COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.261   0.660  -0.228  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.230  -0.105   0.937  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.087  -2.999   0.756  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.525   0.143  -1.367  1.00  0.00           C  
HETATM    5  C   UNL     1       2.138  -0.701  -2.079  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.362  -1.673   0.499  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.649  -0.575  -0.156  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.694  -1.403   1.063  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.527   0.874   0.313  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.300  -0.786  -0.731  1.00  0.00           C  
HETATM   11  C   UNL     1       1.007  -0.115  -1.627  1.00  0.00           C  
HETATM   12  C   UNL     1       2.416  -0.102   0.021  1.00  0.00           C  
HETATM   13  C   UNL     1       3.113   0.044   1.238  1.00  0.00           C  
HETATM   14  C   UNL     1       4.390  -0.414   1.334  1.00  0.00           C  
HETATM   15  C   UNL     1       4.316  -1.158  -0.935  1.00  0.00           C  
HETATM   16  C   UNL     1       4.995  -1.025   0.223  1.00  0.00           C  
HETATM   17  C   UNL     1       8.142   1.788   0.711  1.00  0.00           C  
HETATM   18  C   UNL     1       9.642   0.211  -0.511  1.00  0.00           C  
HETATM   19  C   UNL     1       7.264   0.596   1.098  1.00  0.00           C  
HETATM   20  C   UNL     1       8.719  -0.936  -0.088  1.00  0.00           C  
HETATM   21  C   UNL     1       9.590   1.317   0.546  1.00  0.00           C  
HETATM   22  C   UNL     1      10.461   2.493   0.099  1.00  0.00           C  
HETATM   23  C   UNL     1      10.106   0.775   1.880  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.252   0.099  -2.426  1.00  0.00           C  
HETATM   25  C   UNL     1       6.410  -1.534   0.326  1.00  0.00           C  
HETATM   26  N   UNL     1      -6.132  -3.516   1.418  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.591  -1.930  -0.732  1.00  0.00           N  
HETATM   28  N   UNL     1       1.192   0.242  -0.354  1.00  0.00           N  
HETATM   29  N   UNL     1      -1.468  -1.720  -1.323  1.00  0.00           N  
HETATM   30  N   UNL     1      -7.113  -2.534   1.601  1.00  0.00           N  
HETATM   31  N   UNL     1       3.034  -0.702  -1.045  1.00  0.00           N  
HETATM   32  N   UNL     1      -1.387  -0.498  -1.717  1.00  0.00           N  
HETATM   33  N   UNL     1       7.346  -0.435   0.056  1.00  0.00           N  
HETATM   34 BR   UNL     1      -7.295   2.596   0.173  1.00  0.00          Br  
HETATM   35  H   UNL     1      -4.746   1.478  -0.709  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.207   0.113   1.344  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.187  -3.527   0.477  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.773   1.177  -1.556  1.00  0.00           H  
HETATM   39  H   UNL     1       2.302  -1.097  -3.071  1.00  0.00           H  
HETATM   40  H   UNL     1       2.637   0.516   2.085  1.00  0.00           H  
HETATM   41  H   UNL     1       4.936  -0.309   2.260  1.00  0.00           H  
HETATM   42  H   UNL     1       4.791  -1.629  -1.783  1.00  0.00           H  
HETATM   43  H   UNL     1       7.787   2.210  -0.230  1.00  0.00           H  
HETATM   44  H   UNL     1       8.092   2.546   1.492  1.00  0.00           H  
HETATM   45  H   UNL     1      10.664  -0.157  -0.602  1.00  0.00           H  
HETATM   46  H   UNL     1       9.312   0.609  -1.471  1.00  0.00           H  
HETATM   47  H   UNL     1       7.610   0.182   2.046  1.00  0.00           H  
HETATM   48  H   UNL     1       6.230   0.925   1.202  1.00  0.00           H  
HETATM   49  H   UNL     1       8.743  -1.720  -0.845  1.00  0.00           H  
HETATM   50  H   UNL     1       9.058  -1.342   0.865  1.00  0.00           H  
HETATM   51  H   UNL     1      10.091   2.880  -0.850  1.00  0.00           H  
HETATM   52  H   UNL     1      10.424   3.280   0.853  1.00  0.00           H  
HETATM   53  H   UNL     1      11.491   2.156  -0.023  1.00  0.00           H  
HETATM   54  H   UNL     1      11.134   0.435   1.761  1.00  0.00           H  
HETATM   55  H   UNL     1      10.068   1.563   2.632  1.00  0.00           H  
HETATM   56  H   UNL     1       9.482  -0.061   2.198  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.425   1.168  -2.553  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.147  -0.371  -3.404  1.00  0.00           H  
HETATM   59  H   UNL     1       6.585  -1.922   1.329  1.00  0.00           H  
HETATM   60  H   UNL     1       6.564  -2.329  -0.403  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.199  -4.434   1.724  1.00  0.00           H  
CONECT    1    9    7    7   35                                       
CONECT    2    9    9    8   36                                       
CONECT    3    6    6   26   37                                       
CONECT    4   10   10   32   38                                       
CONECT    5   31   11   11   39                                       
CONECT    6    8    7    3    3                                       
CONECT    7    1    1    6   10                                       
CONECT    8    2    6   30   30                                       
CONECT    9   34    2    2    1                                       
CONECT   10    7    4    4   27                                       
CONECT   11   28    5    5   24                                       
CONECT   12   13   31   28   28                                       
CONECT   13   14   14   12   40                                       
CONECT   14   16   13   13   41                                       
CONECT   15   16   16   31   42                                       
CONECT   16   25   14   15   15                                       
CONECT   17   21   19   43   44                                       
CONECT   18   20   21   45   46                                       
CONECT   19   33   17   47   48                                       
CONECT   20   18   33   49   50                                       
CONECT   21   23   18   17   22                                       
CONECT   22   21   51   52   53                                       
CONECT   23   21   54   55   56                                       
CONECT   24   11   32   57   58                                       
CONECT   25   33   16   59   60                                       
CONECT   26   30    3   61                                            
CONECT   27   10   29   29                                            
CONECT   28   12   12   11                                            
CONECT   29   32   27   27                                            
CONECT   30    8    8   26                                            
CONECT   31   15   12    5                                            
CONECT   32    4   24   29                                            
CONECT   33   20   25   19                                            
CONECT   34    9                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
