COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.765  -0.212  -1.026  1.00  0.00           C  
HETATM    2  S   UNL     1       0.074  -2.194  -1.087  1.00  0.00           S  
HETATM    3  B   UNL     1      -3.127   0.176  -0.349  1.00  0.00           B  
HETATM    4  O   UNL     1      -3.694  -0.669   0.641  1.00  0.00           O  
HETATM    5  O   UNL     1      -3.793   1.371  -0.728  1.00  0.00           O  
HETATM    6  N   UNL     1      -1.285  -1.478  -0.467  1.00  0.00           N  
HETATM    7  O   UNL     1       0.329  -3.336  -0.280  1.00  0.00           O  
HETATM    8  O   UNL     1      -0.115  -2.264  -2.493  1.00  0.00           O  
HETATM    9  C   UNL     1       1.416  -1.086  -0.819  1.00  0.00           C  
HETATM   10  C   UNL     1       1.841  -0.817   0.470  1.00  0.00           C  
HETATM   11  C   UNL     1       2.893   0.051   0.686  1.00  0.00           C  
HETATM   12  C   UNL     1       3.527   0.657  -0.398  1.00  0.00           C  
HETATM   13  C   UNL     1       3.093   0.382  -1.695  1.00  0.00           C  
HETATM   14  C   UNL     1       2.045  -0.491  -1.899  1.00  0.00           C  
HETATM   15  C   UNL     1       4.654   1.589  -0.173  1.00  0.00           C  
HETATM   16  N   UNL     1       5.356   2.250  -1.126  1.00  0.00           N  
HETATM   17  N   UNL     1       6.313   3.004  -0.424  1.00  0.00           N  
HETATM   18  N   UNL     1       6.134   2.760   0.829  1.00  0.00           N  
HETATM   19  N   UNL     1       5.162   1.937   0.991  1.00  0.00           N  
HETATM   20  C   UNL     1       1.155  -1.473   1.640  1.00  0.00           C  
HETATM   21  F   UNL     1       1.664  -0.949   2.833  1.00  0.00           F  
HETATM   22  F   UNL     1      -0.221  -1.227   1.572  1.00  0.00           F  
HETATM   23  F   UNL     1       1.384  -2.853   1.602  1.00  0.00           F  
HETATM   24  P   UNL     1      -5.177   1.627   0.056  1.00  0.00           P  
HETATM   25  O   UNL     1      -5.836   3.004  -0.455  1.00  0.00           O  
HETATM   26  O   UNL     1      -6.107   0.506  -0.208  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.888   1.724   1.636  1.00  0.00           O  
HETATM   28  H   UNL     1      -1.910  -0.320  -2.100  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.030   0.571  -0.836  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.533  -0.348   0.999  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.763  -1.897   0.266  1.00  0.00           H  
HETATM   32  H   UNL     1       3.223   0.260   1.693  1.00  0.00           H  
HETATM   33  H   UNL     1       3.580   0.849  -2.539  1.00  0.00           H  
HETATM   34  H   UNL     1       1.712  -0.708  -2.903  1.00  0.00           H  
HETATM   35  H   UNL     1       5.226   2.212  -2.087  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.674   3.221  -0.025  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.284   2.438   1.883  1.00  0.00           H  
CONECT    1    6    3   28   29                                       
CONECT    2    8    8    6    9                                       
CONECT    2    7    7                                                 
CONECT    3    5    4    1                                            
CONECT    4    3   30                                                 
CONECT    5   24    3                                                 
CONECT    6    2    1   31                                            
CONECT    7    2    2                                                 
CONECT    8    2    2                                                 
CONECT    9    2   10   10   14                                       
CONECT   10   20    9    9   11                                       
CONECT   11   10   12   12   32                                       
CONECT   12   11   11   13   15                                       
CONECT   13   14   14   12   33                                       
CONECT   14    9   13   13   34                                       
CONECT   15   12   16   19   19                                       
CONECT   16   15   17   35                                            
CONECT   17   16   18   18                                            
CONECT   18   17   17   19                                            
CONECT   19   15   15   18                                            
CONECT   20   21   23   22   10                                       
CONECT   21   20                                                      
CONECT   22   20                                                      
CONECT   23   20                                                      
CONECT   24   26   26   25   27                                       
CONECT   24    5                                                      
CONECT   25   24   36                                                 
CONECT   26   24   24                                                 
CONECT   27   24   37                                                 
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32   11                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   16                                                      
CONECT   36   25                                                      
CONECT   37   27                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
