COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.119   1.567  -0.001  1.00  0.00           O  
HETATM    2  C   UNL     1       1.230   0.357  -0.007  1.00  0.00           C  
HETATM    3  C   UNL     1       2.509  -0.232  -0.008  1.00  0.00           C  
HETATM    4  C   UNL     1       3.616   0.551  -0.007  1.00  0.00           C  
HETATM    5  C   UNL     1       4.949  -0.063  -0.008  1.00  0.00           C  
HETATM    6  C   UNL     1       6.094   0.743  -0.007  1.00  0.00           C  
HETATM    7  C   UNL     1       7.345   0.160  -0.008  1.00  0.00           C  
HETATM    8  O   UNL     1       8.459   0.939  -0.007  1.00  0.00           O  
HETATM    9  C   UNL     1       8.260   2.355  -0.006  1.00  0.00           C  
HETATM   10  C   UNL     1       7.467  -1.230  -0.009  1.00  0.00           C  
HETATM   11  O   UNL     1       8.699  -1.802  -0.010  1.00  0.00           O  
HETATM   12  C   UNL     1       6.332  -2.031  -0.009  1.00  0.00           C  
HETATM   13  C   UNL     1       5.080  -1.458  -0.003  1.00  0.00           C  
HETATM   14  C   UNL     1       0.000  -0.513  -0.008  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.230   0.357   0.000  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.119   1.567   0.005  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.509  -0.232   0.001  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.616   0.551   0.008  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.949  -0.063   0.009  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.094   0.743   0.010  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.345   0.160   0.010  1.00  0.00           C  
HETATM   22  O   UNL     1      -8.459   0.940   0.012  1.00  0.00           O  
HETATM   23  C   UNL     1      -8.260   2.355   0.012  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.467  -1.230   0.009  1.00  0.00           C  
HETATM   25  O   UNL     1      -8.699  -1.801   0.009  1.00  0.00           O  
HETATM   26  C   UNL     1      -6.332  -2.031   0.008  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.080  -1.458   0.003  1.00  0.00           C  
HETATM   28  H   UNL     1       2.608  -1.307  -0.008  1.00  0.00           H  
HETATM   29  H   UNL     1       3.517   1.626  -0.007  1.00  0.00           H  
HETATM   30  H   UNL     1       5.999   1.819  -0.007  1.00  0.00           H  
HETATM   31  H   UNL     1       7.701   2.644  -0.896  1.00  0.00           H  
HETATM   32  H   UNL     1       7.701   2.642   0.884  1.00  0.00           H  
HETATM   33  H   UNL     1       9.228   2.857  -0.005  1.00  0.00           H  
HETATM   34  H   UNL     1       9.056  -1.968   0.874  1.00  0.00           H  
HETATM   35  H   UNL     1       6.432  -3.106  -0.010  1.00  0.00           H  
HETATM   36  H   UNL     1       4.200  -2.083  -0.003  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.003  -1.138  -0.900  1.00  0.00           H  
HETATM   38  H   UNL     1       0.003  -1.146   0.879  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.608  -1.307  -0.004  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.517   1.626   0.012  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.999   1.819   0.011  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.702   2.644  -0.878  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.228   2.857   0.013  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.701   2.643   0.902  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.056  -1.966  -0.874  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.432  -3.106   0.007  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.200  -2.083  -0.002  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3   14    1    1                                       
CONECT    3    4    4    2   28                                       
CONECT    4    5    3    3   29                                       
CONECT    5    6    6   13    4                                       
CONECT    6    7    5    5   30                                       
CONECT    7    8   10   10    6                                       
CONECT    8    9    7                                                 
CONECT    9    8   31   32   33                                       
CONECT   10   11    7    7   12                                       
CONECT   11   10   34                                                 
CONECT   12   10   13   13   35                                       
CONECT   13   12   12    5   36                                       
CONECT   14    2   15   37   38                                       
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   18   39                                       
CONECT   18   17   17   19   40                                       
CONECT   19   20   18   27   27                                       
CONECT   20   21   21   19   41                                       
CONECT   21   22   20   20   24                                       
CONECT   22   23   21                                                 
CONECT   23   22   42   43   44                                       
CONECT   24   21   25   26   26                                       
CONECT   25   24   45                                                 
CONECT   26   24   24   27   46                                       
CONECT   27   19   19   26   47                                       
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    6                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   20                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   23                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
