COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -0.002  -1.456   1.015  1.00  0.00           F  
HETATM    2  C   UNL     1      -0.134  -0.140   0.739  1.00  0.00           C  
HETATM    3  C   UNL     1       0.860   0.754   1.116  1.00  0.00           C  
HETATM    4  S   UNL     1       2.296   0.172   1.954  1.00  0.00           S  
HETATM    5  C   UNL     1       3.437  -0.206   0.595  1.00  0.00           C  
HETATM    6  C   UNL     1       4.755  -0.732   1.167  1.00  0.00           C  
HETATM    7  C   UNL     1       5.703  -1.046   0.038  1.00  0.00           C  
HETATM    8  C   UNL     1       5.708  -2.306  -0.529  1.00  0.00           C  
HETATM    9  C   UNL     1       6.577  -2.595  -1.564  1.00  0.00           C  
HETATM   10  C   UNL     1       6.563  -0.072  -0.433  1.00  0.00           C  
HETATM   11  C   UNL     1       7.432  -0.361  -1.469  1.00  0.00           C  
HETATM   12  C   UNL     1       7.441  -1.623  -2.033  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.263   0.321   0.073  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.398   1.673  -0.210  1.00  0.00           C  
HETATM   15  S   UNL     1      -2.829   2.257  -1.056  1.00  0.00           S  
HETATM   16  O   UNL     1      -3.349   1.149  -1.777  1.00  0.00           O  
HETATM   17  N   UNL     1      -3.957   2.637   0.096  1.00  0.00           N  
HETATM   18  O   UNL     1      -2.458   3.482  -1.673  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.408   2.564   0.171  1.00  0.00           C  
HETATM   20  F   UNL     1      -0.543   3.880  -0.104  1.00  0.00           F  
HETATM   21  C   UNL     1       0.720   2.108   0.830  1.00  0.00           C  
HETATM   22  F   UNL     1       1.687   2.978   1.197  1.00  0.00           F  
HETATM   23  N   UNL     1      -2.264  -0.578  -0.314  1.00  0.00           N  
HETATM   24  C   UNL     1      -2.828  -1.271   0.852  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.900  -2.228   0.398  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.570  -3.531   0.074  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.553  -4.409  -0.344  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.865  -3.984  -0.437  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.195  -2.681  -0.113  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.213  -1.805   0.310  1.00  0.00           C  
HETATM   31  H   UNL     1       2.994  -0.964  -0.051  1.00  0.00           H  
HETATM   32  H   UNL     1       3.626   0.698   0.018  1.00  0.00           H  
HETATM   33  H   UNL     1       5.199   0.026   1.814  1.00  0.00           H  
HETATM   34  H   UNL     1       4.566  -1.636   1.745  1.00  0.00           H  
HETATM   35  H   UNL     1       5.033  -3.066  -0.163  1.00  0.00           H  
HETATM   36  H   UNL     1       6.581  -3.580  -2.007  1.00  0.00           H  
HETATM   37  H   UNL     1       6.556   0.914   0.007  1.00  0.00           H  
HETATM   38  H   UNL     1       8.104   0.400  -1.838  1.00  0.00           H  
HETATM   39  H   UNL     1       8.120  -1.848  -2.842  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.603   3.341  -0.072  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.972   2.156   0.938  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.914  -1.238  -0.992  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.040  -1.824   1.363  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.260  -0.539   1.535  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.545  -3.863   0.146  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.296  -5.427  -0.597  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.633  -4.670  -0.763  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.220  -2.349  -0.186  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.470  -0.787   0.563  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3   13                                       
CONECT    3    4    2    2   21                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   31   32                                       
CONECT    6    7    5   33   34                                       
CONECT    7    8    6   10   10                                       
CONECT    8    9    9    7   35                                       
CONECT    9    8    8   12   36                                       
CONECT   10    7    7   11   37                                       
CONECT   11   12   12   10   38                                       
CONECT   12    9   11   11   39                                       
CONECT   13    2   23   14   14                                       
CONECT   14   13   13   19   15                                       
CONECT   15   14   17   16   16                                       
CONECT   15   18   18                                                 
CONECT   16   15   15                                                 
CONECT   17   15   40   41                                            
CONECT   18   15   15                                                 
CONECT   19   21   21   14   20                                       
CONECT   20   19                                                      
CONECT   21    3   22   19   19                                       
CONECT   22   21                                                      
CONECT   23   24   13   42                                            
CONECT   24   25   23   43   44                                       
CONECT   25   30   30   26   24                                       
CONECT   26   27   27   25   45                                       
CONECT   27   28   26   26   46                                       
CONECT   28   29   29   27   47                                       
CONECT   29   28   28   30   48                                       
CONECT   30   29   25   25   49                                       
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
CONECT   49   30                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
