COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.732   2.031  -0.004  1.00  0.00           C  
HETATM    2  C   UNL     1       3.118   0.654  -0.001  1.00  0.00           C  
HETATM    3  N   UNL     1       3.898  -0.408   0.005  1.00  0.00           N  
HETATM    4  C   UNL     1       3.418  -1.639   0.008  1.00  0.00           C  
HETATM    5  C   UNL     1       2.059  -1.872   0.004  1.00  0.00           C  
HETATM    6  C   UNL     1       1.192  -0.780  -0.002  1.00  0.00           C  
HETATM    7  C   UNL     1       1.736   0.516   0.001  1.00  0.00           C  
HETATM    8  N   UNL     1       0.693   1.423  -0.001  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.521   0.759   0.002  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.835   1.214   0.002  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.270  -0.623  -0.008  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.332  -1.525  -0.008  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.628  -1.060  -0.014  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.880   0.308   0.004  1.00  0.00           C  
HETATM   15  O   UNL     1      -4.163   0.758   0.004  1.00  0.00           O  
HETATM   16  C   UNL     1      -5.196  -0.228   0.007  1.00  0.00           C  
HETATM   17  H   UNL     1       3.883   2.359  -1.033  1.00  0.00           H  
HETATM   18  H   UNL     1       3.065   2.727   0.505  1.00  0.00           H  
HETATM   19  H   UNL     1       4.691   2.002   0.512  1.00  0.00           H  
HETATM   20  H   UNL     1       4.101  -2.476   0.014  1.00  0.00           H  
HETATM   21  H   UNL     1       1.674  -2.881   0.006  1.00  0.00           H  
HETATM   22  H   UNL     1       0.797   2.388  -0.003  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.039   2.274   0.000  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.139  -2.588  -0.004  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.451  -1.759  -0.015  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.105  -0.853  -0.882  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.104  -0.849   0.898  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.169   0.264   0.007  1.00  0.00           H  
CONECT    1    2   17   18   19                                       
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4                                            
CONECT    4    3    5    5   20                                       
CONECT    5    4    4    6   21                                       
CONECT    6    5    7    7   11                                       
CONECT    7    2    6    6    8                                       
CONECT    8    7    9   22                                            
CONECT    9    8   10   10   11                                       
CONECT   10    9    9   14   23                                       
CONECT   11    6    9   12   12                                       
CONECT   12   11   11   13   24                                       
CONECT   13   12   14   14   25                                       
CONECT   14   10   13   13   15                                       
CONECT   15   14   16                                                 
CONECT   16   15   26   27   28                                       
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    8                                                      
CONECT   23   10                                                      
CONECT   24   12                                                      
CONECT   25   13                                                      
CONECT   26   16                                                      
CONECT   27   16                                                      
CONECT   28   16                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
