COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.670  12.177   4.899  1.00  0.00           O  
HETATM    2  C   UNL     1       4.367  13.417   4.475  1.00  0.00           C  
HETATM    3  O   UNL     1       3.948  14.225   5.279  1.00  0.00           O  
HETATM    4  C   UNL     1       4.540  13.798   3.055  1.00  0.00           C  
HETATM    5  C   UNL     1       5.074  12.993   2.016  1.00  0.00           C  
HETATM    6  N   UNL     1       5.062  13.698   0.909  1.00  0.00           N  
HETATM    7  N   UNL     1       4.522  14.971   1.176  1.00  0.00           N  
HETATM    8  C   UNL     1       4.218  15.023   2.491  1.00  0.00           C  
HETATM    9  C   UNL     1       4.354  16.024   0.246  1.00  0.00           C  
HETATM   10  C   UNL     1       3.384  17.013   0.451  1.00  0.00           C  
HETATM   11  C   UNL     1       3.246  18.048  -0.457  1.00  0.00           C  
HETATM   12  C   UNL     1       4.061  18.113  -1.578  1.00  0.00           C  
HETATM   13  C   UNL     1       5.021  17.136  -1.796  1.00  0.00           C  
HETATM   14  C   UNL     1       5.170  16.099  -0.884  1.00  0.00           C  
HETATM   15  H   UNL     1       4.500  12.110   5.831  1.00  0.00           H  
HETATM   16  H   UNL     1       5.428  11.978   2.118  1.00  0.00           H  
HETATM   17  H   UNL     1       3.798  15.870   3.012  1.00  0.00           H  
HETATM   18  H   UNL     1       2.743  16.968   1.319  1.00  0.00           H  
HETATM   19  H   UNL     1       5.924  15.344  -1.051  1.00  0.00           H  
HETATM   20  H   UNL     1       2.499  18.810  -0.292  1.00  0.00           H  
HETATM   21  H   UNL     1       3.948  18.925  -2.281  1.00  0.00           H  
HETATM   22  H   UNL     1       5.651  17.181  -2.672  1.00  0.00           H  
CONECT    1    2   15                                                 
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    8    8                                       
CONECT    5    4    6    6   16                                       
CONECT    6    5    5    7                                            
CONECT    7    6    8    9                                            
CONECT    8    4    4    7   17                                       
CONECT    9    7   10   14   14                                       
CONECT   10    9   11   11   18                                       
CONECT   11   10   10   12   20                                       
CONECT   12   11   13   13   21                                       
CONECT   13   12   12   14   22                                       
CONECT   14    9    9   13   19                                       
CONECT   15    1                                                      
CONECT   16    5                                                      
CONECT   17    8                                                      
CONECT   18   10                                                      
CONECT   19   14                                                      
CONECT   20   11                                                      
CONECT   21   12                                                      
CONECT   22   13                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
