COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       3.721  -2.506   1.880  1.00  0.00           F  
HETATM    2  F   UNL     1       5.095  -3.631   0.443  1.00  0.00           F  
HETATM    3  N   UNL     1      -0.008   2.099  -0.307  1.00  0.00           N  
HETATM    4  C   UNL     1       1.744   4.122   0.336  1.00  0.00           C  
HETATM    5  C   UNL     1       2.979   3.743   0.829  1.00  0.00           C  
HETATM    6  O   UNL     1      -0.777   4.189   0.757  1.00  0.00           O  
HETATM    7  C   UNL     1       4.118   4.418   0.431  1.00  0.00           C  
HETATM    8  C   UNL     1       4.023   5.470  -0.459  1.00  0.00           C  
HETATM    9  C   UNL     1       2.788   5.848  -0.953  1.00  0.00           C  
HETATM   10  C   UNL     1       1.649   5.174  -0.555  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.073   2.303  -1.293  1.00  0.00           C  
HETATM   12  O   UNL     1       0.631   2.564   2.031  1.00  0.00           O  
HETATM   13  C   UNL     1      -2.118   1.229  -1.133  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.248   1.473  -0.375  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.208   0.491  -0.227  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.036  -0.743  -0.840  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.133  -1.388  -0.057  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.110  -0.656  -0.716  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.286  -0.333  -0.066  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.489  -0.738   1.240  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.517  -1.467   1.899  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.340  -1.794   1.254  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.901  -0.985  -1.599  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.947   0.002  -1.748  1.00  0.00           C  
HETATM   25  C   UNL     1       0.757   0.931  -0.336  1.00  0.00           C  
HETATM   26  O   UNL     1      -4.978  -1.711  -0.696  1.00  0.00           O  
HETATM   27  C   UNL     1       0.940   0.190   0.825  1.00  0.00           C  
HETATM   28  C   UNL     1       1.696  -0.965   0.792  1.00  0.00           C  
HETATM   29  C   UNL     1       2.271  -1.385  -0.394  1.00  0.00           C  
HETATM   30  C   UNL     1       3.095  -2.646  -0.425  1.00  0.00           C  
HETATM   31  C   UNL     1       4.241  -2.531   0.581  1.00  0.00           C  
HETATM   32  C   UNL     1       2.212  -3.841  -0.060  1.00  0.00           C  
HETATM   33  C   UNL     1       2.090  -0.649  -1.551  1.00  0.00           C  
HETATM   34  C   UNL     1       1.331   0.504  -1.527  1.00  0.00           C  
HETATM   35  O   UNL     1       3.630  -2.832  -1.737  1.00  0.00           O  
HETATM   36  F   UNL     1       4.956  -1.352   0.342  1.00  0.00           F  
HETATM   37  F   UNL     1       2.978  -5.012  -0.089  1.00  0.00           F  
HETATM   38  F   UNL     1       1.689  -3.658   1.225  1.00  0.00           F  
HETATM   39  F   UNL     1       1.164  -3.946  -0.980  1.00  0.00           F  
HETATM   40  S   UNL     1       0.293   3.258   0.838  1.00  0.00           S  
HETATM   41  H   UNL     1       3.054   2.920   1.525  1.00  0.00           H  
HETATM   42  H   UNL     1       5.083   4.122   0.817  1.00  0.00           H  
HETATM   43  H   UNL     1       4.913   5.998  -0.769  1.00  0.00           H  
HETATM   44  H   UNL     1       2.714   6.671  -1.649  1.00  0.00           H  
HETATM   45  H   UNL     1       0.685   5.467  -0.943  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.530   3.280  -1.138  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.652   2.254  -2.297  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.381   2.433   0.101  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.090   0.682   0.365  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.952  -0.338  -1.736  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.047   0.237  -0.579  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.409  -0.484   1.747  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.678  -1.783   2.920  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.581  -2.364   1.769  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.764  -1.945  -2.077  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.064  -0.185  -2.343  1.00  0.00           H  
HETATM   57  H   UNL     1       0.491   0.516   1.751  1.00  0.00           H  
HETATM   58  H   UNL     1       1.839  -1.542   1.694  1.00  0.00           H  
HETATM   59  H   UNL     1       2.541  -0.979  -2.475  1.00  0.00           H  
HETATM   60  H   UNL     1       1.190   1.078  -2.431  1.00  0.00           H  
HETATM   61  H   UNL     1       2.958  -2.913  -2.428  1.00  0.00           H  
CONECT    1   31                                                      
CONECT    2   31                                                      
CONECT    3   11   40   25                                            
CONECT    4    5    5   10   40                                       
CONECT    5    7    4    4   41                                       
CONECT    6   40   40                                                 
CONECT    7    8    8    5   42                                       
CONECT    8    7    7    9   43                                       
CONECT    9    8   10   10   44                                       
CONECT   10    9    9    4   45                                       
CONECT   11    3   13   46   47                                       
CONECT   12   40   40                                                 
CONECT   13   11   24   24   14                                       
CONECT   14   13   15   15   48                                       
CONECT   15   14   14   16   49                                       
CONECT   16   23   23   15   26                                       
CONECT   17   26   22   22   18                                       
CONECT   18   17   19   19   50                                       
CONECT   19   18   18   20   51                                       
CONECT   20   21   21   19   52                                       
CONECT   21   22   20   20   53                                       
CONECT   22   17   17   21   54                                       
CONECT   23   24   16   16   55                                       
CONECT   24   13   13   23   56                                       
CONECT   25   34    3   27   27                                       
CONECT   26   16   17                                                 
CONECT   27   25   25   28   57                                       
CONECT   28   29   29   27   58                                       
CONECT   29   33   30   28   28                                       
CONECT   30   31   29   32   35                                       
CONECT   31    1   36    2   30                                       
CONECT   32   38   30   39   37                                       
CONECT   33   34   34   29   59                                       
CONECT   34   33   33   25   60                                       
CONECT   35   30   61                                                 
CONECT   36   31                                                      
CONECT   37   32                                                      
CONECT   38   32                                                      
CONECT   39   32                                                      
CONECT   40    4    6    6    3                                       
CONECT   40   12   12                                                 
CONECT   41    5                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   33                                                      
CONECT   60   34                                                      
CONECT   61   35                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
