COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.798   0.743  -1.209  1.00  0.00           O  
HETATM    2  C   UNL     1       1.898  -0.064  -0.306  1.00  0.00           C  
HETATM    3  O   UNL     1       3.054  -0.730  -0.123  1.00  0.00           O  
HETATM    4  C   UNL     1       4.181  -0.484  -1.005  1.00  0.00           C  
HETATM    5  C   UNL     1       5.343  -1.349  -0.589  1.00  0.00           C  
HETATM    6  C   UNL     1       5.493  -2.612  -1.129  1.00  0.00           C  
HETATM    7  C   UNL     1       6.558  -3.405  -0.748  1.00  0.00           C  
HETATM    8  C   UNL     1       7.475  -2.935   0.174  1.00  0.00           C  
HETATM    9  C   UNL     1       7.326  -1.671   0.714  1.00  0.00           C  
HETATM   10  C   UNL     1       6.262  -0.876   0.329  1.00  0.00           C  
HETATM   11  N   UNL     1       0.852  -0.293   0.513  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.405   0.432   0.314  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.333   1.785   1.025  1.00  0.00           C  
HETATM   14  C   UNL     1       0.726   2.638   0.374  1.00  0.00           C  
HETATM   15  C   UNL     1       0.393   3.469  -0.679  1.00  0.00           C  
HETATM   16  C   UNL     1       1.364   4.252  -1.275  1.00  0.00           C  
HETATM   17  C   UNL     1       2.667   4.203  -0.819  1.00  0.00           C  
HETATM   18  C   UNL     1       3.000   3.372   0.235  1.00  0.00           C  
HETATM   19  C   UNL     1       2.029   2.593   0.834  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.544  -0.374   0.883  1.00  0.00           C  
HETATM   21  O   UNL     1      -1.327  -1.448   1.404  1.00  0.00           O  
HETATM   22  N   UNL     1      -2.805   0.098   0.813  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.912  -0.685   1.367  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.043  -0.397   2.863  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.193  -0.307   0.668  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.889  -1.233   0.000  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.134  -0.865  -0.679  1.00  0.00           C  
HETATM   28  O   UNL     1      -7.535   0.281  -0.635  1.00  0.00           O  
HETATM   29  C   UNL     1      -7.909  -1.896  -1.423  1.00  0.00           C  
HETATM   30  O   UNL     1      -8.936  -1.593  -1.983  1.00  0.00           O  
HETATM   31  H   UNL     1       3.899  -0.723  -2.030  1.00  0.00           H  
HETATM   32  H   UNL     1       4.469   0.566  -0.942  1.00  0.00           H  
HETATM   33  H   UNL     1       4.777  -2.979  -1.850  1.00  0.00           H  
HETATM   34  H   UNL     1       6.675  -4.393  -1.170  1.00  0.00           H  
HETATM   35  H   UNL     1       8.307  -3.555   0.473  1.00  0.00           H  
HETATM   36  H   UNL     1       8.041  -1.304   1.435  1.00  0.00           H  
HETATM   37  H   UNL     1       6.146   0.111   0.751  1.00  0.00           H  
HETATM   38  H   UNL     1       0.932  -0.936   1.234  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.569   0.590  -0.752  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.298   2.285   0.952  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.081   1.631   2.074  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.626   3.507  -1.035  1.00  0.00           H  
HETATM   43  H   UNL     1       1.103   4.901  -2.098  1.00  0.00           H  
HETATM   44  H   UNL     1       3.426   4.814  -1.285  1.00  0.00           H  
HETATM   45  H   UNL     1       4.019   3.334   0.591  1.00  0.00           H  
HETATM   46  H   UNL     1       2.289   1.944   1.657  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.979   0.957   0.397  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.717  -1.747   1.217  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.239   0.665   3.013  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.867  -0.980   3.275  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.117  -0.671   3.369  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.549   0.712   0.708  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.533  -2.252  -0.039  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.553  -2.915  -1.462  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   11                                       
CONECT    3    2    4                                                 
CONECT    4    3    5   31   32                                       
CONECT    5    4    6    6   10                                       
CONECT    6    5    5    7   33                                       
CONECT    7    6    8    8   34                                       
CONECT    8    7    7    9   35                                       
CONECT    9    8   10   10   36                                       
CONECT   10    5    9    9   37                                       
CONECT   11    2   12   38                                            
CONECT   12   11   13   20   39                                       
CONECT   13   12   14   40   41                                       
CONECT   14   13   15   15   19                                       
CONECT   15   14   14   16   42                                       
CONECT   16   15   17   17   43                                       
CONECT   17   16   16   18   44                                       
CONECT   18   17   19   19   45                                       
CONECT   19   14   18   18   46                                       
CONECT   20   12   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   47                                            
CONECT   23   22   24   25   48                                       
CONECT   24   23   49   50   51                                       
CONECT   25   23   26   26   52                                       
CONECT   26   25   25   27   53                                       
CONECT   27   26   28   28   29                                       
CONECT   28   27   27                                                 
CONECT   29   27   30   30   54                                       
CONECT   30   29   29                                                 
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
