COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.710  -1.948   0.198  1.00  0.00           N  
HETATM    2  C   UNL     1       3.482   0.447  -0.479  1.00  0.00           C  
HETATM    3  C   UNL     1       4.679   0.926  -1.018  1.00  0.00           C  
HETATM    4  C   UNL     1       5.841   0.199  -0.853  1.00  0.00           C  
HETATM    5  C   UNL     1       5.778  -0.999  -0.146  1.00  0.00           C  
HETATM    6  C   UNL     1       6.112  -2.951   0.908  1.00  0.00           C  
HETATM    7  C   UNL     1       4.535  -1.426   0.372  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.545   0.175  -0.977  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.499  -1.197   0.684  1.00  0.00           C  
HETATM   10 BR   UNL     1      -5.103  -2.040  -0.099  1.00  0.00          Br  
HETATM   11  C   UNL     1      -3.580  -0.921  -0.134  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.429   0.990  -1.006  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.382  -0.385   0.651  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.348   0.711  -0.192  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.131   1.599  -0.224  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.172   2.563   0.964  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.326   3.518   0.796  1.00  0.00           C  
HETATM   18  O   UNL     1      -1.642   4.369   1.784  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.967   3.517  -0.228  1.00  0.00           O  
HETATM   20  N   UNL     1       1.078   0.775  -0.142  1.00  0.00           N  
HETATM   21  C   UNL     1       2.238   1.228  -0.658  1.00  0.00           C  
HETATM   22  O   UNL     1       2.262   2.278  -1.270  1.00  0.00           O  
HETATM   23  N   UNL     1       3.444  -0.697   0.189  1.00  0.00           N  
HETATM   24  C   UNL     1       4.802  -2.695   1.053  1.00  0.00           C  
HETATM   25  H   UNL     1       7.651  -1.913  -0.033  1.00  0.00           H  
HETATM   26  H   UNL     1       4.694   1.860  -1.561  1.00  0.00           H  
HETATM   27  H   UNL     1       6.777   0.550  -1.261  1.00  0.00           H  
HETATM   28  H   UNL     1       6.620  -3.823   1.295  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.389   0.391  -1.617  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.526  -2.053   1.343  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.402   1.846  -1.664  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.538  -0.601   1.290  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.121   2.168  -1.153  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.300   1.997   1.887  1.00  0.00           H  
HETATM   35  H   UNL     1       0.761   3.125   1.009  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.390   4.963   1.630  1.00  0.00           H  
HETATM   37  H   UNL     1       1.043  -0.096   0.283  1.00  0.00           H  
HETATM   38  H   UNL     1       4.081  -3.312   1.569  1.00  0.00           H  
CONECT    1    5    6   25                                            
CONECT    2   21    3    3   23                                       
CONECT    3    2    2    4   26                                       
CONECT    4    3    5    5   27                                       
CONECT    5    4    4    1    7                                       
CONECT    6    1   24   24   28                                       
CONECT    7   24    5   23   23                                       
CONECT    8   12   11   11   29                                       
CONECT    9   11   13   13   30                                       
CONECT   10   11                                                      
CONECT   11    8    8   10    9                                       
CONECT   12   14   14    8   31                                       
CONECT   13    9    9   14   32                                       
CONECT   14   15   12   12   13                                       
CONECT   15   16   20   14   33                                       
CONECT   16   17   15   34   35                                       
CONECT   17   19   19   18   16                                       
CONECT   18   17   36                                                 
CONECT   19   17   17                                                 
CONECT   20   15   21   37                                            
CONECT   21   20   22   22    2                                       
CONECT   22   21   21                                                 
CONECT   23    7    7    2                                            
CONECT   24    6    6    7   38                                       
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   16                                                      
CONECT   36   18                                                      
CONECT   37   20                                                      
CONECT   38   24                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
