COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.137  -0.593   1.790  1.00  0.00           O  
HETATM    2  C   UNL     1       1.646   0.238   1.061  1.00  0.00           C  
HETATM    3  N   UNL     1       2.968   0.188   0.803  1.00  0.00           N  
HETATM    4  C   UNL     1       3.791  -0.867   1.398  1.00  0.00           C  
HETATM    5  C   UNL     1       5.222  -0.698   0.954  1.00  0.00           C  
HETATM    6  C   UNL     1       6.092   0.079   1.696  1.00  0.00           C  
HETATM    7  C   UNL     1       7.403   0.233   1.296  1.00  0.00           C  
HETATM    8  C   UNL     1       7.861  -0.391   0.139  1.00  0.00           C  
HETATM    9  O   UNL     1       9.100  -0.382  -0.426  1.00  0.00           O  
HETATM   10  C   UNL     1       8.997  -0.792  -1.801  1.00  0.00           C  
HETATM   11  C   UNL     1       7.744  -1.699  -1.795  1.00  0.00           C  
HETATM   12  C   UNL     1       6.976  -1.166  -0.601  1.00  0.00           C  
HETATM   13  C   UNL     1       5.670  -1.326  -0.195  1.00  0.00           C  
HETATM   14  C   UNL     1       0.820   1.291   0.460  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.524   1.455   0.639  1.00  0.00           C  
HETATM   16  N   UNL     1       1.268   2.288  -0.378  1.00  0.00           N  
HETATM   17  C   UNL     1       0.226   3.069  -0.729  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.909   2.582  -0.116  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.274   3.139  -0.228  1.00  0.00           C  
HETATM   20  N   UNL     1      -2.624   4.452  -0.125  1.00  0.00           N  
HETATM   21  N   UNL     1      -4.010   4.546  -0.291  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.499   3.351  -0.488  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.441   2.425  -0.463  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.552   0.958  -0.644  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.400   0.214   0.174  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.812   0.318  -1.638  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.919  -1.048  -1.803  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.759  -1.782  -0.984  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.872  -3.273  -1.170  1.00  0.00           C  
HETATM   30  N   UNL     1      -5.090  -3.581  -1.931  1.00  0.00           N  
HETATM   31  C   UNL     1      -4.499  -1.152   0.000  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.411  -1.959   0.887  1.00  0.00           C  
HETATM   33  F   UNL     1      -6.048  -1.109   1.798  1.00  0.00           F  
HETATM   34  F   UNL     1      -6.372  -2.606   0.103  1.00  0.00           F  
HETATM   35  F   UNL     1      -4.660  -2.911   1.585  1.00  0.00           F  
HETATM   36  H   UNL     1       3.374   0.851   0.222  1.00  0.00           H  
HETATM   37  H   UNL     1       3.738  -0.799   2.485  1.00  0.00           H  
HETATM   38  H   UNL     1       3.423  -1.841   1.076  1.00  0.00           H  
HETATM   39  H   UNL     1       5.743   0.567   2.594  1.00  0.00           H  
HETATM   40  H   UNL     1       8.076   0.841   1.882  1.00  0.00           H  
HETATM   41  H   UNL     1       8.847   0.071  -2.450  1.00  0.00           H  
HETATM   42  H   UNL     1       9.881  -1.352  -2.104  1.00  0.00           H  
HETATM   43  H   UNL     1       7.170  -1.576  -2.714  1.00  0.00           H  
HETATM   44  H   UNL     1       8.019  -2.743  -1.647  1.00  0.00           H  
HETATM   45  H   UNL     1       4.995  -1.938  -0.775  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.170   0.837   1.244  1.00  0.00           H  
HETATM   47  H   UNL     1       2.185   2.410  -0.668  1.00  0.00           H  
HETATM   48  H   UNL     1       0.273   3.930  -1.379  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.018   5.192   0.036  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.541   3.114  -0.650  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.978   0.705   0.943  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.157   0.891  -2.278  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.347  -1.544  -2.572  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.001  -3.639  -1.714  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.920  -3.758  -0.194  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.099  -3.092  -2.813  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.189  -4.576  -2.068  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3   14    1    1                                       
CONECT    3    4    2   36                                            
CONECT    4    3    5   37   38                                       
CONECT    5    4    6    6   13                                       
CONECT    6    5    5    7   39                                       
CONECT    7    6    8    8   40                                       
CONECT    8    7    7   12    9                                       
CONECT    9    8   10                                                 
CONECT   10   11    9   41   42                                       
CONECT   11   12   10   43   44                                       
CONECT   12   13   13    8   11                                       
CONECT   13    5   12   12   45                                       
CONECT   14   15   15    2   16                                       
CONECT   15   18   14   14   46                                       
CONECT   16   14   17   47                                            
CONECT   17   18   18   16   48                                       
CONECT   18   19   15   17   17                                       
CONECT   19   23   23   20   18                                       
CONECT   20   21   19   49                                            
CONECT   21   22   22   20                                            
CONECT   22   23   21   21   50                                       
CONECT   23   24   22   19   19                                       
CONECT   24   26   23   25   25                                       
CONECT   25   24   24   31   51                                       
CONECT   26   27   27   24   52                                       
CONECT   27   26   26   28   53                                       
CONECT   28   27   29   31   31                                       
CONECT   29   30   28   54   55                                       
CONECT   30   29   56   57                                            
CONECT   31   28   28   25   32                                       
CONECT   32   31   35   33   34                                       
CONECT   33   32                                                      
CONECT   34   32                                                      
CONECT   35   32                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   13                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   20                                                      
CONECT   50   22                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
