COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       0.446  -1.842   0.269  1.00  0.00           F  
HETATM    2  C   UNL     1       0.822  -0.544   0.233  1.00  0.00           C  
HETATM    3  C   UNL     1       2.123  -0.188   0.562  1.00  0.00           C  
HETATM    4  S   UNL     1       3.287  -1.426   1.027  1.00  0.00           S  
HETATM    5  C   UNL     1       4.035  -1.898  -0.557  1.00  0.00           C  
HETATM    6  C   UNL     1       5.085  -2.985  -0.321  1.00  0.00           C  
HETATM    7  O   UNL     1       5.674  -3.357  -1.569  1.00  0.00           O  
HETATM    8  C   UNL     1       2.507   1.149   0.524  1.00  0.00           C  
HETATM    9  F   UNL     1       3.772   1.498   0.843  1.00  0.00           F  
HETATM   10  C   UNL     1       1.592   2.122   0.158  1.00  0.00           C  
HETATM   11  F   UNL     1       1.967   3.419   0.120  1.00  0.00           F  
HETATM   12  C   UNL     1      -0.092   0.434  -0.138  1.00  0.00           C  
HETATM   13  C   UNL     1       0.295   1.767  -0.171  1.00  0.00           C  
HETATM   14  S   UNL     1      -0.864   3.008  -0.641  1.00  0.00           S  
HETATM   15  O   UNL     1      -1.853   2.356  -1.427  1.00  0.00           O  
HETATM   16  N   UNL     1      -1.625   3.517   0.739  1.00  0.00           N  
HETATM   17  O   UNL     1      -0.102   4.112  -1.110  1.00  0.00           O  
HETATM   18  N   UNL     1      -1.402   0.076  -0.475  1.00  0.00           N  
HETATM   19  C   UNL     1      -2.109  -0.485   0.684  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.925  -1.690   0.268  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.534  -2.994   0.013  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.470  -3.940  -0.359  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.800  -3.585  -0.478  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.192  -2.284  -0.225  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.256  -1.335   0.148  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.425   0.133   0.476  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.137   0.530   1.228  1.00  0.00           C  
HETATM   28  H   UNL     1       3.262  -2.279  -1.225  1.00  0.00           H  
HETATM   29  H   UNL     1       4.508  -1.027  -1.009  1.00  0.00           H  
HETATM   30  H   UNL     1       5.858  -2.605   0.346  1.00  0.00           H  
HETATM   31  H   UNL     1       4.612  -3.857   0.131  1.00  0.00           H  
HETATM   32  H   UNL     1       6.351  -4.044  -1.495  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.388   3.127   1.595  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.306   4.206   0.691  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.413  -0.567  -1.252  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.398  -0.759   1.464  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.495  -3.272   0.106  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.162  -4.956  -0.557  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.533  -4.323  -0.770  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.232  -2.008  -0.318  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.523   0.716  -0.440  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.296   0.280   1.114  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.265   0.413   2.304  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.842   1.550   0.980  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3   12                                       
CONECT    3    4    2    2    8                                       
CONECT    4    5    3                                                 
CONECT    5    6    4   28   29                                       
CONECT    6    7    5   30   31                                       
CONECT    7    6   32                                                 
CONECT    8    3   10   10    9                                       
CONECT    9    8                                                      
CONECT   10    8    8   13   11                                       
CONECT   11   10                                                      
CONECT   12   18    2   13   13                                       
CONECT   13   12   12   10   14                                       
CONECT   14   13   16   17   17                                       
CONECT   14   15   15                                                 
CONECT   15   14   14                                                 
CONECT   16   14   33   34                                            
CONECT   17   14   14                                                 
CONECT   18   19   12   35                                            
CONECT   19   20   27   18   36                                       
CONECT   20   25   21   21   19                                       
CONECT   21   22   20   20   37                                       
CONECT   22   23   23   21   38                                       
CONECT   23   24   22   22   39                                       
CONECT   24   25   25   23   40                                       
CONECT   25   24   24   26   20                                       
CONECT   26   25   27   41   42                                       
CONECT   27   26   19   43   44                                       
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   21                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
CONECT   41   26                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
