COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.124   0.081   2.744  1.00  0.00           C  
HETATM    2  O   UNL     1       0.835   0.080   3.477  1.00  0.00           O  
HETATM    3  O   UNL     1      -1.337  -0.231   3.227  1.00  0.00           O  
HETATM    4  C   UNL     1       0.038   0.435   1.288  1.00  0.00           C  
HETATM    5  O   UNL     1       1.411   0.727   1.020  1.00  0.00           O  
HETATM    6  C   UNL     1      -0.410  -0.744   0.424  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.246  -0.391  -1.031  1.00  0.00           C  
HETATM    8  C   UNL     1       0.942  -0.666  -1.680  1.00  0.00           C  
HETATM    9  C   UNL     1       1.092  -0.342  -3.016  1.00  0.00           C  
HETATM   10  C   UNL     1       0.052   0.257  -3.702  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.136   0.531  -3.054  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.287   0.203  -1.719  1.00  0.00           C  
HETATM   13  H   UNL     1      -1.442  -0.458   4.161  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.570   1.308   1.056  1.00  0.00           H  
HETATM   15  H   UNL     1       1.914  -0.069   1.239  1.00  0.00           H  
HETATM   16  H   UNL     1       0.199  -1.618   0.656  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.457  -0.967   0.628  1.00  0.00           H  
HETATM   18  H   UNL     1       1.754  -1.134  -1.144  1.00  0.00           H  
HETATM   19  H   UNL     1       2.021  -0.556  -3.522  1.00  0.00           H  
HETATM   20  H   UNL     1       0.170   0.511  -4.745  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.948   1.000  -3.590  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.217   0.418  -1.213  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   13                                                 
CONECT    4    1    5    6   14                                       
CONECT    5    4   15                                                 
CONECT    6    4    7   16   17                                       
CONECT    7    6    8    8   12                                       
CONECT    8    7    7    9   18                                       
CONECT    9    8   10   10   19                                       
CONECT   10    9    9   11   20                                       
CONECT   11   10   12   12   21                                       
CONECT   12    7   11   11   22                                       
CONECT   13    3                                                      
CONECT   14    4                                                      
CONECT   15    5                                                      
CONECT   16    6                                                      
CONECT   17    6                                                      
CONECT   18    8                                                      
CONECT   19    9                                                      
CONECT   20   10                                                      
CONECT   21   11                                                      
CONECT   22   12                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
