COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.009   1.401  -1.328  1.00  0.00           N  
HETATM    2  S   UNL     1       2.196   1.555   0.107  1.00  0.00           S  
HETATM    3  O   UNL     1       3.059   1.044   1.113  1.00  0.00           O  
HETATM    4  O   UNL     1       1.670   2.875   0.130  1.00  0.00           O  
HETATM    5  C   UNL     1       0.811   0.468   0.041  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.473   0.982   0.032  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.557   0.130  -0.020  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.373  -1.245  -0.080  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.076  -1.755  -0.063  1.00  0.00           C  
HETATM   10  C   UNL     1       1.005  -0.901  -0.009  1.00  0.00           C  
HETATM   11  C   UNL     1       2.404  -1.461   0.003  1.00  0.00           C  
HETATM   12  F   UNL     1       2.354  -2.846  -0.182  1.00  0.00           F  
HETATM   13  F   UNL     1       3.148  -0.879  -1.029  1.00  0.00           F  
HETATM   14  F   UNL     1       3.010  -1.176   1.232  1.00  0.00           F  
HETATM   15  N   UNL     1      -2.442  -2.131  -0.178  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.801  -1.799   0.242  1.00  0.00           C  
HETATM   17  N   UNL     1      -4.181  -0.507  -0.363  1.00  0.00           N  
HETATM   18  S   UNL     1      -3.197   0.789   0.006  1.00  0.00           S  
HETATM   19  O   UNL     1      -3.475   1.145   1.353  1.00  0.00           O  
HETATM   20  O   UNL     1      -3.291   1.698  -1.082  1.00  0.00           O  
HETATM   21  H   UNL     1       3.910   1.041  -1.339  1.00  0.00           H  
HETATM   22  H   UNL     1       2.583   1.666  -2.158  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.628   2.050   0.067  1.00  0.00           H  
HETATM   24  H   UNL     1       0.083  -2.823  -0.097  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.276  -3.014  -0.544  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.488  -2.576  -0.094  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.839  -1.719   1.329  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.956  -0.416  -0.940  1.00  0.00           H  
CONECT    1    2   21   22                                            
CONECT    2    1    3    3    4                                       
CONECT    2    4    5                                                 
CONECT    3    2    2                                                 
CONECT    4    2    2                                                 
CONECT    5    2    6    6   10                                       
CONECT    6    5    5    7   23                                       
CONECT    7    6    8    8   18                                       
CONECT    8    7    7    9   15                                       
CONECT    9    8   10   10   24                                       
CONECT   10    5    9    9   11                                       
CONECT   11   10   12   13   14                                       
CONECT   12   11                                                      
CONECT   13   11                                                      
CONECT   14   11                                                      
CONECT   15    8   16   25                                            
CONECT   16   15   17   26   27                                       
CONECT   17   16   18   28                                            
CONECT   18    7   17   19   19                                       
CONECT   18   20   20                                                 
CONECT   19   18   18                                                 
CONECT   20   18   18                                                 
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    6                                                      
CONECT   24    9                                                      
CONECT   25   15                                                      
CONECT   26   16                                                      
CONECT   27   16                                                      
CONECT   28   17                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
