COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       6.082  -1.956   0.200  1.00  0.00           F  
HETATM    2  C   UNL     1       6.280  -0.572   0.167  1.00  0.00           C  
HETATM    3  F   UNL     1       6.831  -0.150   1.382  1.00  0.00           F  
HETATM    4  F   UNL     1       7.154  -0.251  -0.878  1.00  0.00           F  
HETATM    5  C   UNL     1       4.960   0.119  -0.054  1.00  0.00           C  
HETATM    6  C   UNL     1       3.806  -0.622  -0.180  1.00  0.00           C  
HETATM    7  C   UNL     1       4.903   1.514  -0.124  1.00  0.00           C  
HETATM    8  C   UNL     1       6.100   2.289   0.012  1.00  0.00           C  
HETATM    9  N   UNL     1       7.049   2.903   0.120  1.00  0.00           N  
HETATM   10  C   UNL     1       3.675   2.151  -0.329  1.00  0.00           C  
HETATM   11  C   UNL     1       2.527   1.403  -0.460  1.00  0.00           C  
HETATM   12  C   UNL     1       2.586   0.015  -0.383  1.00  0.00           C  
HETATM   13  N   UNL     1       1.420  -0.740  -0.511  1.00  0.00           N  
HETATM   14  C   UNL     1       0.256  -0.270  -0.018  1.00  0.00           C  
HETATM   15  O   UNL     1       0.206   0.843   0.461  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.982  -1.128  -0.063  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.973  -1.915  -1.256  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.008  -2.051   1.157  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.223  -0.233  -0.052  1.00  0.00           C  
HETATM   20  S   UNL     1      -3.712  -1.265   0.043  1.00  0.00           S  
HETATM   21  O   UNL     1      -3.887  -2.000  -1.161  1.00  0.00           O  
HETATM   22  O   UNL     1      -3.796  -1.904   1.309  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.045  -0.114   0.047  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.612   0.291  -1.147  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.528   0.380   1.245  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.574   1.283   1.250  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.139   1.694   0.054  1.00  0.00           C  
HETATM   28  F   UNL     1      -8.161   2.577   0.058  1.00  0.00           F  
HETATM   29  C   UNL     1      -6.659   1.194  -1.145  1.00  0.00           C  
HETATM   30  H   UNL     1       3.848  -1.700  -0.121  1.00  0.00           H  
HETATM   31  H   UNL     1       3.628   3.228  -0.383  1.00  0.00           H  
HETATM   32  H   UNL     1       1.578   1.894  -0.617  1.00  0.00           H  
HETATM   33  H   UNL     1       1.446  -1.602  -0.953  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.957  -1.395  -2.071  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.015  -1.450   2.066  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.903  -2.671   1.124  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.124  -2.688   1.149  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.185   0.430   0.812  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.251   0.361  -0.966  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.237  -0.098  -2.082  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.087   0.059   2.178  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.951   1.668   2.186  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.101   1.511  -2.078  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    3    5    1    4                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    6    2    7    7                                       
CONECT    6   12   12    5   30                                       
CONECT    7    5    5   10    8                                       
CONECT    8    7    9    9    9                                       
CONECT    9    8    8    8                                            
CONECT   10   11   11    7   31                                       
CONECT   11   12   10   10   32                                       
CONECT   12   13    6    6   11                                       
CONECT   13   14   12   33                                            
CONECT   14   16   15   15   13                                       
CONECT   15   14   14                                                 
CONECT   16   18   17   19   14                                       
CONECT   17   16   34                                                 
CONECT   18   16   35   36   37                                       
CONECT   19   16   20   38   39                                       
CONECT   20   22   22   19   21                                       
CONECT   20   21   23                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23   20   24   24   25                                       
CONECT   24   23   23   29   40                                       
CONECT   25   23   26   26   41                                       
CONECT   26   25   25   27   42                                       
CONECT   27   29   29   26   28                                       
CONECT   28   27                                                      
CONECT   29   24   27   27   43                                       
CONECT   30    6                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   13                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   24                                                      
CONECT   41   25                                                      
CONECT   42   26                                                      
CONECT   43   29                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
