COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.864  -1.835   0.764  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.058   0.533   0.464  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.186  -0.630  -3.225  1.00  0.00           C  
HETATM    4  C   UNL     1       0.217  -0.789  -2.698  1.00  0.00           C  
HETATM    5  C   UNL     1       0.791  -0.091  -1.673  1.00  0.00           C  
HETATM    6  C   UNL     1       3.071  -0.138  -0.591  1.00  0.00           C  
HETATM    7  C   UNL     1       4.192   0.606  -1.322  1.00  0.00           C  
HETATM    8  C   UNL     1       5.271   1.010  -0.315  1.00  0.00           C  
HETATM    9  C   UNL     1       6.936   0.146   1.215  1.00  0.00           C  
HETATM   10  C   UNL     1       8.104   0.648   0.364  1.00  0.00           C  
HETATM   11  C   UNL     1       9.772  -0.218   1.890  1.00  0.00           C  
HETATM   12  C   UNL     1      10.287   1.688   0.488  1.00  0.00           C  
HETATM   13  C   UNL     1       4.753  -0.895   1.092  1.00  0.00           C  
HETATM   14  C   UNL     1       3.658  -1.356   0.126  1.00  0.00           C  
HETATM   15  C   UNL     1       0.165   0.970  -0.854  1.00  0.00           C  
HETATM   16  C   UNL     1       0.960   1.966  -0.290  1.00  0.00           C  
HETATM   17  C   UNL     1       0.362   2.955   0.474  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.012   2.918   0.651  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.747   1.896   0.061  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.675   0.639   0.405  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.889  -0.498   0.527  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.485  -1.732   0.706  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.649  -0.704   0.643  1.00  0.00           C  
HETATM   24  N   UNL     1       2.063  -0.578  -1.559  1.00  0.00           N  
HETATM   25  N   UNL     1       5.803  -0.191   0.343  1.00  0.00           N  
HETATM   26  N   UNL     1       9.237   0.984   1.236  1.00  0.00           N  
HETATM   27  N   UNL     1       2.221  -1.492  -2.452  1.00  0.00           N  
HETATM   28  N   UNL     1       1.144  -1.643  -3.138  1.00  0.00           N  
HETATM   29  N   UNL     1      -1.151   0.969  -0.668  1.00  0.00           N  
HETATM   30  O   UNL     1      -3.092   1.854   0.230  1.00  0.00           O  
HETATM   31 BR   UNL     1      -2.414  -3.283   0.872  1.00  0.00          Br  
HETATM   32 BR   UNL     1      -6.133   2.080   0.299  1.00  0.00          Br  
HETATM   33  H   UNL     1      -5.327  -2.801   0.899  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.212   0.184  -3.950  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.501  -1.556  -3.706  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.860  -0.402  -2.399  1.00  0.00           H  
HETATM   37  H   UNL     1       2.609   0.527   0.139  1.00  0.00           H  
HETATM   38  H   UNL     1       4.628  -0.046  -2.080  1.00  0.00           H  
HETATM   39  H   UNL     1       3.787   1.498  -1.799  1.00  0.00           H  
HETATM   40  H   UNL     1       6.078   1.527  -0.834  1.00  0.00           H  
HETATM   41  H   UNL     1       4.838   1.673   0.435  1.00  0.00           H  
HETATM   42  H   UNL     1       7.245  -0.742   1.768  1.00  0.00           H  
HETATM   43  H   UNL     1       6.636   0.924   1.916  1.00  0.00           H  
HETATM   44  H   UNL     1       8.403  -0.131  -0.337  1.00  0.00           H  
HETATM   45  H   UNL     1       7.795   1.535  -0.189  1.00  0.00           H  
HETATM   46  H   UNL     1      10.564   0.068   2.583  1.00  0.00           H  
HETATM   47  H   UNL     1       8.974  -0.720   2.437  1.00  0.00           H  
HETATM   48  H   UNL     1      10.176  -0.893   1.135  1.00  0.00           H  
HETATM   49  H   UNL     1      10.645   1.052  -0.321  1.00  0.00           H  
HETATM   50  H   UNL     1       9.880   2.610   0.072  1.00  0.00           H  
HETATM   51  H   UNL     1      11.113   1.925   1.158  1.00  0.00           H  
HETATM   52  H   UNL     1       4.322  -0.222   1.834  1.00  0.00           H  
HETATM   53  H   UNL     1       5.183  -1.762   1.594  1.00  0.00           H  
HETATM   54  H   UNL     1       2.872  -1.865   0.683  1.00  0.00           H  
HETATM   55  H   UNL     1       4.085  -2.039  -0.608  1.00  0.00           H  
HETATM   56  H   UNL     1       2.028   1.967  -0.447  1.00  0.00           H  
HETATM   57  H   UNL     1       0.954   3.739   0.923  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.506   3.674   1.242  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.813  -0.418   0.483  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.725  -0.786   0.688  1.00  0.00           H  
CONECT    1   23   23   22   33                                       
CONECT    2   23   32   20   20                                       
CONECT    3    4   34   35   36                                       
CONECT    4    5    5   28    3                                       
CONECT    5   24   15    4    4                                       
CONECT    6   14    7   24   37                                       
CONECT    7    8    6   38   39                                       
CONECT    8   25    7   40   41                                       
CONECT    9   10   25   42   43                                       
CONECT   10   26    9   44   45                                       
CONECT   11   26   46   47   48                                       
CONECT   12   26   49   50   51                                       
CONECT   13   25   14   52   53                                       
CONECT   14   13    6   54   55                                       
CONECT   15   29    5   16   16                                       
CONECT   16   15   15   17   56                                       
CONECT   17   18   18   16   57                                       
CONECT   18   19   17   17   58                                       
CONECT   19   30   29   29   18                                       
CONECT   20    2    2   21   30                                       
CONECT   21   22   22   20   59                                       
CONECT   22    1   31   21   21                                       
CONECT   23    1    1    2   60                                       
CONECT   24    6   27    5                                            
CONECT   25    9   13    8                                            
CONECT   26   12   11   10                                            
CONECT   27   24   28   28                                            
CONECT   28   27   27    4                                            
CONECT   29   19   19   15                                            
CONECT   30   20   19                                                 
CONECT   31   22                                                      
CONECT   32    2                                                      
CONECT   33    1                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   14                                                      
CONECT   56   16                                                      
CONECT   57   17                                                      
CONECT   58   18                                                      
CONECT   59   21                                                      
CONECT   60   23                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
