COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.410   2.490   1.129  1.00  0.00           O  
HETATM    2  C   UNL     1       3.283   1.752   0.650  1.00  0.00           C  
HETATM    3  C   UNL     1       2.130   2.714   0.352  1.00  0.00           C  
HETATM    4  O   UNL     1       2.560   3.700  -0.589  1.00  0.00           O  
HETATM    5  C   UNL     1       3.664   1.014  -0.638  1.00  0.00           C  
HETATM    6  O   UNL     1       4.691   0.061  -0.356  1.00  0.00           O  
HETATM    7  C   UNL     1       2.431   0.291  -1.186  1.00  0.00           C  
HETATM    8  C   UNL     1       2.788  -0.399  -2.504  1.00  0.00           C  
HETATM    9  O   UNL     1       1.386   1.239  -1.412  1.00  0.00           O  
HETATM   10  C   UNL     1       0.956   1.926  -0.234  1.00  0.00           C  
HETATM   11  O   UNL     1       0.492   0.976   0.728  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.719   0.400   0.493  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.891   1.196   0.435  1.00  0.00           C  
HETATM   14  O   UNL     1      -1.845   2.406   0.592  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.813  -0.947   0.306  1.00  0.00           C  
HETATM   16  C   UNL     1       0.416  -1.759   0.364  1.00  0.00           C  
HETATM   17  C   UNL     1       1.315  -1.597   1.422  1.00  0.00           C  
HETATM   18  C   UNL     1       2.462  -2.359   1.472  1.00  0.00           C  
HETATM   19  C   UNL     1       2.726  -3.286   0.472  1.00  0.00           C  
HETATM   20  O   UNL     1       3.858  -4.035   0.525  1.00  0.00           O  
HETATM   21  C   UNL     1       1.836  -3.451  -0.582  1.00  0.00           C  
HETATM   22  C   UNL     1       0.684  -2.698  -0.637  1.00  0.00           C  
HETATM   23  O   UNL     1      -1.985  -1.561   0.071  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.152  -0.888   0.004  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.342  -1.556  -0.241  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.533  -0.849  -0.307  1.00  0.00           C  
HETATM   27  O   UNL     1      -6.694  -1.511  -0.547  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.551   0.530  -0.130  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.374   1.214   0.114  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.166   0.507   0.177  1.00  0.00           C  
HETATM   31  O   UNL     1      -4.389   2.560   0.287  1.00  0.00           O  
HETATM   32  H   UNL     1       4.240   2.982   1.943  1.00  0.00           H  
HETATM   33  H   UNL     1       2.972   1.030   1.405  1.00  0.00           H  
HETATM   34  H   UNL     1       1.816   3.203   1.274  1.00  0.00           H  
HETATM   35  H   UNL     1       1.906   4.390  -0.764  1.00  0.00           H  
HETATM   36  H   UNL     1       4.024   1.731  -1.375  1.00  0.00           H  
HETATM   37  H   UNL     1       4.981  -0.444  -1.128  1.00  0.00           H  
HETATM   38  H   UNL     1       2.096  -0.454  -0.464  1.00  0.00           H  
HETATM   39  H   UNL     1       3.586  -1.121  -2.332  1.00  0.00           H  
HETATM   40  H   UNL     1       1.910  -0.914  -2.894  1.00  0.00           H  
HETATM   41  H   UNL     1       3.122   0.347  -3.225  1.00  0.00           H  
HETATM   42  H   UNL     1       0.148   2.611  -0.488  1.00  0.00           H  
HETATM   43  H   UNL     1       1.110  -0.876   2.200  1.00  0.00           H  
HETATM   44  H   UNL     1       3.156  -2.234   2.289  1.00  0.00           H  
HETATM   45  H   UNL     1       3.755  -4.870   1.001  1.00  0.00           H  
HETATM   46  H   UNL     1       2.045  -4.174  -1.357  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.010  -2.830  -1.454  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.341  -2.626  -0.380  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.146  -1.815   0.252  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.485   1.068  -0.183  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.508   2.837   1.206  1.00  0.00           H  
CONECT    1    2   32                                                 
CONECT    2    1    3    5   33                                       
CONECT    3    4    2   10   34                                       
CONECT    4    3   35                                                 
CONECT    5    2    6    7   36                                       
CONECT    6    5   37                                                 
CONECT    7    5    9    8   38                                       
CONECT    8    7   39   40   41                                       
CONECT    9   10    7                                                 
CONECT   10    3    9   11   42                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   15   15                                       
CONECT   13   14   14   12   30                                       
CONECT   14   13   13                                                 
CONECT   15   12   12   16   23                                       
CONECT   16   17   15   22   22                                       
CONECT   17   18   18   16   43                                       
CONECT   18   17   17   19   44                                       
CONECT   19   18   20   21   21                                       
CONECT   20   19   45                                                 
CONECT   21   19   19   22   46                                       
CONECT   22   16   16   21   47                                       
CONECT   23   15   24                                                 
CONECT   24   30   23   25   25                                       
CONECT   25   24   24   26   48                                       
CONECT   26   28   28   25   27                                       
CONECT   27   26   49                                                 
CONECT   28   29   26   26   50                                       
CONECT   29   31   30   30   28                                       
CONECT   30   13   29   29   24                                       
CONECT   31   29   51                                                 
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42   10                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   25                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   31                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
