COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       8.188   0.044  -0.949  1.00  0.00           O  
HETATM    2  C   UNL     1       7.897   0.731   0.270  1.00  0.00           C  
HETATM    3  C   UNL     1       6.462   1.260   0.228  1.00  0.00           C  
HETATM    4  N   UNL     1       5.525   0.130   0.186  1.00  0.00           N  
HETATM    5  C   UNL     1       4.134   0.602   0.144  1.00  0.00           C  
HETATM    6  C   UNL     1       3.189  -0.601   0.101  1.00  0.00           C  
HETATM    7  N   UNL     1       1.802  -0.131   0.060  1.00  0.00           N  
HETATM    8  C   UNL     1       0.760  -1.046   0.017  1.00  0.00           C  
HETATM    9  C   UNL     1       1.031  -2.410  -0.121  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.563  -0.608   0.117  1.00  0.00           C  
HETATM   11  C   UNL     1       0.006  -3.325  -0.164  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.869   0.825   0.267  1.00  0.00           C  
HETATM   13  O   UNL     1       0.009   1.616   0.554  1.00  0.00           O  
HETATM   14  C   UNL     1      -1.615  -1.547   0.072  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.255   1.289   0.066  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.324  -2.907  -0.072  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.010  -1.086   0.177  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.907  -1.880   0.390  1.00  0.00           O  
HETATM   19  C   UNL     1      -2.534   2.648  -0.083  1.00  0.00           C  
HETATM   20  N   UNL     1      -2.352  -3.838  -0.116  1.00  0.00           N  
HETATM   21  O   UNL     1      -1.529   3.558  -0.043  1.00  0.00           O  
HETATM   22  C   UNL     1      -3.850   3.068  -0.273  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.877   2.151  -0.315  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.617   0.790  -0.168  1.00  0.00           C  
HETATM   25  O   UNL     1      -5.635  -0.105  -0.212  1.00  0.00           O  
HETATM   26  C   UNL     1      -3.306   0.351   0.022  1.00  0.00           C  
HETATM   27  H   UNL     1       9.083  -0.319  -0.992  1.00  0.00           H  
HETATM   28  H   UNL     1       8.007   0.044   1.109  1.00  0.00           H  
HETATM   29  H   UNL     1       8.589   1.565   0.391  1.00  0.00           H  
HETATM   30  H   UNL     1       6.270   1.859   1.118  1.00  0.00           H  
HETATM   31  H   UNL     1       6.328   1.877  -0.661  1.00  0.00           H  
HETATM   32  H   UNL     1       5.673  -0.492   0.966  1.00  0.00           H  
HETATM   33  H   UNL     1       3.925   1.196   1.034  1.00  0.00           H  
HETATM   34  H   UNL     1       3.984   1.214  -0.745  1.00  0.00           H  
HETATM   35  H   UNL     1       3.398  -1.196  -0.788  1.00  0.00           H  
HETATM   36  H   UNL     1       2.054  -2.748  -0.195  1.00  0.00           H  
HETATM   37  H   UNL     1       0.230  -4.376  -0.272  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.258  -3.551  -0.309  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.164  -4.776   0.044  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.136   3.747  -0.906  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.065   4.120  -0.388  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.892   2.490  -0.462  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.828  -0.439  -1.098  1.00  0.00           H  
HETATM   44  H   UNL     1       3.339  -1.213   0.991  1.00  0.00           H  
HETATM   45  H   UNL     1       1.612   0.820   0.063  1.00  0.00           H  
CONECT    1    2   27                                                 
CONECT    2    1    3   28   29                                       
CONECT    3    4    2   30   31                                       
CONECT    4    5    3   32                                            
CONECT    5    6    4   33   34                                       
CONECT    6    7    5   35   44                                       
CONECT    7    8    6   45                                            
CONECT    8   10    7    9    9                                       
CONECT    9    8    8   11   36                                       
CONECT   10   12   14   14    8                                       
CONECT   11   16   16    9   37                                       
CONECT   12   15   13   13   10                                       
CONECT   13   12   12                                                 
CONECT   14   17   10   10   16                                       
CONECT   15   19   19   26   12                                       
CONECT   16   14   20   11   11                                       
CONECT   17   26   18   18   14                                       
CONECT   18   17   17                                                 
CONECT   19   22   21   15   15                                       
CONECT   20   16   38   39                                            
CONECT   21   19   40                                                 
CONECT   22   23   23   19   41                                       
CONECT   23   22   22   24   42                                       
CONECT   24   23   25   26   26                                       
CONECT   25   24   43                                                 
CONECT   26   24   24   15   17                                       
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   25                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
