COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.757   0.196   0.146  1.00  0.00           C  
HETATM    2  N   UNL     1       1.650   0.109   0.303  1.00  0.00           N  
HETATM    3  C   UNL     1      -1.982  -0.452   0.119  1.00  0.00           C  
HETATM    4  C   UNL     1       0.412  -0.541   0.274  1.00  0.00           C  
HETATM    5  C   UNL     1       2.736  -0.486  -0.230  1.00  0.00           C  
HETATM    6  C   UNL     1       4.055   0.142  -0.098  1.00  0.00           C  
HETATM    7  C   UNL     1       5.630   1.569   0.445  1.00  0.00           C  
HETATM    8  C   UNL     1       6.231   0.567  -0.233  1.00  0.00           C  
HETATM    9  C   UNL     1       5.230  -0.351  -0.588  1.00  0.00           C  
HETATM   10  O   UNL     1       4.318   1.310   0.522  1.00  0.00           O  
HETATM   11  O   UNL     1       2.622  -1.544  -0.820  1.00  0.00           O  
HETATM   12  C   UNL     1       0.351  -1.925   0.374  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.164   0.289  -0.017  1.00  0.00           N  
HETATM   14  C   UNL     1      -4.405  -0.231  -0.056  1.00  0.00           C  
HETATM   15  O   UNL     1      -4.683  -1.410   0.021  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.872  -2.568   0.346  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.037  -1.836   0.225  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.233   1.628  -0.122  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.655   2.015  -0.248  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.372   0.879  -0.207  1.00  0.00           C  
HETATM   21  O   UNL     1      -2.288   2.390  -0.116  1.00  0.00           O  
HETATM   22  H   UNL     1      -0.711   1.272   0.063  1.00  0.00           H  
HETATM   23  H   UNL     1       1.727   0.988   0.706  1.00  0.00           H  
HETATM   24  H   UNL     1       6.125   2.436   0.857  1.00  0.00           H  
HETATM   25  H   UNL     1       7.284   0.488  -0.460  1.00  0.00           H  
HETATM   26  H   UNL     1       5.364  -1.269  -1.140  1.00  0.00           H  
HETATM   27  H   UNL     1       1.260  -2.500   0.474  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.917  -3.644   0.424  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.991  -2.341   0.204  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.044   3.017  -0.349  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.446   0.793  -0.269  1.00  0.00           H  
CONECT    1    4    3    3   22                                       
CONECT    2    5    4   23                                            
CONECT    3    1    1   17   13                                       
CONECT    4    2   12   12    1                                       
CONECT    5    6   11   11    2                                       
CONECT    6   10    9    9    5                                       
CONECT    7    8    8   10   24                                       
CONECT    8    7    7    9   25                                       
CONECT    9    8    6    6   26                                       
CONECT   10    7    6                                                 
CONECT   11    5    5                                                 
CONECT   12    4    4   16   27                                       
CONECT   13    3   18   14                                            
CONECT   14   13   20   15   15                                       
CONECT   15   14   14                                                 
CONECT   16   12   17   17   28                                       
CONECT   17   16   16    3   29                                       
CONECT   18   21   21   13   19                                       
CONECT   19   18   20   20   30                                       
CONECT   20   19   19   14   31                                       
CONECT   21   18   18                                                 
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    9                                                      
CONECT   27   12                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   19                                                      
CONECT   31   20                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
