COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C1* UNL     1       1.189   0.383  -0.421  1.00  0.00           C  
HETATM    2  N   UNL     1      -0.179  -0.104  -0.223  1.00  0.00           N  
HETATM    3  O4* UNL     1       2.083  -0.715  -0.705  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.301   0.671  -0.313  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.506   1.972  -0.575  1.00  0.00           N  
HETATM    6  O2* UNL     1       1.388   2.352   1.030  1.00  0.00           O  
HETATM    7  C   UNL     1      -2.707   2.476  -0.603  1.00  0.00           C  
HETATM    8  N   UNL     1      -3.815   1.727  -0.372  1.00  0.00           N  
HETATM    9  O3* UNL     1       3.845   2.055   0.226  1.00  0.00           O  
HETATM   10  C   UNL     1      -3.699   0.407  -0.101  1.00  0.00           C  
HETATM   11  N   UNL     1      -3.203  -3.621   0.721  1.00  0.00           N  
HETATM   12  C   UNL     1      -2.403  -0.153  -0.067  1.00  0.00           C  
HETATM   13  O   UNL     1      -4.684  -0.279   0.109  1.00  0.00           O  
HETATM   14  C   UNL     1      -1.863  -1.497   0.182  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.508  -1.390   0.070  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.611  -2.681   0.483  1.00  0.00           C  
HETATM   17  C2* UNL     1       1.752   0.977   0.895  1.00  0.00           C  
HETATM   18  C3* UNL     1       3.280   0.828   0.690  1.00  0.00           C  
HETATM   19  C4* UNL     1       3.411  -0.268  -0.386  1.00  0.00           C  
HETATM   20  C5* UNL     1       4.237  -1.435   0.158  1.00  0.00           C  
HETATM   21  O5* UNL     1       4.438  -2.399  -0.877  1.00  0.00           O  
HETATM   22  H1* UNL     1       1.222   1.122  -1.221  1.00  0.00           H  
HETATM   23  H2* UNL     1       1.718   2.769   1.839  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.826   3.528  -0.817  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.693   2.140  -0.402  1.00  0.00           H  
HETATM   26  H3* UNL     1       4.800   2.019   0.081  1.00  0.00           H  
HETATM   27  H   UNL     1       0.194  -2.202   0.192  1.00  0.00           H  
HETATM   28  H2* UNL     1       1.417   0.401   1.757  1.00  0.00           H  
HETATM   29  H3* UNL     1       3.760   0.512   1.617  1.00  0.00           H  
HETATM   30  H4* UNL     1       3.888   0.143  -1.276  1.00  0.00           H  
HETATM   31 H5*1 UNL     1       5.202  -1.067   0.504  1.00  0.00           H  
HETATM   32 H5*2 UNL     1       3.706  -1.899   0.989  1.00  0.00           H  
HETATM   33  H5* UNL     1       4.955  -3.169  -0.602  1.00  0.00           H  
CONECT    1    2   17    3   22                                       
CONECT    2    4   15    1                                            
CONECT    3    1   19                                                 
CONECT    4    5   12   12    2                                       
CONECT    5    7    7    4                                            
CONECT    6   17   23                                                 
CONECT    7    8    5    5   24                                       
CONECT    8    7   10   25                                            
CONECT    9   18   26                                                 
CONECT   10    8   13   13   12                                       
CONECT   11   16   16   16                                            
CONECT   12   10    4    4   14                                       
CONECT   13   10   10                                                 
CONECT   14   12   16   15   15                                       
CONECT   15   14   14    2   27                                       
CONECT   16   11   11   11   14                                       
CONECT   17    1    6   18   28                                       
CONECT   18   17   19    9   29                                       
CONECT   19    3   18   20   30                                       
CONECT   20   19   21   31   32                                       
CONECT   21   20   33                                                 
CONECT   22    1                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    9                                                      
CONECT   27   15                                                      
CONECT   28   17                                                      
CONECT   29   18                                                      
CONECT   30   19                                                      
CONECT   31   20                                                      
CONECT   32   20                                                      
CONECT   33   21                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
