COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.745  -1.230   0.893  1.00  0.00           C  
HETATM    2  C   UNL     1       0.293  -0.109   1.831  1.00  0.00           C  
HETATM    3  N   UNL     1      -0.009  -0.669   3.151  1.00  0.00           N  
HETATM    4  C   UNL     1       0.161   0.080   4.257  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.150  -0.496   5.614  1.00  0.00           C  
HETATM    6  O   UNL     1       0.567   1.219   4.161  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.691   0.069  -3.715  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.402   0.585  -4.925  1.00  0.00           O  
HETATM    9  O   UNL     1      -1.818  -0.315  -3.472  1.00  0.00           O  
HETATM   10  B   UNL     1      -0.991   0.577   1.246  1.00  0.00           B  
HETATM   11  O   UNL     1      -2.169  -0.186   1.032  1.00  0.00           O  
HETATM   12  C   UNL     1       2.335  -0.213  -0.748  1.00  0.00           C  
HETATM   13  C   UNL     1       1.057  -0.653  -0.463  1.00  0.00           C  
HETATM   14  C   UNL     1       2.632   0.317  -1.993  1.00  0.00           C  
HETATM   15  C   UNL     1       0.062  -0.570  -1.426  1.00  0.00           C  
HETATM   16  C   UNL     1       1.655   0.412  -2.960  1.00  0.00           C  
HETATM   17  C   UNL     1       0.358  -0.028  -2.685  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.975   1.961   0.932  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.192  -1.002  -1.147  1.00  0.00           O  
HETATM   20  H   UNL     1       1.637  -1.706   1.299  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.050  -1.968   0.799  1.00  0.00           H  
HETATM   22  H   UNL     1       1.089   0.629   1.925  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.334  -1.580   3.228  1.00  0.00           H  
HETATM   24  H   UNL     1       0.048   0.252   6.381  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.200  -0.786   5.653  1.00  0.00           H  
HETATM   26  H   UNL     1       0.475  -1.371   5.790  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.091   0.649  -5.601  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.832   0.418   0.672  1.00  0.00           H  
HETATM   29  H   UNL     1       3.107  -0.284   0.003  1.00  0.00           H  
HETATM   30  H   UNL     1       3.634   0.658  -2.206  1.00  0.00           H  
HETATM   31  H   UNL     1       1.891   0.827  -3.928  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.091   2.288   1.149  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.229  -1.935  -1.401  1.00  0.00           H  
CONECT    1    2   13   20   21                                       
CONECT    2    1    3   10   22                                       
CONECT    3    2    4   23                                            
CONECT    4    3    5    6    6                                       
CONECT    5    4   24   25   26                                       
CONECT    6    4    4                                                 
CONECT    7    8    9    9   17                                       
CONECT    8    7   27                                                 
CONECT    9    7    7                                                 
CONECT   10    2   11   18                                            
CONECT   11   10   28                                                 
CONECT   12   13   13   14   29                                       
CONECT   13    1   12   12   15                                       
CONECT   14   12   16   16   30                                       
CONECT   15   13   17   17   19                                       
CONECT   16   14   14   17   31                                       
CONECT   17    7   15   15   16                                       
CONECT   18   10   32                                                 
CONECT   19   15   33                                                 
CONECT   20    1                                                      
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    5                                                      
CONECT   25    5                                                      
CONECT   26    5                                                      
CONECT   27    8                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   14                                                      
CONECT   31   16                                                      
CONECT   32   18                                                      
CONECT   33   19                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
