COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.408   0.563  -1.087  1.00  0.00           C  
HETATM    2  C   UNL     1       3.529  -2.025  -1.066  1.00  0.00           C  
HETATM    3  C   UNL     1       4.838  -1.555  -0.932  1.00  0.00           C  
HETATM    4  C   UNL     1       5.942  -2.399  -1.279  1.00  0.00           C  
HETATM    5  C   UNL     1       5.067  -0.260  -0.459  1.00  0.00           C  
HETATM    6  C   UNL     1       4.248   1.944   0.384  1.00  0.00           C  
HETATM    7  C   UNL     1       0.188  -1.433   3.217  1.00  0.00           C  
HETATM    8  O   UNL     1       0.732  -0.636   2.162  1.00  0.00           O  
HETATM    9  C   UNL     1      -0.061  -0.421   1.079  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.335  -0.964   1.032  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.136  -0.752  -0.074  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.522  -1.343  -0.123  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.521  -0.350   0.473  1.00  0.00           C  
HETATM   14  S   UNL     1      -4.654   1.139  -0.574  1.00  0.00           S  
HETATM   15  C   UNL     1      -6.375   0.900  -0.925  1.00  0.00           C  
HETATM   16  O   UNL     1      -7.072   1.616  -1.617  1.00  0.00           O  
HETATM   17  N   UNL     1      -6.768  -0.208  -0.292  1.00  0.00           N  
HETATM   18  C   UNL     1      -5.924  -0.917   0.438  1.00  0.00           C  
HETATM   19  O   UNL     1      -6.244  -1.927   1.026  1.00  0.00           O  
HETATM   20  C   UNL     1      -1.676   0.014  -1.129  1.00  0.00           C  
HETATM   21  C   UNL     1       0.405   0.346   0.015  1.00  0.00           C  
HETATM   22  O   UNL     1       1.655   0.880   0.056  1.00  0.00           O  
HETATM   23  C   UNL     1       2.701   0.079  -0.267  1.00  0.00           C  
HETATM   24  C   UNL     1       2.469  -1.208  -0.738  1.00  0.00           C  
HETATM   25  N   UNL     1       6.818  -3.068  -1.554  1.00  0.00           N  
HETATM   26  C   UNL     1       4.003   0.548  -0.127  1.00  0.00           C  
HETATM   27  F   UNL     1       3.707   2.073   1.667  1.00  0.00           F  
HETATM   28  F   UNL     1       5.625   2.188   0.432  1.00  0.00           F  
HETATM   29  F   UNL     1       3.641   2.868  -0.474  1.00  0.00           F  
HETATM   30  H   UNL     1      -0.049   1.157  -1.914  1.00  0.00           H  
HETATM   31  H   UNL     1       3.348  -3.025  -1.431  1.00  0.00           H  
HETATM   32  H   UNL     1       6.077   0.106  -0.354  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.713  -0.956   3.603  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.060  -2.422   2.833  1.00  0.00           H  
HETATM   35  H   UNL     1       0.922  -1.526   4.017  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.699  -1.559   1.856  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.791  -1.552  -1.159  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.542  -2.269   0.451  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.236  -0.082   1.490  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.690  -0.499  -0.370  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.308   0.184  -1.988  1.00  0.00           H  
HETATM   42  H   UNL     1       1.457  -1.569  -0.845  1.00  0.00           H  
CONECT    1   20   20   21   30                                       
CONECT    2    3    3   24   31                                       
CONECT    3    2    2    5    4                                       
CONECT    4    3   25   25   25                                       
CONECT    5    3   26   26   32                                       
CONECT    6   27   29   26   28                                       
CONECT    7    8   33   34   35                                       
CONECT    8    7    9                                                 
CONECT    9    8   21   21   10                                       
CONECT   10    9   11   11   36                                       
CONECT   11   10   10   20   12                                       
CONECT   12   11   13   37   38                                       
CONECT   13   12   18   14   39                                       
CONECT   14   13   15                                                 
CONECT   15   14   17   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   40                                            
CONECT   18   13   17   19   19                                       
CONECT   19   18   18                                                 
CONECT   20    1    1   11   41                                       
CONECT   21    1    9    9   22                                       
CONECT   22   21   23                                                 
CONECT   23   22   26   24   24                                       
CONECT   24    2   23   23   42                                       
CONECT   25    4    4    4                                            
CONECT   26    5    5    6   23                                       
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   17                                                      
CONECT   41   20                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
