COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -8.863   1.866  -0.481  1.00  0.00           N  
HETATM    2  C   UNL     1      -6.639   0.863  -0.320  1.00  0.00           C  
HETATM    3  O   UNL     1      -9.145   2.272   1.711  1.00  0.00           O  
HETATM    4  N   UNL     1       1.866  -0.259   0.153  1.00  0.00           N  
HETATM    5  C   UNL     1      -9.226   2.545  -1.735  1.00  0.00           C  
HETATM    6  N   UNL     1       0.091  -1.763   0.032  1.00  0.00           N  
HETATM    7  C   UNL     1      -9.956   3.817  -1.265  1.00  0.00           C  
HETATM    8  C   UNL     1      -9.303   2.598   0.552  1.00  0.00           C  
HETATM    9 BR   UNL     1       3.520   0.285   2.977  1.00  0.00          Br  
HETATM   10  C   UNL     1       4.516   0.768   1.443  1.00  0.00           C  
HETATM   11  C   UNL     1       5.898   0.765   1.487  1.00  0.00           C  
HETATM   12  C   UNL     1       6.626   1.118   0.366  1.00  0.00           C  
HETATM   13  C   UNL     1       8.132   1.115   0.414  1.00  0.00           C  
HETATM   14  C   UNL     1       5.971   1.474  -0.800  1.00  0.00           C  
HETATM   15 BR   UNL     1       6.966   1.964  -2.331  1.00  0.00          Br  
HETATM   16  C   UNL     1       4.589   1.476  -0.844  1.00  0.00           C  
HETATM   17  C   UNL     1       3.861   1.118   0.276  1.00  0.00           C  
HETATM   18  C   UNL     1       2.355   1.120   0.228  1.00  0.00           C  
HETATM   19  C   UNL     1       0.511  -0.508   0.100  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.333   0.517   0.118  1.00  0.00           N  
HETATM   21  C   UNL     1      -1.638   0.327   0.068  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.206  -2.044  -0.021  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.638  -3.351  -0.091  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.665  -4.438  -0.227  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.357  -4.688  -1.718  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.199  -6.225  -1.821  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.288  -6.747  -0.850  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.257  -5.747   0.325  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.133  -0.980  -0.004  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.581  -1.238  -0.060  1.00  0.00           C  
HETATM   31  O   UNL     1      -3.997  -2.380  -0.019  1.00  0.00           O  
HETATM   32  N   UNL     1      -4.446  -0.209  -0.157  1.00  0.00           N  
HETATM   33  C   UNL     1      -5.887  -0.466  -0.212  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.144   0.594  -0.378  1.00  0.00           C  
HETATM   35  O   UNL     1      -9.930   3.723   0.189  1.00  0.00           O  
HETATM   36  H   UNL     1      -6.413   1.479   0.550  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.327   1.384  -1.225  1.00  0.00           H  
HETATM   38  H   UNL     1       2.496  -0.996   0.141  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.332   2.804  -2.302  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.888   1.918  -2.332  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.422   4.707  -1.600  1.00  0.00           H  
HETATM   42  H   UNL     1     -10.984   3.828  -1.628  1.00  0.00           H  
HETATM   43  H   UNL     1       6.410   0.488   2.397  1.00  0.00           H  
HETATM   44  H   UNL     1       8.503   0.132   0.121  1.00  0.00           H  
HETATM   45  H   UNL     1       8.519   1.868  -0.273  1.00  0.00           H  
HETATM   46  H   UNL     1       8.464   1.342   1.427  1.00  0.00           H  
HETATM   47  H   UNL     1       4.078   1.753  -1.754  1.00  0.00           H  
HETATM   48  H   UNL     1       2.020   1.673  -0.650  1.00  0.00           H  
HETATM   49  H   UNL     1       1.964   1.596   1.128  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.315   1.169   0.084  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.586  -3.551  -0.051  1.00  0.00           H  
HETATM   52  H   UNL     1       0.251  -4.188   0.307  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.184  -4.347  -2.341  1.00  0.00           H  
HETATM   54  H   UNL     1       0.568  -4.189  -2.005  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.393  -6.567  -2.837  1.00  0.00           H  
HETATM   56  H   UNL     1       0.793  -6.535  -1.491  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.265  -6.738  -1.332  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.042  -7.751  -0.505  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.627  -6.132   1.127  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.268  -5.573   0.694  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.114   0.702  -0.189  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.199  -0.987   0.693  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.113  -1.082  -1.082  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.455   0.073   0.527  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.369  -0.022  -1.248  1.00  0.00           H  
CONECT    1    5    8   34                                            
CONECT    2   34   33   36   37                                       
CONECT    3    8    8                                                 
CONECT    4   19   18   38                                            
CONECT    5    7    1   39   40                                       
CONECT    6   19   19   22                                            
CONECT    7   35    5   41   42                                       
CONECT    8   35    3    3    1                                       
CONECT    9   10                                                      
CONECT   10   17   17   11    9                                       
CONECT   11   12   12   10   43                                       
CONECT   12   14   13   11   11                                       
CONECT   13   12   44   45   46                                       
CONECT   14   15   16   16   12                                       
CONECT   15   14                                                      
CONECT   16   14   14   17   47                                       
CONECT   17   16   18   10   10                                       
CONECT   18    4   17   48   49                                       
CONECT   19   20    4    6    6                                       
CONECT   20   21   21   19                                            
CONECT   21   20   20   29   50                                       
CONECT   22   29   29    6   23                                       
CONECT   23   22   24   51                                            
CONECT   24   23   25   28   52                                       
CONECT   25   24   26   53   54                                       
CONECT   26   25   27   55   56                                       
CONECT   27   26   28   57   58                                       
CONECT   28   24   27   59   60                                       
CONECT   29   21   30   22   22                                       
CONECT   30   32   29   31   31                                       
CONECT   31   30   30                                                 
CONECT   32   33   30   61                                            
CONECT   33    2   32   62   63                                       
CONECT   34    1    2   64   65                                       
CONECT   35    7    8                                                 
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   21                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   28                                                      
CONECT   61   32                                                      
CONECT   62   33                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
