COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.125   0.166  -3.340  1.00  0.00           C  
HETATM    2  O   UNL     1       0.859   0.337  -4.031  1.00  0.00           O  
HETATM    3  O   UNL     1      -1.348   0.145  -3.905  1.00  0.00           O  
HETATM    4  C   UNL     1       0.018  -0.017  -1.884  1.00  0.00           C  
HETATM    5  C   UNL     1       1.286   0.004  -1.297  1.00  0.00           C  
HETATM    6  C   UNL     1       1.418  -0.167   0.068  1.00  0.00           C  
HETATM    7  N   UNL     1       2.688  -0.146   0.656  1.00  0.00           N  
HETATM    8  C   UNL     1       0.285  -0.363   0.859  1.00  0.00           C  
HETATM    9  N   UNL     1       0.420  -0.537   2.240  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.172   0.324   3.089  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.823   1.251   2.656  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.027   0.136   4.578  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.978  -0.390   0.275  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.080  -0.580   1.048  1.00  0.00           O  
HETATM   15  C   UNL     1      -1.114  -0.212  -1.089  1.00  0.00           C  
HETATM   16  H   UNL     1      -1.442   0.266  -4.859  1.00  0.00           H  
HETATM   17  H   UNL     1       2.162   0.155  -1.910  1.00  0.00           H  
HETATM   18  H   UNL     1       3.475  -0.010   0.106  1.00  0.00           H  
HETATM   19  H   UNL     1       2.780  -0.267   1.614  1.00  0.00           H  
HETATM   20  H   UNL     1       0.940  -1.279   2.587  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.571   0.924   5.098  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.433  -0.834   4.862  1.00  0.00           H  
HETATM   23  H   UNL     1       1.027   0.183   4.849  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.237  -1.534   1.081  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.095  -0.229  -1.540  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   16                                                 
CONECT    4    1    5    5   15                                       
CONECT    5    4    4    6   17                                       
CONECT    6    5    7    8    8                                       
CONECT    7    6   18   19                                            
CONECT    8    6    6    9   13                                       
CONECT    9    8   10   20                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   21   22   23                                       
CONECT   13    8   14   15   15                                       
CONECT   14   13   24                                                 
CONECT   15    4   13   13   25                                       
CONECT   16    3                                                      
CONECT   17    5                                                      
CONECT   18    7                                                      
CONECT   19    7                                                      
CONECT   20    9                                                      
CONECT   21   12                                                      
CONECT   22   12                                                      
CONECT   23   12                                                      
CONECT   24   14                                                      
CONECT   25   15                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
