COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.783  -2.336  -0.302  1.00  0.00           O  
HETATM    2  C   UNL     1       6.477  -1.348  -0.256  1.00  0.00           C  
HETATM    3  N   UNL     1       7.817  -1.462  -0.340  1.00  0.00           N  
HETATM    4  O   UNL     1       8.329  -2.560  -0.463  1.00  0.00           O  
HETATM    5  C   UNL     1       5.844   0.012  -0.110  1.00  0.00           C  
HETATM    6  N   UNL     1       4.387  -0.132  -0.047  1.00  0.00           N  
HETATM    7  C   UNL     1       3.592   0.891  -0.416  1.00  0.00           C  
HETATM    8  O   UNL     1       4.084   1.934  -0.802  1.00  0.00           O  
HETATM    9  C   UNL     1       2.125   0.746  -0.353  1.00  0.00           C  
HETATM   10  C   UNL     1       1.560  -0.452   0.097  1.00  0.00           C  
HETATM   11  C   UNL     1       0.203  -0.587   0.157  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.624   0.475  -0.232  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.047   0.335  -0.170  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.215   0.220  -0.118  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.584   0.084  -0.058  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.751  -0.031  -0.006  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.175  -0.171   0.056  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.002   0.889  -0.332  1.00  0.00           C  
HETATM   19  C   UNL     1      -9.370   0.750  -0.270  1.00  0.00           C  
HETATM   20  C   UNL     1      -9.931  -0.443   0.178  1.00  0.00           C  
HETATM   21  N   UNL     1     -11.317  -0.579   0.239  1.00  0.00           N  
HETATM   22  C   UNL     1      -9.112  -1.499   0.565  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.743  -1.371   0.501  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.057   1.674  -0.682  1.00  0.00           C  
HETATM   25  C   UNL     1       1.301   1.809  -0.736  1.00  0.00           C  
HETATM   26  C   UNL     1       6.347   0.674   1.174  1.00  0.00           C  
HETATM   27  O   UNL     1       7.768   0.814   1.112  1.00  0.00           O  
HETATM   28  C   UNL     1       5.704   2.054   1.322  1.00  0.00           C  
HETATM   29  H   UNL     1       6.111   0.630  -0.967  1.00  0.00           H  
HETATM   30  H   UNL     1       3.995  -0.965   0.261  1.00  0.00           H  
HETATM   31  H   UNL     1       2.198  -1.270   0.396  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.233  -1.512   0.503  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.568   1.815  -0.679  1.00  0.00           H  
HETATM   34  H   UNL     1     -10.010   1.567  -0.569  1.00  0.00           H  
HETATM   35  H   UNL     1     -11.889   0.156  -0.031  1.00  0.00           H  
HETATM   36  H   UNL     1     -11.709  -1.410   0.551  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.551  -2.423   0.912  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.108  -2.193   0.797  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.693   2.494  -0.982  1.00  0.00           H  
HETATM   40  H   UNL     1       1.738   2.735  -1.079  1.00  0.00           H  
HETATM   41  H   UNL     1       6.080   0.055   2.031  1.00  0.00           H  
HETATM   42  H   UNL     1       8.078   1.354   0.373  1.00  0.00           H  
HETATM   43  H   UNL     1       4.620   1.947   1.369  1.00  0.00           H  
HETATM   44  H   UNL     1       6.063   2.526   2.237  1.00  0.00           H  
HETATM   45  H   UNL     1       5.971   2.673   0.465  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    5                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3                                                 
CONECT    5    2   26    6   29                                       
CONECT    6    5    7   30                                            
CONECT    7    6    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   25   25   10                                       
CONECT   10    9   11   11   31                                       
CONECT   11   10   10   12   32                                       
CONECT   12   11   24   24   13                                       
CONECT   13   12   14   14   14                                       
CONECT   14   13   13   13   15                                       
CONECT   15   14   16   16   16                                       
CONECT   16   15   15   15   17                                       
CONECT   17   16   18   18   23                                       
CONECT   18   17   17   19   33                                       
CONECT   19   18   20   20   34                                       
CONECT   20   19   19   22   21                                       
CONECT   21   20   35   36                                            
CONECT   22   20   23   23   37                                       
CONECT   23   17   22   22   38                                       
CONECT   24   12   12   25   39                                       
CONECT   25    9    9   24   40                                       
CONECT   26    5   27   28   41                                       
CONECT   27   26   42                                                 
CONECT   28   26   43   44   45                                       
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   21                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
CONECT   40   25                                                      
CONECT   41   26                                                      
CONECT   42   27                                                      
CONECT   43   28                                                      
CONECT   44   28                                                      
CONECT   45   28                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
