COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       4.537   2.336   1.475  1.00  0.00           F  
HETATM    2  C   UNL     1       3.668   3.361   1.084  1.00  0.00           C  
HETATM    3  F   UNL     1       2.674   3.525   2.056  1.00  0.00           F  
HETATM    4  F   UNL     1       4.386   4.554   0.946  1.00  0.00           F  
HETATM    5  C   UNL     1       3.019   2.998  -0.253  1.00  0.00           C  
HETATM    6  O   UNL     1       2.230   4.097  -0.713  1.00  0.00           O  
HETATM    7  C   UNL     1       4.109   2.688  -1.281  1.00  0.00           C  
HETATM    8  F   UNL     1       3.516   2.356  -2.503  1.00  0.00           F  
HETATM    9  F   UNL     1       4.926   3.811  -1.448  1.00  0.00           F  
HETATM   10  F   UNL     1       4.882   1.612  -0.830  1.00  0.00           F  
HETATM   11  C   UNL     1       2.139   1.788  -0.072  1.00  0.00           C  
HETATM   12  C   UNL     1       0.793   1.861  -0.372  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.023   0.748  -0.207  1.00  0.00           C  
HETATM   14  S   UNL     1      -1.734   0.878  -0.618  1.00  0.00           S  
HETATM   15  C   UNL     1      -2.448  -0.582   0.193  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.867  -0.821  -0.325  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.751   0.329   0.085  1.00  0.00           C  
HETATM   18  N   UNL     1      -6.053   0.336  -0.264  1.00  0.00           N  
HETATM   19  C   UNL     1      -6.912   1.454   0.134  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.332   1.216  -0.384  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.291   0.985  -1.896  1.00  0.00           C  
HETATM   22  O   UNL     1      -8.887   0.066   0.259  1.00  0.00           O  
HETATM   23  C   UNL     1      -9.199   2.439  -0.077  1.00  0.00           C  
HETATM   24  O   UNL     1      -4.291   1.249   0.727  1.00  0.00           O  
HETATM   25  C   UNL     1      -1.561  -1.789  -0.147  1.00  0.00           C  
HETATM   26  N   UNL     1      -0.251  -1.593   0.468  1.00  0.00           N  
HETATM   27  C   UNL     1       0.515  -0.444   0.267  1.00  0.00           C  
HETATM   28  C   UNL     1       1.875  -0.506   0.562  1.00  0.00           C  
HETATM   29  C   UNL     1       2.680   0.602   0.387  1.00  0.00           C  
HETATM   30  S   UNL     1       0.351  -2.786   1.447  1.00  0.00           S  
HETATM   31  O   UNL     1       1.222  -2.146   2.370  1.00  0.00           O  
HETATM   32  O   UNL     1      -0.760  -3.576   1.847  1.00  0.00           O  
HETATM   33  C   UNL     1       1.363  -3.822   0.444  1.00  0.00           C  
HETATM   34  C   UNL     1       2.732  -3.630   0.413  1.00  0.00           C  
HETATM   35  C   UNL     1       3.526  -4.443  -0.374  1.00  0.00           C  
HETATM   36  C   UNL     1       2.951  -5.449  -1.130  1.00  0.00           C  
HETATM   37  F   UNL     1       3.727  -6.244  -1.900  1.00  0.00           F  
HETATM   38  C   UNL     1       1.580  -5.641  -1.098  1.00  0.00           C  
HETATM   39  C   UNL     1       0.788  -4.831  -0.307  1.00  0.00           C  
HETATM   40  H   UNL     1       1.518   4.349  -0.110  1.00  0.00           H  
HETATM   41  H   UNL     1       0.372   2.787  -0.735  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.468  -0.432   1.273  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.850  -0.896  -1.412  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.258  -1.747   0.098  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.421  -0.400  -0.777  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.930   1.530   1.222  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.522   2.380  -0.288  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.674   0.114  -2.114  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.303   0.816  -2.265  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.868   1.863  -2.385  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.943   0.142   1.221  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.776   3.316  -0.567  1.00  0.00           H  
HETATM   53  H   UNL     1     -10.210   2.269  -0.446  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.228   2.603   1.000  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.016  -2.699   0.243  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.448  -1.867  -1.228  1.00  0.00           H  
HETATM   57  H   UNL     1       2.303  -1.428   0.926  1.00  0.00           H  
HETATM   58  H   UNL     1       3.734   0.542   0.614  1.00  0.00           H  
HETATM   59  H   UNL     1       3.180  -2.845   1.004  1.00  0.00           H  
HETATM   60  H   UNL     1       4.595  -4.292  -0.398  1.00  0.00           H  
HETATM   61  H   UNL     1       1.130  -6.426  -1.689  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.281  -4.980  -0.281  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    5    3    1    4                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    6    7   11    2                                       
CONECT    6    5   40                                                 
CONECT    7    9   10    5    8                                       
CONECT    8    7                                                      
CONECT    9    7                                                      
CONECT   10    7                                                      
CONECT   11   12    5   29   29                                       
CONECT   12   13   13   11   41                                       
CONECT   13   14   12   12   27                                       
CONECT   14   15   13                                                 
CONECT   15   14   16   25   42                                       
CONECT   16   17   15   43   44                                       
CONECT   17   24   24   18   16                                       
CONECT   18   19   17   45                                            
CONECT   19   20   18   46   47                                       
CONECT   20   22   21   19   23                                       
CONECT   21   20   48   49   50                                       
CONECT   22   20   51                                                 
CONECT   23   20   52   53   54                                       
CONECT   24   17   17                                                 
CONECT   25   15   26   55   56                                       
CONECT   26   30   25   27                                            
CONECT   27   13   26   28   28                                       
CONECT   28   27   27   29   57                                       
CONECT   29   11   11   28   58                                       
CONECT   30   33   31   31   26                                       
CONECT   30   32   32                                                 
CONECT   31   30   30                                                 
CONECT   32   30   30                                                 
CONECT   33   34   34   39   30                                       
CONECT   34   35   33   33   59                                       
CONECT   35   36   36   34   60                                       
CONECT   36   37   35   35   38                                       
CONECT   37   36                                                      
CONECT   38   36   39   39   61                                       
CONECT   39   38   38   33   62                                       
CONECT   40    6                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   34                                                      
CONECT   60   35                                                      
CONECT   61   38                                                      
CONECT   62   39                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
