COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -4.362   0.441   0.091  1.00  0.00           S  
HETATM    2  N   UNL     1       2.383  -0.293  -0.002  1.00  0.00           N  
HETATM    3  O   UNL     1       1.702  -2.407  -0.047  1.00  0.00           O  
HETATM    4  C   UNL     1      -0.009  -0.817   0.018  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.674   0.913   0.073  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.347   0.537   0.052  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.669  -0.048   0.062  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.018  -1.781   0.006  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.341  -1.392   0.029  1.00  0.00           C  
HETATM   10  C   UNL     1       1.411  -1.227  -0.012  1.00  0.00           C  
HETATM   11  F   UNL     1       4.400   1.337  -1.130  1.00  0.00           F  
HETATM   12  F   UNL     1       6.024   0.156  -0.040  1.00  0.00           F  
HETATM   13  F   UNL     1       4.431   1.277   1.154  1.00  0.00           F  
HETATM   14  C   UNL     1       3.790  -0.700  -0.031  1.00  0.00           C  
HETATM   15  O   UNL     1      -5.089  -0.660   0.618  1.00  0.00           O  
HETATM   16  C   UNL     1       4.681   0.544  -0.011  1.00  0.00           C  
HETATM   17  O   UNL     1      -4.394   1.740   0.665  1.00  0.00           O  
HETATM   18  N   UNL     1      -4.849   0.613  -1.483  1.00  0.00           N  
HETATM   19  H   UNL     1       2.150   0.648   0.026  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.937   1.961   0.100  1.00  0.00           H  
HETATM   21  H   UNL     1       0.429   1.288   0.061  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.763  -2.831  -0.020  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.122  -2.137   0.021  1.00  0.00           H  
HETATM   24  H   UNL     1       4.008  -1.317   0.840  1.00  0.00           H  
HETATM   25  H   UNL     1       3.984  -1.271  -0.939  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.758   1.470  -1.928  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.225  -0.144  -1.959  1.00  0.00           H  
CONECT    1    7   17   17   18                                       
CONECT    1   15   15                                                 
CONECT    2   14   10   19                                            
CONECT    3   10   10                                                 
CONECT    4   10    8    8    6                                       
CONECT    5    6    6    7   20                                       
CONECT    6    4    5    5   21                                       
CONECT    7    1    5    9    9                                       
CONECT    8    4    4    9   22                                       
CONECT    9    7    7    8   23                                       
CONECT   10    2    3    3    4                                       
CONECT   11   16                                                      
CONECT   12   16                                                      
CONECT   13   16                                                      
CONECT   14    2   16   24   25                                       
CONECT   15    1    1                                                 
CONECT   16   11   12   13   14                                       
CONECT   17    1    1                                                 
CONECT   18    1   26   27                                            
CONECT   19    2                                                      
CONECT   20    5                                                      
CONECT   21    6                                                      
CONECT   22    8                                                      
CONECT   23    9                                                      
CONECT   24   14                                                      
CONECT   25   14                                                      
CONECT   26   18                                                      
CONECT   27   18                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
