COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.046  -0.616   0.107  1.00  0.00           C  
HETATM    2  C   UNL     1       0.636  -0.355  -0.354  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.221  -2.522   0.661  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.773  -1.163  -0.444  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.593  -0.703   0.733  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.133  -3.502  -0.108  1.00  0.00           C  
HETATM    7  CA  UNL     1      -4.641   0.210   1.687  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.144  -3.429  -1.636  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.688   1.221   1.215  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.986   2.477   0.695  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.025   3.528   0.240  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.143   3.221  -1.269  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.672  -4.648  -2.396  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.201   2.164  -0.559  1.00  0.00           C  
HETATM   15  C   UNL     1       0.000  -2.674  -2.314  1.00  0.00           C  
HETATM   16  C   UNL     1       4.203   0.382   0.035  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.156  -2.606  -0.836  1.00  0.00           C  
HETATM   18  C   UNL     1       4.671  -0.712   0.749  1.00  0.00           C  
HETATM   19  C   UNL     1       6.008  -0.794   1.087  1.00  0.00           C  
HETATM   20  C   UNL     1       6.880   0.213   0.716  1.00  0.00           C  
HETATM   21  C   UNL     1       6.417   1.305   0.004  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.343  -0.993   2.321  1.00  0.00           C  
HETATM   23  C   UNL     1       5.080   1.391  -0.338  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.339  -1.243  -0.078  1.00  0.00           N  
HETATM   25  N   UNL     1      -3.844  -0.237   0.543  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.869   2.595  -1.643  1.00  0.00           N  
HETATM   27  O   UNL     1       2.889   0.462  -0.304  1.00  0.00           O  
HETATM   28  O   UNL     1      -3.125   1.604  -0.584  1.00  0.00           O  
HETATM   29  O   UNL     1       0.378   0.655  -0.975  1.00  0.00           O  
HETATM   30  O   UNL     1      -2.128  -0.751   1.852  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.284  -1.538   1.395  1.00  0.00           O  
HETATM   32 CL   UNL     1       4.498   2.762  -1.230  1.00  0.00          Cl  
HETATM   33 CL   UNL     1       8.560   0.106   1.143  1.00  0.00          Cl  
HETATM   34  H   UNL     1       2.064  -0.697   1.194  1.00  0.00           H  
HETATM   35  H   UNL     1       2.406  -1.547  -0.332  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.571  -2.402   1.686  1.00  0.00           H  
HETATM   37  H   UNL     1       0.811  -2.873   0.651  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.912  -0.490  -1.290  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.431  -4.419   0.401  1.00  0.00           H  
HETATM   40  HA  UNL     1      -3.989   0.679   2.423  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.284   0.780   0.416  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.338   1.487   2.049  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.331   2.892   1.462  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.979   3.378   0.745  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.654   4.540   0.404  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.969   2.532  -1.450  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.290   4.143  -1.832  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.112  -5.353  -1.691  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.429  -4.330  -3.112  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.850  -5.129  -2.926  1.00  0.00           H  
HETATM   51  H   UNL     1       0.632  -3.380  -2.853  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.410  -1.946  -3.014  1.00  0.00           H  
HETATM   53  H   UNL     1       0.593  -2.158  -1.559  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.214  -2.863  -0.883  1.00  0.00           H  
HETATM   55  H   UNL     1       3.990  -1.498   1.040  1.00  0.00           H  
HETATM   56  H   UNL     1       6.372  -1.646   1.643  1.00  0.00           H  
HETATM   57  H   UNL     1       7.100   2.090  -0.285  1.00  0.00           H  
HETATM   58  H1  UNL     1      -4.603  -1.752   2.577  1.00  0.00           H  
HETATM   59  H2  UNL     1      -5.864  -0.675   3.224  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.215  -0.199  -0.352  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.550   2.506  -2.555  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.767  -2.305   1.730  1.00  0.00           H  
CONECT    1   27    2   34   35                                       
CONECT    2    1   24   29   29                                       
CONECT    3    6   24   36   37                                       
CONECT    4   17   24    5   38                                       
CONECT    5   30   30    4   25                                       
CONECT    6    3   17    8   39                                       
CONECT    7   25   22    9   40                                       
CONECT    8    6   13   17   15                                       
CONECT    9    7   10   41   42                                       
CONECT   10   11    9   14   43                                       
CONECT   11   12   10   44   45                                       
CONECT   12   11   26   46   47                                       
CONECT   13    8   48   49   50                                       
CONECT   14   10   26   28   28                                       
CONECT   15    8   51   52   53                                       
CONECT   16   27   23   23   18                                       
CONECT   17    6    8    4   54                                       
CONECT   18   16   19   19   55                                       
CONECT   19   18   18   20   56                                       
CONECT   20   21   21   19   33                                       
CONECT   21   23   20   20   57                                       
CONECT   22    7   31   58   59                                       
CONECT   23   32   16   16   21                                       
CONECT   24    3    2    4                                            
CONECT   25    5    7   60                                            
CONECT   26   12   14   61                                            
CONECT   27   16    1                                                 
CONECT   28   14   14                                                 
CONECT   29    2    2                                                 
CONECT   30    5    5                                                 
CONECT   31   22   62                                                 
CONECT   32   23                                                      
CONECT   33   20                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   15                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   31                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
