COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.568   4.792  -0.418  1.00  0.00           C  
HETATM    2  N   UNL     1       2.797   1.474   0.312  1.00  0.00           N  
HETATM    3  C   UNL     1       0.962   3.058   0.032  1.00  0.00           C  
HETATM    4  C   UNL     1       2.397   2.733   0.122  1.00  0.00           C  
HETATM    5  C   UNL     1       4.695   3.382   0.101  1.00  0.00           C  
HETATM    6  C   UNL     1       3.365   3.740   0.009  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.379   4.177  -1.561  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.611  -0.930   0.489  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.479  -0.731   1.256  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.415  -0.238  -0.217  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.366  -1.533   1.068  1.00  0.00           C  
HETATM   12  C   UNL     1       5.068  -3.340  -2.178  1.00  0.00           C  
HETATM   13  C   UNL     1       0.987  -0.909   2.086  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.633  -1.931  -0.467  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.518  -2.730  -0.659  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.233  -1.572   0.124  1.00  0.00           C  
HETATM   17  C   UNL     1       0.468  -1.903   1.276  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.304   3.997  -0.214  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.081   2.189   0.244  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.270   2.747   0.098  1.00  0.00           N  
HETATM   21  C   UNL     1       4.490  -0.251   0.607  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.209   6.238  -0.768  1.00  0.00           C  
HETATM   23  C   UNL     1       4.078   1.182   0.392  1.00  0.00           C  
HETATM   24  C   UNL     1       4.558  -0.970  -0.742  1.00  0.00           C  
HETATM   25  C   UNL     1       0.108   0.764   0.600  1.00  0.00           C  
HETATM   26  C   UNL     1       0.811   0.419   1.756  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.388  -2.534   0.111  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.398   4.769   0.866  1.00  0.00           C  
HETATM   29  F   UNL     1      -6.742  -2.129  -1.213  1.00  0.00           F  
HETATM   30  F   UNL     1      -2.259  -1.338   1.817  1.00  0.00           F  
HETATM   31  F   UNL     1      -1.091   0.088  -1.340  1.00  0.00           F  
HETATM   32  N   UNL     1       5.011   2.108   0.290  1.00  0.00           N  
HETATM   33  N   UNL     1      -0.755  -2.580  -0.691  1.00  0.00           N  
HETATM   34  O   UNL     1       4.029  -3.358   0.245  1.00  0.00           O  
HETATM   35  O   UNL     1       6.383  -2.714   0.020  1.00  0.00           O  
HETATM   36  O   UNL     1      -1.569  -3.992   1.162  1.00  0.00           O  
HETATM   37  O   UNL     1      -2.293  -4.446  -1.186  1.00  0.00           O  
HETATM   38  S   UNL     1       0.275   4.633  -0.357  1.00  0.00           S  
HETATM   39  S   UNL     1       5.054  -2.696  -0.483  1.00  0.00           S  
HETATM   40  S   UNL     1      -1.971  -3.554  -0.128  1.00  0.00           S  
HETATM   41  H   UNL     1       5.470   4.130   0.019  1.00  0.00           H  
HETATM   42  H   UNL     1       3.077   4.770  -0.145  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.293   4.753  -1.709  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.787   4.194  -2.476  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.634   3.148  -1.312  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.481  -0.308   0.639  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.462   0.050   2.001  1.00  0.00           H  
HETATM   48  H   UNL     1       4.073  -3.241  -2.613  1.00  0.00           H  
HETATM   49  H   UNL     1       5.783  -2.774  -2.776  1.00  0.00           H  
HETATM   50  H   UNL     1       5.357  -4.391  -2.165  1.00  0.00           H  
HETATM   51  H   UNL     1       1.531  -1.173   2.981  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.535  -3.510  -1.405  1.00  0.00           H  
HETATM   53  H   UNL     1       0.610  -2.941   1.540  1.00  0.00           H  
HETATM   54  H   UNL     1       5.470  -0.280   1.084  1.00  0.00           H  
HETATM   55  H   UNL     1       3.761  -0.747   1.247  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.632   6.676   0.046  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.618   6.255  -1.683  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.123   6.814  -0.916  1.00  0.00           H  
HETATM   59  H   UNL     1       3.578  -0.942  -1.218  1.00  0.00           H  
HETATM   60  H   UNL     1       5.288  -0.474  -1.382  1.00  0.00           H  
HETATM   61  H   UNL     1       1.217   1.192   2.391  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.821   5.207   1.680  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.312   5.345   0.719  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.654   3.739   1.115  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.406  -2.710  -1.587  1.00  0.00           H  
CONECT    1   22    7   28   18                                       
CONECT    2   23   23    4                                            
CONECT    3   38   19   19    4                                       
CONECT    4    2    3    6    6                                       
CONECT    5   32   32    6   41                                       
CONECT    6    4    4    5   42                                       
CONECT    7    1   43   44   45                                       
CONECT    8    9   14   14   46                                       
CONECT    9   11   11    8   47                                       
CONECT   10   31   25   25   16                                       
CONECT   11   30    9    9   27                                       
CONECT   12   39   48   49   50                                       
CONECT   13   26   26   17   51                                       
CONECT   14    8    8   15   29                                       
CONECT   15   27   27   14   52                                       
CONECT   16   10   33   17   17                                       
CONECT   17   16   16   13   53                                       
CONECT   18    1   38   20   20                                       
CONECT   19   20    3    3   25                                       
CONECT   20   18   18   19                                            
CONECT   21   24   23   54   55                                       
CONECT   22    1   56   57   58                                       
CONECT   23   21    2    2   32                                       
CONECT   24   39   21   59   60                                       
CONECT   25   19   10   10   26                                       
CONECT   26   25   13   13   61                                       
CONECT   27   11   40   15   15                                       
CONECT   28    1   62   63   64                                       
CONECT   29   14                                                      
CONECT   30   11                                                      
CONECT   31   10                                                      
CONECT   32   23    5    5                                            
CONECT   33   16   40   65                                            
CONECT   34   39   39                                                 
CONECT   35   39   39                                                 
CONECT   36   40   40                                                 
CONECT   37   40   40                                                 
CONECT   38   18    3                                                 
CONECT   39   34   34   12   35                                       
CONECT   39   35   24                                                 
CONECT   40   33   27   37   37                                       
CONECT   40   36   36                                                 
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   24                                                      
CONECT   60   24                                                      
CONECT   61   26                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   33                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
