COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.674   0.125  -1.572  1.00  0.00           C  
HETATM    2  C   UNL     1       8.508   0.623  -0.588  1.00  0.00           C  
HETATM    3  C   UNL     1       7.982   1.046   0.619  1.00  0.00           C  
HETATM    4  C   UNL     1       6.621   0.970   0.846  1.00  0.00           C  
HETATM    5  C   UNL     1       5.781   0.470  -0.141  1.00  0.00           C  
HETATM    6  C   UNL     1       6.313   0.047  -1.352  1.00  0.00           C  
HETATM    7  N   UNL     1       4.400   0.391   0.085  1.00  0.00           N  
HETATM    8  C   UNL     1       3.470  -0.083  -0.796  1.00  0.00           C  
HETATM    9  C   UNL     1       2.220   0.023  -0.154  1.00  0.00           C  
HETATM   10  C   UNL     1       2.457   0.574   1.125  1.00  0.00           C  
HETATM   11  N   UNL     1       3.737   0.780   1.256  1.00  0.00           N  
HETATM   12  C   UNL     1       1.076  -0.403  -0.851  1.00  0.00           C  
HETATM   13  N   UNL     1       1.226  -0.884  -2.078  1.00  0.00           N  
HETATM   14  C   UNL     1       2.420  -0.965  -2.640  1.00  0.00           C  
HETATM   15  N   UNL     1       3.519  -0.580  -2.030  1.00  0.00           N  
HETATM   16  O   UNL     1      -0.151  -0.324  -0.283  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.258  -0.779  -1.064  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.488  -2.269  -0.803  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.882  -2.458   0.558  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.123  -3.822   0.909  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.536  -3.905   2.380  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.788  -3.241   2.561  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.493  -0.005  -0.683  1.00  0.00           C  
HETATM   24  O   UNL     1      -2.432   0.851   0.173  1.00  0.00           O  
HETATM   25  N   UNL     1      -3.667  -0.266  -1.293  1.00  0.00           N  
HETATM   26  C   UNL     1      -4.831   0.374  -0.869  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.053   0.023  -1.431  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.201   0.666  -1.000  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.085   1.641  -0.018  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.838   1.938   0.496  1.00  0.00           C  
HETATM   31  N   UNL     1      -4.762   1.305   0.069  1.00  0.00           N  
HETATM   32 CL   UNL     1      -8.493   2.477   0.557  1.00  0.00          Cl  
HETATM   33 CL   UNL     1       5.962   1.499   2.362  1.00  0.00          Cl  
HETATM   34  H   UNL     1       8.087  -0.200  -2.516  1.00  0.00           H  
HETATM   35  H   UNL     1       9.572   0.683  -0.762  1.00  0.00           H  
HETATM   36  H   UNL     1       8.636   1.434   1.386  1.00  0.00           H  
HETATM   37  H   UNL     1       5.662  -0.342  -2.122  1.00  0.00           H  
HETATM   38  H   UNL     1       1.705   0.785   1.870  1.00  0.00           H  
HETATM   39  H   UNL     1       2.495  -1.364  -3.641  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.044  -0.625  -2.122  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.273  -2.637  -1.463  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.566  -2.818  -0.994  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.922  -4.222   0.284  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.214  -4.404   0.753  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.634  -4.951   2.671  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.777  -3.426   2.998  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.112  -3.254   3.472  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.701  -0.898  -2.028  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.106  -0.739  -2.193  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.164   0.415  -1.419  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.742   2.696   1.260  1.00  0.00           H  
CONECT    1    6    6    2   34                                       
CONECT    2    1    3    3   35                                       
CONECT    3    2    2    4   36                                       
CONECT    4    5    5    3   33                                       
CONECT    5    6    7    4    4                                       
CONECT    6    1    1    5   37                                       
CONECT    7    5    8   11                                            
CONECT    8   15    7    9    9                                       
CONECT    9    8    8   12   10                                       
CONECT   10    9   11   11   38                                       
CONECT   11    7   10   10                                            
CONECT   12   13   13    9   16                                       
CONECT   13   14   12   12                                            
CONECT   14   15   15   13   39                                       
CONECT   15   14   14    8                                            
CONECT   16   12   17                                                 
CONECT   17   16   18   23   40                                       
CONECT   18   19   17   41   42                                       
CONECT   19   20   18                                                 
CONECT   20   21   19   43   44                                       
CONECT   21   22   20   45   46                                       
CONECT   22   21   47                                                 
CONECT   23   17   25   24   24                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   48                                            
CONECT   26   25   31   31   27                                       
CONECT   27   26   28   28   49                                       
CONECT   28   27   27   29   50                                       
CONECT   29   30   30   28   32                                       
CONECT   30   31   29   29   51                                       
CONECT   31   26   26   30                                            
CONECT   32   29                                                      
CONECT   33    4                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    6                                                      
CONECT   38   10                                                      
CONECT   39   14                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   25                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   30                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
