COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.840  -0.745  -0.218  1.00  0.00           C  
HETATM    2  C   UNL     1       3.045   0.869   0.507  1.00  0.00           C  
HETATM    3  C   UNL     1       4.281   0.637   0.011  1.00  0.00           C  
HETATM    4  C   UNL     1       4.894   1.925  -0.228  1.00  0.00           C  
HETATM    5  C   UNL     1       3.932   2.893   0.162  1.00  0.00           C  
HETATM    6  C   UNL     1       6.144   2.305  -0.726  1.00  0.00           C  
HETATM    7  C   UNL     1       6.393   3.652  -0.817  1.00  0.00           C  
HETATM    8  C   UNL     1       5.459   4.601  -0.437  1.00  0.00           C  
HETATM    9  C   UNL     1       4.213   4.253   0.058  1.00  0.00           C  
HETATM   10  C   UNL     1       4.213  -1.576   2.058  1.00  0.00           C  
HETATM   11  C   UNL     1       3.968  -1.742   0.557  1.00  0.00           C  
HETATM   12  N   UNL     1       2.829   2.217   0.600  1.00  0.00           N  
HETATM   13  C   UNL     1       2.088  -0.237   0.884  1.00  0.00           C  
HETATM   14  N   UNL     1       2.551  -1.487   0.260  1.00  0.00           N  
HETATM   15  C   UNL     1       1.715  -2.622   0.672  1.00  0.00           C  
HETATM   16  C   UNL     1       1.848  -3.752  -0.352  1.00  0.00           C  
HETATM   17  C   UNL     1       0.871  -4.875  -0.002  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.465  -4.368  -0.024  1.00  0.00           O  
HETATM   19  F   UNL     1       1.557  -3.261  -1.629  1.00  0.00           F  
HETATM   20  F   UNL     1       3.156  -4.248  -0.331  1.00  0.00           F  
HETATM   21  C   UNL     1       0.705   0.098   0.389  1.00  0.00           C  
HETATM   22  C   UNL     1       0.404  -0.025  -0.957  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.865   0.283  -1.414  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.837   0.716  -0.521  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.533   0.838   0.828  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.264   0.524   1.281  1.00  0.00           C  
HETATM   27  F   UNL     1       0.031   0.637   2.595  1.00  0.00           F  
HETATM   28  N   UNL     1      -3.119   1.028  -0.980  1.00  0.00           N  
HETATM   29  C   UNL     1      -4.144   1.484  -0.038  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.270   2.302  -0.695  1.00  0.00           C  
HETATM   31  N   UNL     1      -6.195   1.537   0.170  1.00  0.00           N  
HETATM   32  C   UNL     1      -5.220   0.426   0.267  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.393   1.125  -0.574  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.430   0.562   0.400  1.00  0.00           C  
HETATM   35  C   UNL     1      -9.677   0.133  -0.376  1.00  0.00           C  
HETATM   36  F   UNL     1     -10.626  -0.382   0.515  1.00  0.00           F  
HETATM   37  F   UNL     1       1.350  -0.445  -1.825  1.00  0.00           F  
HETATM   38  H   UNL     1       4.813  -0.981  -1.282  1.00  0.00           H  
HETATM   39  H   UNL     1       5.866  -0.793   0.145  1.00  0.00           H  
HETATM   40  H   UNL     1       6.880   1.572  -1.025  1.00  0.00           H  
HETATM   41  H   UNL     1       7.349   3.983  -1.197  1.00  0.00           H  
HETATM   42  H   UNL     1       5.710   5.647  -0.531  1.00  0.00           H  
HETATM   43  H   UNL     1       3.493   5.003   0.351  1.00  0.00           H  
HETATM   44  H   UNL     1       3.956  -0.560   2.357  1.00  0.00           H  
HETATM   45  H   UNL     1       3.594  -2.284   2.608  1.00  0.00           H  
HETATM   46  H   UNL     1       5.264  -1.764   2.277  1.00  0.00           H  
HETATM   47  H   UNL     1       4.225  -2.759   0.257  1.00  0.00           H  
HETATM   48  H   UNL     1       2.015   2.631   0.928  1.00  0.00           H  
HETATM   49  H   UNL     1       2.071  -0.353   1.968  1.00  0.00           H  
HETATM   50  H   UNL     1       2.040  -2.978   1.649  1.00  0.00           H  
HETATM   51  H   UNL     1       0.673  -2.305   0.728  1.00  0.00           H  
HETATM   52  H   UNL     1       0.966  -5.680  -0.731  1.00  0.00           H  
HETATM   53  H   UNL     1       1.098  -5.258   0.993  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.140  -5.028   0.189  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.100   0.188  -2.464  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.288   1.175   1.524  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.331   0.942  -1.923  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.724   1.952   0.853  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.232   3.366  -0.465  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.395   2.101  -1.759  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.330  -0.325  -0.515  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.144  -0.005   1.265  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.812   1.987  -1.093  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.123   0.359  -1.301  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.011  -0.300   0.919  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.700   1.328   1.126  1.00  0.00           H  
HETATM   67  H   UNL     1     -10.097   0.994  -0.895  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.408  -0.633  -1.103  1.00  0.00           H  
CONECT    1    3   11   38   39                                       
CONECT    2    3    3   12   13                                       
CONECT    3    4    1    2    2                                       
CONECT    4    6    6    5    3                                       
CONECT    5    9    9    4   12                                       
CONECT    6    7    4    4   40                                       
CONECT    7    8    8    6   41                                       
CONECT    8    7    7    9   42                                       
CONECT    9    8    5    5   43                                       
CONECT   10   11   44   45   46                                       
CONECT   11    1   14   10   47                                       
CONECT   12    5    2   48                                            
CONECT   13    2   21   14   49                                       
CONECT   14   11   13   15                                            
CONECT   15   14   16   50   51                                       
CONECT   16   19   20   15   17                                       
CONECT   17   16   18   52   53                                       
CONECT   18   17   54                                                 
CONECT   19   16                                                      
CONECT   20   16                                                      
CONECT   21   22   13   26   26                                       
CONECT   22   37   23   23   21                                       
CONECT   23   22   22   24   55                                       
CONECT   24   23   28   25   25                                       
CONECT   25   24   24   26   56                                       
CONECT   26   21   21   25   27                                       
CONECT   27   26                                                      
CONECT   28   29   24   57                                            
CONECT   29   30   32   28   58                                       
CONECT   30   31   29   59   60                                       
CONECT   31   33   30   32                                            
CONECT   32   31   29   61   62                                       
CONECT   33   34   31   63   64                                       
CONECT   34   35   33   65   66                                       
CONECT   35   36   34   67   68                                       
CONECT   36   35                                                      
CONECT   37   22                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   32                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
CONECT   68   35                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
