COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.337   3.196   1.202  1.00  0.00           C  
HETATM    2  C   UNL     1       1.491   0.666  -0.151  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.116  -0.997   0.520  1.00  0.00           C  
HETATM    4  C   UNL     1       3.301  -2.448   0.746  1.00  0.00           C  
HETATM    5  C   UNL     1       3.004  -3.704   1.184  1.00  0.00           C  
HETATM    6  C   UNL     1       1.685  -4.090   1.410  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.758  -0.432  -0.347  1.00  0.00           C  
HETATM    8  C   UNL     1       7.621  -1.494  -1.436  1.00  0.00           C  
HETATM    9  C   UNL     1       7.171  -0.075  -1.789  1.00  0.00           C  
HETATM   10  C   UNL     1       6.838  -0.002  -3.281  1.00  0.00           C  
HETATM   11  C   UNL     1       5.947   0.279  -0.984  1.00  0.00           C  
HETATM   12  N   UNL     1       4.809  -0.365  -1.021  1.00  0.00           N  
HETATM   13  C   UNL     1       3.932   0.212  -0.183  1.00  0.00           C  
HETATM   14  C   UNL     1       4.584   1.288   0.411  1.00  0.00           C  
HETATM   15  N   UNL     1       5.861   1.305  -0.118  1.00  0.00           N  
HETATM   16  C   UNL     1       6.734   2.286   0.294  1.00  0.00           C  
HETATM   17  N   UNL     1       5.104   3.175   1.725  1.00  0.00           N  
HETATM   18  C   UNL     1       4.222   2.261   1.364  1.00  0.00           C  
HETATM   19  N   UNL     1       2.949   2.266   1.908  1.00  0.00           N  
HETATM   20  C   UNL     1       2.540  -0.216   0.063  1.00  0.00           C  
HETATM   21  C   UNL     1       0.179   0.276   0.076  1.00  0.00           C  
HETATM   22  C   UNL     1       0.926  -1.920   0.749  1.00  0.00           C  
HETATM   23  C   UNL     1       2.267  -1.529   0.519  1.00  0.00           C  
HETATM   24  C   UNL     1       0.657  -3.223   1.199  1.00  0.00           C  
HETATM   25  N   UNL     1      -1.443  -1.370   0.743  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.440  -0.730   0.100  1.00  0.00           C  
HETATM   27  O   UNL     1      -2.181   0.106  -0.744  1.00  0.00           O  
HETATM   28  N   UNL     1      -3.724  -1.017   0.393  1.00  0.00           N  
HETATM   29  C   UNL     1      -4.584  -0.172  -1.701  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.608   0.399  -2.430  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.806   0.713  -1.814  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.982   0.455  -0.467  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.962  -0.116   0.268  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.289   0.799   0.201  1.00  0.00           C  
HETATM   35  F   UNL     1      -8.059   1.716   1.232  1.00  0.00           F  
HETATM   36  F   UNL     1      -9.158   1.362  -0.739  1.00  0.00           F  
HETATM   37  F   UNL     1      -8.862  -0.363   0.729  1.00  0.00           F  
HETATM   38  H   UNL     1       7.032   3.959   1.522  1.00  0.00           H  
HETATM   39  H   UNL     1       1.699   1.668  -0.495  1.00  0.00           H  
HETATM   40  H   UNL     1       4.328  -2.162   0.574  1.00  0.00           H  
HETATM   41  H   UNL     1       3.803  -4.410   1.358  1.00  0.00           H  
HETATM   42  H   UNL     1       1.476  -5.091   1.757  1.00  0.00           H  
HETATM   43  H   UNL     1       6.819  -2.197  -1.664  1.00  0.00           H  
HETATM   44  H   UNL     1       8.506  -1.750  -2.019  1.00  0.00           H  
HETATM   45  H   UNL     1       7.858  -1.546  -0.373  1.00  0.00           H  
HETATM   46  H   UNL     1       7.972   0.627  -1.561  1.00  0.00           H  
HETATM   47  H   UNL     1       6.037  -0.705  -3.509  1.00  0.00           H  
HETATM   48  H   UNL     1       6.517   1.008  -3.533  1.00  0.00           H  
HETATM   49  H   UNL     1       7.723  -0.259  -3.864  1.00  0.00           H  
HETATM   50  H   UNL     1       7.734   2.326  -0.111  1.00  0.00           H  
HETATM   51  H   UNL     1       2.289   1.622   1.606  1.00  0.00           H  
HETATM   52  H   UNL     1       2.716   2.914   2.592  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.623   0.979  -0.097  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.362  -3.535   1.378  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.648  -2.090   1.360  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.931  -1.628   1.117  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.648  -0.416  -2.182  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.473   0.602  -3.482  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.605   1.160  -2.386  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.100  -0.318   1.320  1.00  0.00           H  
CONECT    1   16   16   17   38                                       
CONECT    2   21   21   20   39                                       
CONECT    3   21   22   22   25                                       
CONECT    4   23    5    5   40                                       
CONECT    5    4    4    6   41                                       
CONECT    6   24   24    5   42                                       
CONECT    7   28   33   33   29                                       
CONECT    8    9   43   44   45                                       
CONECT    9   10    8   11   46                                       
CONECT   10    9   47   48   49                                       
CONECT   11    9   15   12   12                                       
CONECT   12   11   11   13                                            
CONECT   13   12   14   14   20                                       
CONECT   14   15   13   13   18                                       
CONECT   15   11   16   14                                            
CONECT   16   15    1    1   50                                       
CONECT   17    1   18   18                                            
CONECT   18   14   17   17   19                                       
CONECT   19   18   51   52                                            
CONECT   20   13    2   23   23                                       
CONECT   21    2    2    3   53                                       
CONECT   22    3    3   23   24                                       
CONECT   23   20   20   22    4                                       
CONECT   24   22    6    6   54                                       
CONECT   25    3   26   55                                            
CONECT   26   25   27   27   28                                       
CONECT   27   26   26                                                 
CONECT   28   26    7   56                                            
CONECT   29    7   30   30   57                                       
CONECT   30   29   29   31   58                                       
CONECT   31   32   32   30   59                                       
CONECT   32   33   34   31   31                                       
CONECT   33    7    7   32   60                                       
CONECT   34   37   35   32   36                                       
CONECT   35   34                                                      
CONECT   36   34                                                      
CONECT   37   34                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   16                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   21                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   33                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
