COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.282  -1.578  -0.173  1.00  0.00           C  
HETATM    2  O   UNL     1       4.628  -1.187  -0.529  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.485  -0.806  -0.088  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.741  -1.459  -0.001  1.00  0.00           C  
HETATM    5  O   UNL     1      -3.763  -0.803   0.071  1.00  0.00           O  
HETATM    6  N   UNL     1       0.673  -2.190  -0.241  1.00  0.00           N  
HETATM    7  O   UNL     1      -2.802  -2.807   0.001  1.00  0.00           O  
HETATM    8  C   UNL     1      -4.100  -3.397   0.091  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.422   0.589  -0.090  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.286   1.332  -0.175  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.349   2.654  -0.173  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.765   3.177  -0.071  1.00  0.00           C  
HETATM   13  S   UNL     1      -2.768   1.656   0.005  1.00  0.00           S  
HETATM   14  O   UNL     1       0.626   3.371  -0.245  1.00  0.00           O  
HETATM   15  C   UNL     1       0.961   0.693  -0.264  1.00  0.00           C  
HETATM   16  C   UNL     1       1.492   0.379  -1.507  1.00  0.00           C  
HETATM   17  C   UNL     1       2.719  -0.250  -1.594  1.00  0.00           C  
HETATM   18  C   UNL     1       3.421  -0.568  -0.441  1.00  0.00           C  
HETATM   19  C   UNL     1       2.891  -0.255   0.803  1.00  0.00           C  
HETATM   20  C   UNL     1       1.666   0.379   0.892  1.00  0.00           C  
HETATM   21  F   UNL     1       1.152   0.689   2.102  1.00  0.00           F  
HETATM   22  C   UNL     1       5.295  -1.485   0.699  1.00  0.00           C  
HETATM   23  H   UNL     1      -4.704  -3.078  -0.758  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.007  -4.483   0.083  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.580  -3.080   1.017  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.893   3.767   0.836  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.023   3.764  -0.953  1.00  0.00           H  
HETATM   28  H   UNL     1       0.947   0.627  -2.406  1.00  0.00           H  
HETATM   29  H   UNL     1       3.132  -0.494  -2.562  1.00  0.00           H  
HETATM   30  H   UNL     1       3.438  -0.504   1.700  1.00  0.00           H  
HETATM   31  H   UNL     1       6.245  -1.976   0.487  1.00  0.00           H  
HETATM   32  H   UNL     1       5.479  -0.560   1.246  1.00  0.00           H  
HETATM   33  H   UNL     1       4.671  -2.145   1.301  1.00  0.00           H  
CONECT    1    6    6    6    3                                       
CONECT    2   18   22                                                 
CONECT    3    9    9    1    4                                       
CONECT    4    3    5    5    7                                       
CONECT    5    4    4                                                 
CONECT    6    1    1    1                                            
CONECT    7    4    8                                                 
CONECT    8    7   23   24   25                                       
CONECT    9   10   13    3    3                                       
CONECT   10   15   11    9                                            
CONECT   11   14   14   10   12                                       
CONECT   12   11   13   26   27                                       
CONECT   13   12    9                                                 
CONECT   14   11   11                                                 
CONECT   15   16   10   20   20                                       
CONECT   16   17   17   15   28                                       
CONECT   17   16   16   18   29                                       
CONECT   18   17    2   19   19                                       
CONECT   19   18   18   20   30                                       
CONECT   20   15   15   19   21                                       
CONECT   21   20                                                      
CONECT   22    2   31   32   33                                       
CONECT   23    8                                                      
CONECT   24    8                                                      
CONECT   25    8                                                      
CONECT   26   12                                                      
CONECT   27   12                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   19                                                      
CONECT   31   22                                                      
CONECT   32   22                                                      
CONECT   33   22                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
