COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.122  -1.760   0.036  1.00  0.00           C  
HETATM    2  C   UNL     1       4.967  -1.241   0.117  1.00  0.00           C  
HETATM    3  C   UNL     1       0.764  -2.000  -0.002  1.00  0.00           C  
HETATM    4  C   UNL     1       6.317  -0.941   0.151  1.00  0.00           C  
HETATM    5  C   UNL     1       1.695   0.604  -0.138  1.00  0.00           C  
HETATM    6  C   UNL     1       4.538   1.118  -0.058  1.00  0.00           C  
HETATM    7  C   UNL     1       2.596  -0.452  -0.032  1.00  0.00           C  
HETATM    8  C   UNL     1       4.056  -0.186   0.010  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.131  -0.947  -0.108  1.00  0.00           C  
HETATM   10  C   UNL     1       0.336   0.354  -0.176  1.00  0.00           C  
HETATM   11  C   UNL     1       6.719   0.384   0.079  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.643  -0.951  -0.168  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.832   1.311  -0.286  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.065   0.497   0.161  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.360  -1.233   1.011  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.979  -1.725  -1.012  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.006  -1.003   0.337  1.00  0.00           C  
HETATM   18  N   UNL     1       5.834   1.358  -0.022  1.00  0.00           N  
HETATM   19  N   UNL     1      -3.250   0.882  -0.609  1.00  0.00           N  
HETATM   20  O   UNL     1      -5.633   1.261  -0.928  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.621   1.446   1.322  1.00  0.00           O  
HETATM   22  F   UNL     1       8.036   0.682   0.112  1.00  0.00           F  
HETATM   23  S   UNL     1      -4.754   0.774   0.077  1.00  0.00           S  
HETATM   24  H   UNL     1       2.815  -2.584   0.123  1.00  0.00           H  
HETATM   25  H   UNL     1       0.396  -3.014   0.050  1.00  0.00           H  
HETATM   26  H   UNL     1       4.626  -2.264   0.167  1.00  0.00           H  
HETATM   27  H   UNL     1       7.049  -1.731   0.233  1.00  0.00           H  
HETATM   28  H   UNL     1       2.059   1.619  -0.190  1.00  0.00           H  
HETATM   29  H   UNL     1       3.844   1.942  -0.141  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.981  -1.225  -1.167  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.050  -1.640   0.572  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.684   2.166   0.374  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.952   1.644  -1.317  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.240   0.616   1.230  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.154   1.201  -1.520  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.512  -2.301   1.167  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.379  -0.719   1.972  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.154  -0.843   0.374  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.212  -1.394   0.974  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.988  -1.629  -1.456  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.211  -2.780  -0.865  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.719  -1.280  -1.677  1.00  0.00           H  
CONECT    1    3    7    7   24                                       
CONECT    2    4    4    8   26                                       
CONECT    3    1    9    9   25                                       
CONECT    4    2    2   11   27                                       
CONECT    5    7   10   10   28                                       
CONECT    6    8    8   18   29                                       
CONECT    7    1    1    5    8                                       
CONECT    8    2    6    6    7                                       
CONECT    9    3    3   10   12                                       
CONECT   10    5    5    9   13                                       
CONECT   11    4   18   18   22                                       
CONECT   12    9   14   30   31                                       
CONECT   13   10   14   32   33                                       
CONECT   14   12   13   19   34                                       
CONECT   15   17   36   37   38                                       
CONECT   16   17   40   41   42                                       
CONECT   17   15   16   23   39                                       
CONECT   18    6   11   11                                            
CONECT   19   14   23   35                                            
CONECT   20   23   23                                                 
CONECT   21   23   23                                                 
CONECT   22   11                                                      
CONECT   23   17   19   20   20                                       
CONECT   23   21   21                                                 
CONECT   24    1                                                      
CONECT   25    3                                                      
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30   12                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   19                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
