COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -5.865   0.885  -2.486  1.00  0.00           F  
HETATM    2  C   UNL     1      -6.046   0.498  -1.153  1.00  0.00           C  
HETATM    3  F   UNL     1      -6.331   1.625  -0.375  1.00  0.00           F  
HETATM    4  F   UNL     1      -7.109  -0.407  -1.071  1.00  0.00           F  
HETATM    5  C   UNL     1      -4.787  -0.158  -0.646  1.00  0.00           C  
HETATM    6  N   UNL     1      -3.657  -0.263  -1.300  1.00  0.00           N  
HETATM    7  N   UNL     1      -2.737  -0.937  -0.483  1.00  0.00           N  
HETATM    8  C   UNL     1      -3.352  -1.229   0.675  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.622  -0.754   0.602  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.639  -0.887   1.708  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.153  -1.964   2.685  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.699  -1.682   3.075  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.784  -1.945   1.875  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.352  -1.265  -0.831  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.447  -0.136  -0.408  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.913   0.845   0.130  1.00  0.00           O  
HETATM   17  N   UNL     1       0.880  -0.218  -0.629  1.00  0.00           N  
HETATM   18  C   UNL     1       1.712   0.821  -0.240  1.00  0.00           C  
HETATM   19  S   UNL     1       1.186   2.249   0.523  1.00  0.00           S  
HETATM   20  C   UNL     1       2.815   2.899   0.615  1.00  0.00           C  
HETATM   21  C   UNL     1       3.697   2.047   0.081  1.00  0.00           C  
HETATM   22  C   UNL     1       3.068   0.836  -0.412  1.00  0.00           C  
HETATM   23  C   UNL     1       5.191   2.321   0.010  1.00  0.00           C  
HETATM   24  C   UNL     1       5.429   3.817   0.226  1.00  0.00           C  
HETATM   25  C   UNL     1       4.686   4.268   1.488  1.00  0.00           C  
HETATM   26  C   UNL     1       3.180   4.243   1.216  1.00  0.00           C  
HETATM   27  C   UNL     1       3.813  -0.262  -1.037  1.00  0.00           C  
HETATM   28  O   UNL     1       3.998  -0.265  -2.240  1.00  0.00           O  
HETATM   29  N   UNL     1       4.293  -1.268  -0.278  1.00  0.00           N  
HETATM   30  C   UNL     1       5.037  -2.365  -0.902  1.00  0.00           C  
HETATM   31  C   UNL     1       5.466  -3.366   0.172  1.00  0.00           C  
HETATM   32  C   UNL     1       6.243  -4.511  -0.479  1.00  0.00           C  
HETATM   33  N   UNL     1       6.655  -5.472   0.552  1.00  0.00           N  
HETATM   34  H   UNL     1      -5.740   0.065   2.230  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.602  -1.179   1.288  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.777  -1.952   3.579  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.218  -2.942   2.210  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.601  -0.640   3.381  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.412  -2.332   3.901  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.741  -3.016   1.677  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.783  -1.569   2.086  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.055  -2.180  -0.317  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.272  -1.411  -1.908  1.00  0.00           H  
HETATM   44  H   UNL     1       1.253  -1.003  -1.059  1.00  0.00           H  
HETATM   45  H   UNL     1       5.704   1.754   0.787  1.00  0.00           H  
HETATM   46  H   UNL     1       5.570   2.029  -0.969  1.00  0.00           H  
HETATM   47  H   UNL     1       6.496   4.003   0.346  1.00  0.00           H  
HETATM   48  H   UNL     1       5.056   4.373  -0.634  1.00  0.00           H  
HETATM   49  H   UNL     1       4.919   3.590   2.310  1.00  0.00           H  
HETATM   50  H   UNL     1       4.994   5.280   1.751  1.00  0.00           H  
HETATM   51  H   UNL     1       2.921   5.039   0.516  1.00  0.00           H  
HETATM   52  H   UNL     1       2.637   4.385   2.150  1.00  0.00           H  
HETATM   53  H   UNL     1       4.145  -1.265   0.680  1.00  0.00           H  
HETATM   54  H   UNL     1       4.402  -2.865  -1.633  1.00  0.00           H  
HETATM   55  H   UNL     1       5.920  -1.967  -1.402  1.00  0.00           H  
HETATM   56  H   UNL     1       6.101  -2.865   0.902  1.00  0.00           H  
HETATM   57  H   UNL     1       4.583  -3.764   0.671  1.00  0.00           H  
HETATM   58  H   UNL     1       5.608  -5.012  -1.210  1.00  0.00           H  
HETATM   59  H   UNL     1       7.127  -4.113  -0.979  1.00  0.00           H  
HETATM   60  H   UNL     1       5.859  -5.808   1.073  1.00  0.00           H  
HETATM   61  H   UNL     1       7.171  -6.239   0.147  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    5    3    4                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    2    9    6    6                                       
CONECT    6    5    5    7                                            
CONECT    7    6   14    8                                            
CONECT    8    7   13    9    9                                       
CONECT    9    5    8    8   10                                       
CONECT   10    9   11   34   35                                       
CONECT   11   10   12   36   37                                       
CONECT   12   11   13   38   39                                       
CONECT   13    8   12   40   41                                       
CONECT   14    7   15   42   43                                       
CONECT   15   14   17   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   44                                            
CONECT   18   17   22   22   19                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   21   26                                       
CONECT   21   20   20   22   23                                       
CONECT   22   18   18   21   27                                       
CONECT   23   21   24   45   46                                       
CONECT   24   23   25   47   48                                       
CONECT   25   24   26   49   50                                       
CONECT   26   20   25   51   52                                       
CONECT   27   22   28   28   29                                       
CONECT   28   27   27                                                 
CONECT   29   27   30   53                                            
CONECT   30   29   31   54   55                                       
CONECT   31   30   32   56   57                                       
CONECT   32   31   33   58   59                                       
CONECT   33   32   60   61                                            
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   17                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
