COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -9.477  -0.430  -0.277  1.00  0.00           C  
HETATM    2  C   UNL     1      -8.882  -0.417   0.971  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.604   0.088   1.122  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.921   0.578   0.025  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.528   1.128   0.189  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.509   0.002  -0.001  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.155   0.537   0.159  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.089  -0.279   0.033  1.00  0.00           C  
HETATM    9  O   UNL     1      -2.252  -1.459  -0.213  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.736   0.255   0.192  1.00  0.00           C  
HETATM   11  C   UNL     1       0.330  -0.561   0.067  1.00  0.00           C  
HETATM   12  C   UNL     1       1.690  -0.025   0.227  1.00  0.00           C  
HETATM   13  C   UNL     1       2.798  -0.869   0.096  1.00  0.00           C  
HETATM   14  C   UNL     1       4.073  -0.358   0.242  1.00  0.00           C  
HETATM   15  O   UNL     1       5.152  -1.176   0.116  1.00  0.00           O  
HETATM   16  C   UNL     1       4.977  -2.499  -0.035  1.00  0.00           C  
HETATM   17  O   UNL     1       3.871  -2.976   0.056  1.00  0.00           O  
HETATM   18  C   UNL     1       6.161  -3.387  -0.319  1.00  0.00           C  
HETATM   19  C   UNL     1       4.253   0.994   0.530  1.00  0.00           C  
HETATM   20  O   UNL     1       5.508   1.493   0.678  1.00  0.00           O  
HETATM   21  C   UNL     1       6.218   1.857  -0.402  1.00  0.00           C  
HETATM   22  O   UNL     1       5.783   1.647  -1.509  1.00  0.00           O  
HETATM   23  C   UNL     1       7.556   2.529  -0.233  1.00  0.00           C  
HETATM   24  C   UNL     1       3.154   1.833   0.660  1.00  0.00           C  
HETATM   25  C   UNL     1       1.880   1.333   0.510  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.518   0.570  -1.222  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.795   0.061  -1.373  1.00  0.00           C  
HETATM   28  H   UNL     1     -10.476  -0.825  -0.395  1.00  0.00           H  
HETATM   29  H   UNL     1      -9.416  -0.801   1.828  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.139   0.098   2.097  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.419   1.551   1.188  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.354   1.905  -0.555  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.618  -0.420  -1.000  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.683  -0.775   0.743  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.025   1.478   0.355  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.592   1.303   0.411  1.00  0.00           H  
HETATM   37  H   UNL     1       0.186  -1.609  -0.152  1.00  0.00           H  
HETATM   38  H   UNL     1       2.656  -1.918  -0.122  1.00  0.00           H  
HETATM   39  H   UNL     1       6.587  -3.735   0.622  1.00  0.00           H  
HETATM   40  H   UNL     1       5.839  -4.244  -0.911  1.00  0.00           H  
HETATM   41  H   UNL     1       6.913  -2.825  -0.873  1.00  0.00           H  
HETATM   42  H   UNL     1       7.979   2.748  -1.213  1.00  0.00           H  
HETATM   43  H   UNL     1       7.429   3.457   0.324  1.00  0.00           H  
HETATM   44  H   UNL     1       8.228   1.867   0.313  1.00  0.00           H  
HETATM   45  H   UNL     1       3.299   2.881   0.878  1.00  0.00           H  
HETATM   46  H   UNL     1       1.027   1.988   0.612  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.985   0.954  -2.079  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.259   0.050  -2.348  1.00  0.00           H  
CONECT    1    2    2   27   28                                       
CONECT    2    1    1    3   29                                       
CONECT    3    2    4    4   30                                       
CONECT    4    3    3    5   26                                       
CONECT    5    4    6   31   32                                       
CONECT    6    5    7   33   34                                       
CONECT    7    6    8   35                                            
CONECT    8    7    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   11   36                                       
CONECT   11   10   10   12   37                                       
CONECT   12   11   13   25   25                                       
CONECT   13   12   14   14   38                                       
CONECT   14   13   13   15   19                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   39   40   41                                       
CONECT   19   14   20   24   24                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   22   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   42   43   44                                       
CONECT   24   19   19   25   45                                       
CONECT   25   12   12   24   46                                       
CONECT   26    4   27   27   47                                       
CONECT   27    1   26   26   48                                       
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
