COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -8.198  -0.948  -0.536  1.00  0.00           F  
HETATM    2  C   UNL     1      -6.922  -0.598  -0.263  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.909  -1.540  -0.357  1.00  0.00           C  
HETATM    4  F   UNL     1      -6.197  -2.809  -0.723  1.00  0.00           F  
HETATM    5  C   UNL     1      -4.602  -1.181  -0.077  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.307   0.116   0.297  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.317   1.058   0.392  1.00  0.00           C  
HETATM    8  F   UNL     1      -5.027   2.325   0.758  1.00  0.00           F  
HETATM    9  C   UNL     1      -6.624   0.702   0.106  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.884   0.507   0.602  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.239   1.107  -0.650  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.957   2.331  -1.033  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.776   1.446  -0.350  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.057   0.178   0.123  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.785  -0.387   1.345  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.148  -0.650   1.006  1.00  0.00           O  
HETATM   17  N   UNL     1       1.329   0.506   0.486  1.00  0.00           N  
HETATM   18  C   UNL     1       2.094   0.958  -0.698  1.00  0.00           C  
HETATM   19  C   UNL     1       3.514   0.492  -0.471  1.00  0.00           C  
HETATM   20  N   UNL     1       4.755   0.664  -0.845  1.00  0.00           N  
HETATM   21  N   UNL     1       5.561  -0.214  -0.109  1.00  0.00           N  
HETATM   22  S   UNL     1       7.205  -0.363  -0.233  1.00  0.00           S  
HETATM   23  O   UNL     1       7.497   0.060  -1.558  1.00  0.00           O  
HETATM   24  C   UNL     1       7.859   0.824   0.973  1.00  0.00           C  
HETATM   25  O   UNL     1       7.469  -1.695   0.186  1.00  0.00           O  
HETATM   26  C   UNL     1       4.760  -0.918   0.719  1.00  0.00           C  
HETATM   27  C   UNL     1       3.490  -0.502   0.517  1.00  0.00           C  
HETATM   28  C   UNL     1       2.055  -0.698   0.948  1.00  0.00           C  
HETATM   29  H   UNL     1      -3.813  -1.915  -0.151  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.412   1.437   0.175  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.873   1.243   1.406  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.286   0.386  -1.466  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.925   2.133  -1.236  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.875   3.037  -0.317  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.296   1.822  -1.253  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.730   2.204   0.432  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.059  -0.562  -0.678  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.304  -1.312   1.660  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.747   0.338   2.158  1.00  0.00           H  
HETATM   40  H   UNL     1       1.689   0.504  -1.603  1.00  0.00           H  
HETATM   41  H   UNL     1       2.062   2.045  -0.775  1.00  0.00           H  
HETATM   42  H   UNL     1       7.501   0.565   1.969  1.00  0.00           H  
HETATM   43  H   UNL     1       8.949   0.794   0.959  1.00  0.00           H  
HETATM   44  H   UNL     1       7.521   1.828   0.715  1.00  0.00           H  
HETATM   45  H   UNL     1       5.077  -1.677   1.419  1.00  0.00           H  
HETATM   46  H   UNL     1       1.995  -0.780   2.033  1.00  0.00           H  
HETATM   47  H   UNL     1       1.640  -1.591   0.479  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    3    1    9    9                                       
CONECT    3    4    5    5    2                                       
CONECT    4    3                                                      
CONECT    5    3    3    6   29                                       
CONECT    6    5   10    7    7                                       
CONECT    7    6    6    9    8                                       
CONECT    8    7                                                      
CONECT    9    2    2    7   30                                       
CONECT   10   11    6   16   31                                       
CONECT   11   12   13   10   32                                       
CONECT   12   11   33   34                                            
CONECT   13   11   14   35   36                                       
CONECT   14   13   17   15   37                                       
CONECT   15   14   16   38   39                                       
CONECT   16   10   15                                                 
CONECT   17   18   14   28                                            
CONECT   18   19   17   40   41                                       
CONECT   19   18   20   20   27                                       
CONECT   20   19   19   21                                            
CONECT   21   20   22   26                                            
CONECT   22   25   25   21   23                                       
CONECT   22   23   24                                                 
CONECT   23   22   22                                                 
CONECT   24   22   42   43   44                                       
CONECT   25   22   22                                                 
CONECT   26   21   27   27   45                                       
CONECT   27   19   26   26   28                                       
CONECT   28   17   27   46   47                                       
CONECT   29    5                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
