COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.845  -0.637  -0.287  1.00  0.00           N  
HETATM    2  C   UNL     1       5.534  -0.271  -0.480  1.00  0.00           C  
HETATM    3  C   UNL     1       4.205   0.000  -0.148  1.00  0.00           C  
HETATM    4  C   UNL     1       3.898   1.124   0.620  1.00  0.00           C  
HETATM    5  C   UNL     1       3.127  -0.901  -0.609  1.00  0.00           C  
HETATM    6  C   UNL     1       0.836  -1.539  -0.639  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.083  -3.130  -2.180  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.250  -1.732   0.205  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.034   0.273  -0.689  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.312   2.258   0.445  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.533   4.326  -0.710  1.00  0.00           C  
HETATM   12  C   UNL     1       4.910   1.962   1.048  1.00  0.00           C  
HETATM   13  C   UNL     1       6.227   1.689   0.715  1.00  0.00           C  
HETATM   14  C   UNL     1       6.538   0.572  -0.043  1.00  0.00           C  
HETATM   15  F   UNL     1       4.614   3.050   1.792  1.00  0.00           F  
HETATM   16  F   UNL     1       7.824   0.312  -0.363  1.00  0.00           F  
HETATM   17  O   UNL     1       3.397  -1.879  -1.279  1.00  0.00           O  
HETATM   18  C   UNL     1       0.916  -2.240  -1.835  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.160  -3.324  -1.335  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.245  -2.624  -0.146  1.00  0.00           C  
HETATM   21  S   UNL     1      -2.623  -2.869   0.924  1.00  0.00           S  
HETATM   22  N   UNL     1      -3.838  -1.876   0.394  1.00  0.00           N  
HETATM   23  O   UNL     1      -3.069  -4.201   0.705  1.00  0.00           O  
HETATM   24  O   UNL     1      -2.233  -2.380   2.200  1.00  0.00           O  
HETATM   25  C   UNL     1      -3.665  -0.488   0.413  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.857   1.643  -0.672  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.954   1.500   1.550  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.125   0.130   1.533  1.00  0.00           C  
HETATM   29  O   UNL     1      -3.143   3.608   0.463  1.00  0.00           O  
HETATM   30  F   UNL     1      -2.792   3.869  -1.804  1.00  0.00           F  
HETATM   31  F   UNL     1      -4.896   4.121  -0.950  1.00  0.00           F  
HETATM   32  H   UNL     1       1.623   0.176   0.192  1.00  0.00           H  
HETATM   33  H   UNL     1       5.777  -1.139  -1.075  1.00  0.00           H  
HETATM   34  H   UNL     1       2.872   1.338   0.880  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.020  -3.679  -3.108  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.317  -1.186   1.134  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.454  -0.206  -1.560  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.346   5.390  -0.563  1.00  0.00           H  
HETATM   39  H   UNL     1       7.014   2.348   1.051  1.00  0.00           H  
HETATM   40  H   UNL     1       1.757  -2.089  -2.495  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.938  -4.023  -1.605  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.670  -2.257   0.071  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.143   2.235  -1.529  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.529   1.980   2.419  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.838  -0.461   2.390  1.00  0.00           H  
CONECT    1    5    6   32                                            
CONECT    2   14   14    3   33                                       
CONECT    3    4    4    2    5                                       
CONECT    4   12    3    3   34                                       
CONECT    5    3    1   17   17                                       
CONECT    6    1   18   18    8                                       
CONECT    7   18   19   19   35                                       
CONECT    8    6   20   20   36                                       
CONECT    9   26   25   25   37                                       
CONECT   10   29   26   26   27                                       
CONECT   11   31   30   29   38                                       
CONECT   12   15   13   13    4                                       
CONECT   13   12   12   14   39                                       
CONECT   14   13   16    2    2                                       
CONECT   15   12                                                      
CONECT   16   14                                                      
CONECT   17    5    5                                                 
CONECT   18    6    6    7   40                                       
CONECT   19    7    7   20   41                                       
CONECT   20    8    8   19   21                                       
CONECT   21   20   23   23   22                                       
CONECT   21   24   24                                                 
CONECT   22   25   21   42                                            
CONECT   23   21   21                                                 
CONECT   24   21   21                                                 
CONECT   25    9    9   28   22                                       
CONECT   26   10   10    9   43                                       
CONECT   27   10   28   28   44                                       
CONECT   28   27   27   25   45                                       
CONECT   29   11   10                                                 
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   22                                                      
CONECT   43   26                                                      
CONECT   44   27                                                      
CONECT   45   28                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
