COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.993  -4.095   0.436  1.00  0.00           C  
HETATM    2  N   UNL     1       2.664   0.034  -0.491  1.00  0.00           N  
HETATM    3  C   UNL     1       1.406   0.190  -0.032  1.00  0.00           C  
HETATM    4  C   UNL     1       0.240   0.095  -0.981  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.177  -0.018  -1.077  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.821  -0.770  -0.174  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.668   0.306   0.018  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.787   0.170   0.818  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.213  -2.116   1.234  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.097   1.670   0.281  1.00  0.00           C  
HETATM   11  O   UNL     1       3.586   2.438   0.006  1.00  0.00           O  
HETATM   12  C   UNL     1       4.192   1.571   0.599  1.00  0.00           C  
HETATM   13  N   UNL     1       5.219   1.899   1.408  1.00  0.00           N  
HETATM   14  C   UNL     1       5.603   3.304   1.571  1.00  0.00           C  
HETATM   15  C   UNL     1       3.797   0.126   0.432  1.00  0.00           C  
HETATM   16  C   UNL     1       4.980  -0.664  -0.133  1.00  0.00           C  
HETATM   17  C   UNL     1       4.627  -2.128  -0.185  1.00  0.00           C  
HETATM   18  C   UNL     1       4.683  -2.917  -1.275  1.00  0.00           C  
HETATM   19  N   UNL     1       4.281  -4.165  -0.881  1.00  0.00           N  
HETATM   20  N   UNL     1       4.202  -2.874   0.846  1.00  0.00           N  
HETATM   21  O   UNL     1       1.214   0.407   1.146  1.00  0.00           O  
HETATM   22  N   UNL     1      -1.012   0.300  -0.240  1.00  0.00           N  
HETATM   23  C   UNL     1      -1.151   2.643  -0.869  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.344   3.950  -0.633  1.00  0.00           O  
HETATM   25  O   UNL     1      -1.021   2.246  -2.002  1.00  0.00           O  
HETATM   26  C   UNL     1      -3.416  -0.168  -0.192  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.601  -0.622  -1.046  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.060  -1.041   1.426  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.090  -1.979   0.440  1.00  0.00           C  
HETATM   30  H   UNL     1       3.642  -4.913   1.048  1.00  0.00           H  
HETATM   31  H   UNL     1       2.818  -0.140  -1.433  1.00  0.00           H  
HETATM   32  H   UNL     1       0.335   0.859  -1.752  1.00  0.00           H  
HETATM   33  H   UNL     1       0.229  -0.891  -1.446  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.339   0.786  -1.795  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.997  -0.951  -1.611  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.456   1.252  -0.457  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.449   1.011   0.968  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.426  -3.063   1.709  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.997   1.773   0.887  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.221   1.881   0.894  1.00  0.00           H  
HETATM   41  H   UNL     1       5.704   1.206   1.883  1.00  0.00           H  
HETATM   42  H   UNL     1       4.761   3.866   1.973  1.00  0.00           H  
HETATM   43  H   UNL     1       6.447   3.372   2.257  1.00  0.00           H  
HETATM   44  H   UNL     1       5.887   3.717   0.603  1.00  0.00           H  
HETATM   45  H   UNL     1       3.513  -0.287   1.399  1.00  0.00           H  
HETATM   46  H   UNL     1       5.208  -0.309  -1.138  1.00  0.00           H  
HETATM   47  H   UNL     1       5.850  -0.523   0.508  1.00  0.00           H  
HETATM   48  H   UNL     1       4.988  -2.622  -2.268  1.00  0.00           H  
HETATM   49  H   UNL     1       4.216  -4.953  -1.444  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.221  -0.910   0.583  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.648   0.790   0.273  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.369  -1.580  -1.510  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.796   0.120  -1.821  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.934  -1.146   2.052  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.429  -2.819   0.290  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.371   4.536  -1.403  1.00  0.00           H  
CONECT    1   19   20   20   30                                       
CONECT    2    3   15   31                                            
CONECT    3    2    4   21   21                                       
CONECT    4    3   22   32   33                                       
CONECT    5   22   26   34   35                                       
CONECT    6    7    7   27   29                                       
CONECT    7    6    6    8   36                                       
CONECT    8    7   28   28   37                                       
CONECT    9   28   29   29   38                                       
CONECT   10   22   23   39   40                                       
CONECT   11   12   12                                                 
CONECT   12   11   11   13   15                                       
CONECT   13   12   14   41                                            
CONECT   14   13   42   43   44                                       
CONECT   15    2   12   16   45                                       
CONECT   16   15   17   46   47                                       
CONECT   17   16   18   18   20                                       
CONECT   18   17   17   19   48                                       
CONECT   19    1   18   49                                            
CONECT   20    1    1   17                                            
CONECT   21    3    3                                                 
CONECT   22    4    5   10                                            
CONECT   23   10   24   25   25                                       
CONECT   24   23   56                                                 
CONECT   25   23   23                                                 
CONECT   26    5   27   50   51                                       
CONECT   27    6   26   52   53                                       
CONECT   28    8    8    9   54                                       
CONECT   29    6    9    9   55                                       
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   24                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
