COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.650  -0.072  -2.501  1.00  0.00           C  
HETATM    2  C   UNL     1       1.705   0.379  -1.718  1.00  0.00           C  
HETATM    3  C   UNL     1       1.606   0.347  -0.336  1.00  0.00           C  
HETATM    4  C   UNL     1       0.456  -0.134   0.265  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.600  -0.585  -0.518  1.00  0.00           C  
HETATM    6  O   UNL     1       2.836   0.850  -2.308  1.00  0.00           O  
HETATM    7  C   UNL     1       3.818   1.335  -1.506  1.00  0.00           C  
HETATM    8  C   UNL     1       4.692   0.475  -0.851  1.00  0.00           C  
HETATM    9  C   UNL     1       5.685   1.012  -0.039  1.00  0.00           C  
HETATM   10  C   UNL     1       4.988   3.167  -0.503  1.00  0.00           C  
HETATM   11  C   UNL     1       6.626   0.108   0.668  1.00  0.00           C  
HETATM   12  C   UNL     1       3.979   2.708  -1.324  1.00  0.00           C  
HETATM   13  F   UNL     1      -8.454   3.456   1.104  1.00  0.00           F  
HETATM   14  C   UNL     1      -7.475   2.536   0.959  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.616   1.516   0.034  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.616   0.575  -0.115  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.329   2.619   1.733  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.327   1.679   1.586  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.469   0.652   0.663  1.00  0.00           C  
HETATM   20  N   UNL     1      -4.454  -0.301   0.513  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.769  -1.583   0.241  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.924  -1.895   0.044  1.00  0.00           O  
HETATM   23  C   UNL     1      -3.685  -2.629   0.181  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.111  -4.073  -0.088  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.638  -3.663   1.308  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.372  -2.171  -0.399  1.00  0.00           C  
HETATM   27  O   UNL     1      -1.860  -2.793  -1.307  1.00  0.00           O  
HETATM   28  N   UNL     1      -1.766  -1.071   0.090  1.00  0.00           N  
HETATM   29  C   UNL     1      -0.502  -0.547  -1.903  1.00  0.00           C  
HETATM   30  F   UNL     1       0.747  -0.041  -3.849  1.00  0.00           F  
HETATM   31  F   UNL     1       0.360  -0.165   1.612  1.00  0.00           F  
HETATM   32  N   UNL     1       5.799   2.326   0.110  1.00  0.00           N  
HETATM   33  C   UNL     1       7.645   0.489   1.493  1.00  0.00           C  
HETATM   34  N   UNL     1       8.256  -0.629   1.928  1.00  0.00           N  
HETATM   35  C   UNL     1       9.404  -0.682   2.838  1.00  0.00           C  
HETATM   36  N   UNL     1       7.606  -1.733   1.363  1.00  0.00           N  
HETATM   37  C   UNL     1       6.628  -1.300   0.614  1.00  0.00           C  
HETATM   38  H   UNL     1       2.427   0.697   0.273  1.00  0.00           H  
HETATM   39  H   UNL     1       4.601  -0.595  -0.971  1.00  0.00           H  
HETATM   40  H   UNL     1       5.113   4.229  -0.357  1.00  0.00           H  
HETATM   41  H   UNL     1       3.321   3.405  -1.822  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.508   1.455  -0.571  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.727  -0.221  -0.837  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.219   3.418   2.451  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.433   1.744   2.189  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.525  -0.039   0.606  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.176  -4.267  -0.222  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.442  -4.693  -0.685  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.657  -4.012   1.630  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.391  -3.586   2.092  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.136  -0.616   0.862  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.323  -0.897  -2.511  1.00  0.00           H  
HETATM   53  H   UNL     1       7.912   1.503   1.750  1.00  0.00           H  
HETATM   54  H   UNL     1       9.049  -0.732   3.867  1.00  0.00           H  
HETATM   55  H   UNL     1      10.002  -1.566   2.617  1.00  0.00           H  
HETATM   56  H   UNL     1      10.013   0.212   2.706  1.00  0.00           H  
HETATM   57  H   UNL     1       5.944  -1.913   0.046  1.00  0.00           H  
CONECT    1   29   29    2   30                                       
CONECT    2    3    3    1    6                                       
CONECT    3    4    2    2   38                                       
CONECT    4   31    5    5    3                                       
CONECT    5   28    4    4   29                                       
CONECT    6    2    7                                                 
CONECT    7    6    8    8   12                                       
CONECT    8    7    7    9   39                                       
CONECT    9    8   11   32   32                                       
CONECT   10   12   12   32   40                                       
CONECT   11   37    9   33   33                                       
CONECT   12    7   10   10   41                                       
CONECT   13   14                                                      
CONECT   14   17   13   15   15                                       
CONECT   15   14   14   16   42                                       
CONECT   16   19   19   15   43                                       
CONECT   17   18   18   14   44                                       
CONECT   18   17   17   19   45                                       
CONECT   19   18   20   16   16                                       
CONECT   20   19   21   46                                            
CONECT   21   20   23   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   25   21   24   26                                       
CONECT   24   25   23   47   48                                       
CONECT   25   23   24   49   50                                       
CONECT   26   23   28   27   27                                       
CONECT   27   26   26                                                 
CONECT   28   26    5   51                                            
CONECT   29    5    1    1   52                                       
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    9    9   10                                            
CONECT   33   11   11   34   53                                       
CONECT   34   36   33   35                                            
CONECT   35   34   54   55   56                                       
CONECT   36   37   37   34                                            
CONECT   37   36   36   11   57                                       
CONECT   38    3                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   33                                                      
CONECT   54   35                                                      
CONECT   55   35                                                      
CONECT   56   35                                                      
CONECT   57   37                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
