COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.565   1.133   4.623  1.00  0.00           C  
HETATM    2  C   UNL     1       6.819   1.694   3.223  1.00  0.00           C  
HETATM    3  C   UNL     1       6.150   0.793   2.183  1.00  0.00           C  
HETATM    4  C   UNL     1       3.597   1.115  -0.747  1.00  0.00           C  
HETATM    5  C   UNL     1       2.216   0.867  -0.795  1.00  0.00           C  
HETATM    6  C   UNL     1       1.359   1.955  -1.002  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.786   2.935  -1.273  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.263   2.535  -1.305  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.937   1.639   0.120  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.593   0.779   1.465  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.482   0.859   0.403  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.022   1.354  -0.808  1.00  0.00           C  
HETATM   13  C   UNL     1       1.681  -0.506  -0.631  1.00  0.00           C  
HETATM   14  C   UNL     1       1.973  -1.488  -1.577  1.00  0.00           C  
HETATM   15  C   UNL     1       1.473  -2.764  -1.419  1.00  0.00           C  
HETATM   16  C   UNL     1       0.683  -3.070  -0.325  1.00  0.00           C  
HETATM   17  C   UNL     1       3.186   3.355  -1.092  1.00  0.00           C  
HETATM   18  C   UNL     1       0.390  -2.099   0.617  1.00  0.00           C  
HETATM   19  C   UNL     1       0.890  -0.821   0.472  1.00  0.00           C  
HETATM   20  N   UNL     1       6.394   1.330   0.842  1.00  0.00           N  
HETATM   21  N   UNL     1       4.492   0.078  -0.545  1.00  0.00           N  
HETATM   22  N   UNL     1       1.882   3.168  -1.144  1.00  0.00           N  
HETATM   23  N   UNL     1       4.031   2.362  -0.904  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.342   1.173   1.290  1.00  0.00           N  
HETATM   25  N   UNL     1      -4.758   1.730  -0.913  1.00  0.00           N  
HETATM   26  O   UNL     1       6.411   1.195  -1.622  1.00  0.00           O  
HETATM   27  O   UNL     1       6.755  -0.859  -0.240  1.00  0.00           O  
HETATM   28  O   UNL     1       0.017   1.773  -1.058  1.00  0.00           O  
HETATM   29  O   UNL     1      -2.650   2.039  -0.022  1.00  0.00           O  
HETATM   30  S   UNL     1       6.118   0.387  -0.491  1.00  0.00           S  
HETATM   31 BR   UNL     1      -8.279   0.308   0.604  1.00  0.00          Br  
HETATM   32 BR   UNL     1       0.001  -4.822  -0.116  1.00  0.00          Br  
HETATM   33  H   UNL     1       7.042   1.775   5.364  1.00  0.00           H  
HETATM   34  H   UNL     1       5.492   1.097   4.811  1.00  0.00           H  
HETATM   35  H   UNL     1       6.981   0.128   4.693  1.00  0.00           H  
HETATM   36  H   UNL     1       6.404   2.700   3.153  1.00  0.00           H  
HETATM   37  H   UNL     1       7.893   1.731   3.035  1.00  0.00           H  
HETATM   38  H   UNL     1       6.566  -0.213   2.252  1.00  0.00           H  
HETATM   39  H   UNL     1       5.077   0.756   2.370  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.514   3.395  -2.222  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.620   3.646  -0.463  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.869   3.405  -1.557  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.412   1.758  -2.055  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.918   0.399   2.422  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.688   1.429  -1.655  1.00  0.00           H  
HETATM   46  H   UNL     1       2.589  -1.250  -2.431  1.00  0.00           H  
HETATM   47  H   UNL     1       1.699  -3.526  -2.151  1.00  0.00           H  
HETATM   48  H   UNL     1       3.575   4.355  -1.217  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.227  -2.344   1.469  1.00  0.00           H  
HETATM   50  H   UNL     1       0.664  -0.065   1.210  1.00  0.00           H  
HETATM   51  H   UNL     1       6.717   2.239   0.735  1.00  0.00           H  
HETATM   52  H   UNL     1       4.167  -0.829  -0.435  1.00  0.00           H  
CONECT    1    2   33   34   35                                       
CONECT    2    1    3   36   37                                       
CONECT    3    2   20   38   39                                       
CONECT    4   23   21    5    5                                       
CONECT    5    4    4    6   13                                       
CONECT    6   22   22    5   28                                       
CONECT    7   28    8   40   41                                       
CONECT    8    7   29   42   43                                       
CONECT    9   29   24   24   25                                       
CONECT   10   24   11   11   44                                       
CONECT   11   10   10   12   31                                       
CONECT   12   25   25   11   45                                       
CONECT   13    5   19   19   14                                       
CONECT   14   13   15   15   46                                       
CONECT   15   14   14   16   47                                       
CONECT   16   18   18   15   32                                       
CONECT   17   23   23   22   48                                       
CONECT   18   19   16   16   49                                       
CONECT   19   13   13   18   50                                       
CONECT   20    3   30   51                                            
CONECT   21   30    4   52                                            
CONECT   22   17    6    6                                            
CONECT   23   17   17    4                                            
CONECT   24    9    9   10                                            
CONECT   25    9   12   12                                            
CONECT   26   30   30                                                 
CONECT   27   30   30                                                 
CONECT   28    7    6                                                 
CONECT   29    8    9                                                 
CONECT   30   26   26   20   21                                       
CONECT   30   27   27                                                 
CONECT   31   11                                                      
CONECT   32   16                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
