COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  I   UNL     1       3.188  -0.931  -0.130  1.00  0.00           I  
HETATM    2  N   UNL     1      -2.435   0.041  -0.450  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.688  -0.457   0.775  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.906  -0.236   1.684  1.00  0.00           O  
HETATM    5  N   UNL     1      -3.777  -1.186   1.009  1.00  0.00           N  
HETATM    6  C   UNL     1      -4.643  -1.441   0.038  1.00  0.00           C  
HETATM    7  N   UNL     1      -5.765  -2.196   0.292  1.00  0.00           N  
HETATM    8  C   UNL     1      -4.408  -0.935  -1.257  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.299  -0.190  -1.478  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.229   0.841  -0.678  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.257   2.116   0.193  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.705   3.236  -0.573  1.00  0.00           O  
HETATM   13  C   UNL     1       0.214   2.309   0.624  1.00  0.00           C  
HETATM   14  O   UNL     1       0.719   3.554   0.137  1.00  0.00           O  
HETATM   15  C   UNL     1       0.957   1.127  -0.037  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.058   0.119  -0.237  1.00  0.00           O  
HETATM   17  C   UNL     1       2.054   0.602   0.890  1.00  0.00           C  
HETATM   18  H   UNL     1      -5.925  -2.543   1.184  1.00  0.00           H  
HETATM   19  H   UNL     1      -6.397  -2.381  -0.420  1.00  0.00           H  
HETATM   20  H   UNL     1      -5.104  -1.134  -2.058  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.098   0.210  -2.461  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.140   1.101  -1.732  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.896   1.970   1.064  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.742   4.064  -0.076  1.00  0.00           H  
HETATM   25  H   UNL     1       0.304   2.260   1.709  1.00  0.00           H  
HETATM   26  H   UNL     1       1.640   3.727   0.378  1.00  0.00           H  
HETATM   27  H   UNL     1       1.382   1.433  -0.993  1.00  0.00           H  
HETATM   28  H   UNL     1       1.601   0.181   1.788  1.00  0.00           H  
HETATM   29  H   UNL     1       2.718   1.421   1.168  1.00  0.00           H  
CONECT    1   17                                                      
CONECT    2    9    3   10                                            
CONECT    3    2    5    4    4                                       
CONECT    4    3    3                                                 
CONECT    5    3    6    6                                            
CONECT    6    5    5    8    7                                       
CONECT    7    6   18   19                                            
CONECT    8    6    9    9   20                                       
CONECT    9    2    8    8   21                                       
CONECT   10    2   11   16   22                                       
CONECT   11   10   12   13   23                                       
CONECT   12   11   24                                                 
CONECT   13   11   14   15   25                                       
CONECT   14   13   26                                                 
CONECT   15   13   17   16   27                                       
CONECT   16   10   15                                                 
CONECT   17    1   15   28   29                                       
CONECT   18    7                                                      
CONECT   19    7                                                      
CONECT   20    8                                                      
CONECT   21    9                                                      
CONECT   22   10                                                      
CONECT   23   11                                                      
CONECT   24   12                                                      
CONECT   25   13                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28   17                                                      
CONECT   29   17                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
