COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.879   0.501  -0.046  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.249   0.353  -0.167  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.345   1.180  -0.841  1.00  0.00           C  
HETATM    4  C   UNL     1       1.408   0.216   0.019  1.00  0.00           C  
HETATM    5  C   UNL     1       0.848   2.519   0.273  1.00  0.00           C  
HETATM    6  C   UNL     1       1.063  -1.075  -0.149  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.990  -0.959   1.054  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.604   0.325  -0.999  1.00  0.00           C  
HETATM    9  C   UNL     1       2.709   1.001   0.171  1.00  0.00           C  
HETATM   10  C   UNL     1       2.334   2.464  -0.130  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.086  -0.132   0.379  1.00  0.00           C  
HETATM   12  O   UNL     1       3.208   0.881   1.504  1.00  0.00           O  
HETATM   13  C   UNL     1       2.420  -2.967   1.453  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.072   1.151  -0.019  1.00  0.00           O  
HETATM   15  C   UNL     1       0.330   1.096   0.078  1.00  0.00           C  
HETATM   16  S   UNL     1      -0.682  -1.231  -0.239  1.00  0.00           S  
HETATM   17  C   UNL     1      -3.730  -0.105   1.212  1.00  0.00           C  
HETATM   18  S   UNL     1       2.201  -2.415  -0.261  1.00  0.00           S  
HETATM   19  F   UNL     1       3.093   3.342   0.651  1.00  0.00           F  
HETATM   20  F   UNL     1       2.490   2.747  -1.492  1.00  0.00           F  
HETATM   21  O   UNL     1       1.509  -3.400  -1.017  1.00  0.00           O  
HETATM   22  O   UNL     1       3.395  -1.821  -0.751  1.00  0.00           O  
HETATM   23  H   UNL     1      -3.022  -0.519  -0.780  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.572   2.052  -0.228  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.002   1.506  -1.823  1.00  0.00           H  
HETATM   26  H   UNL     1       0.750   2.818   1.316  1.00  0.00           H  
HETATM   27  H   UNL     1       0.307   3.212  -0.371  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.333  -1.285   2.036  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.763  -1.831   0.440  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.385   0.915  -1.480  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.377  -0.547  -1.613  1.00  0.00           H  
HETATM   32  H   UNL     1       3.451   0.646  -0.545  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.983  -0.741   0.267  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.313   0.740   0.993  1.00  0.00           H  
HETATM   35  H   UNL     1       4.034   1.360   1.660  1.00  0.00           H  
HETATM   36  H   UNL     1       1.459  -3.282   1.859  1.00  0.00           H  
HETATM   37  H   UNL     1       3.118  -3.805   1.478  1.00  0.00           H  
HETATM   38  H   UNL     1       2.816  -2.146   2.051  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.949  -0.694   1.692  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.957   0.767   1.825  1.00  0.00           H  
CONECT    1   16   14   15   15                                       
CONECT    2    3   17   14   23                                       
CONECT    3    8    2   24   25                                       
CONECT    4    6    6   15    9                                       
CONECT    5   15   10   26   27                                       
CONECT    6   18   16    4    4                                       
CONECT    7   11   17   28   29                                       
CONECT    8    3   11   30   31                                       
CONECT    9    4   12   10   32                                       
CONECT   10    9    5   20   19                                       
CONECT   11    8    7   33   34                                       
CONECT   12    9   35                                                 
CONECT   13   18   36   37   38                                       
CONECT   14    2    1                                                 
CONECT   15    1    1    4    5                                       
CONECT   16    6    1                                                 
CONECT   17    2    7   39   40                                       
CONECT   18   22   22   21   21                                       
CONECT   18   13    6                                                 
CONECT   19   10                                                      
CONECT   20   10                                                      
CONECT   21   18   18                                                 
CONECT   22   18   18                                                 
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
