COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.423   1.823   0.504  1.00  0.00           C  
HETATM    2  C   UNL     1       0.124   1.951  -0.295  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.827   2.940   0.407  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.101   2.106   0.687  1.00  0.00           C  
HETATM    5  O   UNL     1      -1.128   4.040  -0.453  1.00  0.00           O  
HETATM    6  O   UNL     1      -0.544   0.680  -0.348  1.00  0.00           O  
HETATM    7  C   UNL     1      -1.963   0.948  -0.334  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.279   2.874   0.431  1.00  0.00           O  
HETATM    9  C   UNL     1      -2.220  -1.245   0.889  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.586  -2.275   0.366  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.293  -1.737   0.482  1.00  0.00           C  
HETATM   12  N   UNL     1      -4.986   0.086  -0.843  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.020  -0.516  -0.156  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.190  -0.455  -0.927  1.00  0.00           C  
HETATM   15  N   UNL     1      -7.170   0.202  -1.653  1.00  0.00           N  
HETATM   16  N   UNL     1      -6.491  -1.606  -0.339  1.00  0.00           N  
HETATM   17  N   UNL     1      -5.909  -3.475   0.974  1.00  0.00           N  
HETATM   18  N   UNL     1      -3.152  -2.127   1.101  1.00  0.00           N  
HETATM   19  N   UNL     1      -2.706  -0.230   0.118  1.00  0.00           N  
HETATM   20  O   UNL     1       3.701   0.052   1.704  1.00  0.00           O  
HETATM   21  O   UNL     1       5.213  -2.795   0.290  1.00  0.00           O  
HETATM   22  O   UNL     1       4.698   1.969   0.400  1.00  0.00           O  
HETATM   23  O   UNL     1       6.279  -1.883  -1.934  1.00  0.00           O  
HETATM   24  O   UNL     1       4.505  -0.438  -0.638  1.00  0.00           O  
HETATM   25  O   UNL     1       6.812  -0.842   0.303  1.00  0.00           O  
HETATM   26  O   UNL     1       2.337   0.984  -0.204  1.00  0.00           O  
HETATM   27  P   UNL     1       3.808   0.629   0.345  1.00  0.00           P  
HETATM   28  P   UNL     1       5.726  -1.475  -0.477  1.00  0.00           P  
HETATM   29  H   UNL     1       1.866   2.810   0.639  1.00  0.00           H  
HETATM   30  H   UNL     1       1.208   1.385   1.479  1.00  0.00           H  
HETATM   31  H   UNL     1       0.343   2.298  -1.305  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.389   3.295   1.340  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.101   1.727   1.709  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.724   4.694  -0.062  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.304   1.264  -1.320  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.364   3.661   0.986  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.211  -1.304   1.271  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.968   1.045  -2.088  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.059  -0.180  -1.725  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.805  -3.837   0.887  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.240  -3.955   1.486  1.00  0.00           H  
HETATM   42  H   UNL     1       4.499  -3.262  -0.166  1.00  0.00           H  
HETATM   43  H   UNL     1       4.810   2.402  -0.457  1.00  0.00           H  
HETATM   44  H   UNL     1       7.017  -2.507  -1.914  1.00  0.00           H  
CONECT    1   26    2   29   30                                       
CONECT    2    1    6    3   31                                       
CONECT    3    2    5    4   32                                       
CONECT    4    3    7    8   33                                       
CONECT    5    3   34                                                 
CONECT    6    2    7                                                 
CONECT    7    6    4   19   35                                       
CONECT    8    4   36                                                 
CONECT    9   18   18   19   37                                       
CONECT   10   11   17   16   16                                       
CONECT   11   18   13   13   10                                       
CONECT   12   13   14   14                                            
CONECT   13   19   11   11   12                                       
CONECT   14   12   12   16   15                                       
CONECT   15   14   38   39                                            
CONECT   16   10   10   14                                            
CONECT   17   10   40   41                                            
CONECT   18    9    9   11                                            
CONECT   19    7    9   13                                            
CONECT   20   27   27                                                 
CONECT   21   28   42                                                 
CONECT   22   27   43                                                 
CONECT   23   28   44                                                 
CONECT   24   27   28                                                 
CONECT   25   28   28                                                 
CONECT   26   27    1                                                 
CONECT   27   20   20   22   24                                       
CONECT   27   26                                                      
CONECT   28   25   25   24   21                                       
CONECT   28   23                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
