COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O5* UNL     1       2.572   0.452  -3.637  1.00  0.00           O  
HETATM    2  C5* UNL     1       1.181   0.775  -3.598  1.00  0.00           C  
HETATM    3  C4* UNL     1       0.420  -0.332  -2.866  1.00  0.00           C  
HETATM    4  O4* UNL     1       0.809  -0.386  -1.474  1.00  0.00           O  
HETATM    5  C3* UNL     1      -1.093  -0.008  -2.809  1.00  0.00           C  
HETATM    6  O3* UNL     1      -1.758  -0.464  -3.989  1.00  0.00           O  
HETATM    7  C2* UNL     1      -1.551  -0.815  -1.570  1.00  0.00           C  
HETATM    8  C1* UNL     1      -0.255  -1.046  -0.769  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.391  -0.478   0.573  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.637   0.833   0.715  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.845   1.508  -0.273  1.00  0.00           O  
HETATM   12  N   UNL     1      -0.658   1.418   1.924  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.201   0.774   3.014  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.303   1.287   4.109  1.00  0.00           O  
HETATM   15  C   UNL     1       0.433  -0.585   2.874  1.00  0.00           C  
HETATM   16  C   UNL     1       0.277  -1.360   4.184  1.00  0.00           C  
HETATM   17  O   UNL     1       1.821  -0.435   2.569  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.258  -1.350   1.742  1.00  0.00           C  
HETATM   19  H5* UNL     1       3.014   1.173  -4.106  1.00  0.00           H  
HETATM   20 H5*1 UNL     1       0.801   0.864  -4.616  1.00  0.00           H  
HETATM   21 H5*2 UNL     1       1.041   1.720  -3.074  1.00  0.00           H  
HETATM   22  H4* UNL     1       0.589  -1.295  -3.347  1.00  0.00           H  
HETATM   23  H3* UNL     1      -1.258   1.058  -2.660  1.00  0.00           H  
HETATM   24  H3* UNL     1      -2.704  -0.318  -3.851  1.00  0.00           H  
HETATM   25 H2*1 UNL     1      -1.986  -1.767  -1.874  1.00  0.00           H  
HETATM   26 H2*2 UNL     1      -2.265  -0.239  -0.981  1.00  0.00           H  
HETATM   27  H1* UNL     1      -0.047  -2.114  -0.701  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.007   2.319   2.013  1.00  0.00           H  
HETATM   29  H   UNL     1       0.768  -0.814   4.989  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.781  -1.474   4.415  1.00  0.00           H  
HETATM   31  H   UNL     1       0.735  -2.344   4.080  1.00  0.00           H  
HETATM   32  H   UNL     1       2.217   0.051   3.305  1.00  0.00           H  
HETATM   33  H   UNL     1       0.336  -2.224   1.478  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.247  -1.669   2.071  1.00  0.00           H  
CONECT    1    2   19                                                 
CONECT    2    1    3   20   21                                       
CONECT    3    2    4    5   22                                       
CONECT    4    3    8                                                 
CONECT    5    3    6    7   23                                       
CONECT    6    5   24                                                 
CONECT    7    5    8   25   26                                       
CONECT    8    4    7    9   27                                       
CONECT    9    8   10   18                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   28                                            
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   17   18                                       
CONECT   16   15   29   30   31                                       
CONECT   17   15   32                                                 
CONECT   18    9   15   33   34                                       
CONECT   19    1                                                      
CONECT   20    2                                                      
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28   12                                                      
CONECT   29   16                                                      
CONECT   30   16                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   18                                                      
CONECT   34   18                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
