETATM   29  H   UNL     1       7.649  -1.956  -1.439  1.00  0.00           H  
HETATM   30  H   UNL     1       8.255   0.959  -0.455  1.00  0.00           H  
HETATM   31  H   UNL     1       9.328  -0.059  -1.555  1.00  0.00           H  
HETATM   32  H   UNL     1       6.696   1.149   0.369  1.00  0.00           H  
HETATM   33  H   UNL     1       4.418   1.694   1.130  1.00  0.00           H  
HETATM   34  H   UNL     1       1.750  -0.805   1.473  1.00  0.00           H  
HETATM   35  H   UNL     1       2.289   0.832   1.916  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.670   1.888   1.882  1.00  0.00           H  
HETATM   37  H   UNL     1       0.166   0.334   2.126  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.612  -0.861   0.942  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.354   0.143   2.212  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.627  -0.393   2.011  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.347   0.599   2.257  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.588   1.308  -1.800  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.746  -0.195  -1.351  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.070   1.499  -1.896  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.452   3.185   0.244  1.00  0.00           H  
HETATM   46  H   UNL     1       0.035   3.629  -0.628  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.506   3.493  -1.508  1.00  0.00           H  
HETATM   48  H   UNL     1       3.125  -2.228   0.066  1.00  0.00           H  
HETATM   49  H   UNL     1       5.402  -2.773  -0.697  1.00  0.00           H  
CONECT    1    2    3   27   28                                       
CONECT    2    4    1    3   29                                       
CONECT    3    2    1   30   31                                       
CONECT    4    5    5   20    2                                       
CONECT    5    6    4    4   32                                       
CONECT    6    7    7    5   33                                       
CONECT    7    8    6    6   19                                       
CONECT    8    9    7   34   35                                       
CONECT    9   21    8   25   25                                       
CONECT   10   11   21   36   37                                       
CONECT   11   22   10   38   39                                       
CONECT   12   15   15   23   22                                       
CONECT   13   26   14   14   24                                       
CONECT   14   13   13   15   40                                       
CONECT   15   14   12   12   41                                       
CONECT   16   22   17   42   43                                       
CONECT   17   16   18   21   44                                       
CONECT   18   17   45   46   47                                       
CONECT   19    7   20   20   48                                       
CONECT   20   19   19    4   49                                       
CONECT   21   10   17    9                                            
CONECT   22   12   11   16                                            
CONECT   23   24   24   12                                            
CONECT   24   13   23   23                                            
CONECT   25    9    9                                                 
CONECT   26   13                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
