COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O5* UNL     1      -2.219   1.005  -4.305  1.00  0.00           O  
HETATM    2  C5* UNL     1      -1.230  -0.019  -4.187  1.00  0.00           C  
HETATM    3  C4* UNL     1      -0.216   0.372  -3.110  1.00  0.00           C  
HETATM    4  O4* UNL     1      -0.869   0.506  -1.829  1.00  0.00           O  
HETATM    5  C3* UNL     1       0.820  -0.755  -2.908  1.00  0.00           C  
HETATM    6  O3* UNL     1       2.018  -0.470  -3.633  1.00  0.00           O  
HETATM    7  C2* UNL     1       1.092  -0.748  -1.386  1.00  0.00           C  
HETATM    8  O2* UNL     1       2.467  -0.461  -1.124  1.00  0.00           O  
HETATM    9  C1* UNL     1       0.184   0.380  -0.850  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.372   0.012   0.453  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.529  -0.674   0.671  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.721  -0.827   1.948  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.699  -0.255   2.632  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.399  -0.115   3.998  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.240  -0.640   4.973  1.00  0.00           N  
HETATM   16  C   UNL     1       0.766   0.559   4.345  1.00  0.00           C  
HETATM   17  C   UNL     1       1.579   1.068   3.349  1.00  0.00           C  
HETATM   18  N   UNL     1       1.274   0.928   2.074  1.00  0.00           N  
HETATM   19  C   UNL     1       0.176   0.295   1.685  1.00  0.00           C  
HETATM   20  H5* UNL     1      -2.837   0.720  -4.992  1.00  0.00           H  
HETATM   21 H5*1 UNL     1      -0.718  -0.141  -5.141  1.00  0.00           H  
HETATM   22 H5*2 UNL     1      -1.710  -0.957  -3.909  1.00  0.00           H  
HETATM   23  H4* UNL     1       0.283   1.302  -3.381  1.00  0.00           H  
HETATM   24  H3* UNL     1       0.406  -1.714  -3.219  1.00  0.00           H  
HETATM   25  H3* UNL     1       1.775  -0.426  -4.568  1.00  0.00           H  
HETATM   26  H2* UNL     1       0.811  -1.704  -0.943  1.00  0.00           H  
HETATM   27  H2* UNL     1       2.983  -1.168  -1.534  1.00  0.00           H  
HETATM   28  H1* UNL     1       0.744   1.313  -0.772  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.188  -1.037  -0.103  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.018  -0.538   5.911  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.052  -1.104   4.715  1.00  0.00           H  
HETATM   32  H   UNL     1       1.033   0.684   5.384  1.00  0.00           H  
HETATM   33  H   UNL     1       2.483   1.591   3.622  1.00  0.00           H  
CONECT    1    2   20                                                 
CONECT    2    1    3   21   22                                       
CONECT    3    2    4    5   23                                       
CONECT    4    3    9                                                 
CONECT    5    3    6    7   24                                       
CONECT    6    5   25                                                 
CONECT    7    5    8    9   26                                       
CONECT    8    7   27                                                 
CONECT    9    4    7   10   28                                       
CONECT   10    9   11   19                                            
CONECT   11   10   12   12   29                                       
CONECT   12   11   11   13                                            
CONECT   13   12   14   19   19                                       
CONECT   14   13   15   16   16                                       
CONECT   15   14   30   31                                            
CONECT   16   14   14   17   32                                       
CONECT   17   16   18   18   33                                       
CONECT   18   17   17   19                                            
CONECT   19   10   13   13   18                                       
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29   11                                                      
CONECT   30   15                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
