COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.090   1.477  -0.607  1.00  0.00           O  
HETATM    2  C   UNL     1       3.482   1.300  -0.862  1.00  0.00           C  
HETATM    3  C   UNL     1       3.856   2.008  -2.165  1.00  0.00           C  
HETATM    4  C   UNL     1       3.801  -0.195  -0.986  1.00  0.00           C  
HETATM    5  C   UNL     1       3.315  -0.906   0.290  1.00  0.00           C  
HETATM    6  O   UNL     1       4.002  -1.715   0.866  1.00  0.00           O  
HETATM    7  C   UNL     1       1.928  -0.507   0.767  1.00  0.00           C  
HETATM    8  O   UNL     1       1.709  -0.975   2.100  1.00  0.00           O  
HETATM    9  C   UNL     1       1.826   1.021   0.716  1.00  0.00           C  
HETATM   10  O   UNL     1       0.967  -1.077  -0.122  1.00  0.00           O  
HETATM   11  O   UNL     1       0.531   1.439   1.131  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.325  -0.643   0.307  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.384  -1.264  -0.608  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.309  -2.729  -0.516  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.848  -3.259  -1.775  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.776  -0.799  -0.178  1.00  0.00           C  
HETATM   17  O   UNL     1      -3.018  -1.198   1.173  1.00  0.00           O  
HETATM   18  C   UNL     1      -2.852   0.727  -0.281  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.191   1.179   0.121  1.00  0.00           N  
HETATM   20  C   UNL     1      -5.056   1.036  -1.057  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.804   1.348   0.643  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.867   2.774   0.578  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.410   0.882   0.230  1.00  0.00           C  
HETATM   24  H   UNL     1       4.058   1.726  -0.040  1.00  0.00           H  
HETATM   25  H   UNL     1       3.635   3.072  -2.077  1.00  0.00           H  
HETATM   26  H   UNL     1       4.919   1.873  -2.361  1.00  0.00           H  
HETATM   27  H   UNL     1       3.278   1.584  -2.987  1.00  0.00           H  
HETATM   28  H   UNL     1       3.288  -0.610  -1.854  1.00  0.00           H  
HETATM   29  H   UNL     1       4.877  -0.335  -1.092  1.00  0.00           H  
HETATM   30  H   UNL     1       1.800  -1.937   2.077  1.00  0.00           H  
HETATM   31  H   UNL     1       2.568   1.447   1.391  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.496  -0.966   1.334  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.201  -0.956  -1.637  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.329  -2.968  -0.497  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.881  -2.931  -1.895  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.251  -2.892  -2.610  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.814  -4.348  -1.755  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.527  -1.245  -0.830  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.902  -0.883   1.403  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.658   1.032  -1.309  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.118   2.168   0.309  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.711   1.705  -1.845  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.019   0.006  -1.412  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.081   1.290  -0.788  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.008   1.022   1.663  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.723   3.033   0.945  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.201   1.236  -0.780  1.00  0.00           H  
CONECT    1    2    9                                                 
CONECT    2    1    3    4   24                                       
CONECT    3    2   25   26   27                                       
CONECT    4    2    5   28   29                                       
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5    8    9   10                                       
CONECT    8    7   30                                                 
CONECT    9    1    7   11   31                                       
CONECT   10    7   12                                                 
CONECT   11    9   23                                                 
CONECT   12   10   13   23   32                                       
CONECT   13   12   14   16   33                                       
CONECT   14   13   15   34                                            
CONECT   15   14   35   36   37                                       
CONECT   16   13   17   18   38                                       
CONECT   17   16   39                                                 
CONECT   18   16   19   21   40                                       
CONECT   19   18   20   41                                            
CONECT   20   19   42   43   44                                       
CONECT   21   18   22   23   45                                       
CONECT   22   21   46                                                 
CONECT   23   11   12   21   47                                       
CONECT   24    2                                                      
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
