COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.026   1.672   0.362  1.00  0.00           C  
HETATM    2  C   UNL     1       8.517   1.923   0.420  1.00  0.00           C  
HETATM    3  C   UNL     1       7.773   0.625   0.101  1.00  0.00           C  
HETATM    4  C   UNL     1       6.264   0.875   0.159  1.00  0.00           C  
HETATM    5  C   UNL     1       5.519  -0.423  -0.160  1.00  0.00           C  
HETATM    6  C   UNL     1       4.011  -0.173  -0.102  1.00  0.00           C  
HETATM    7  O   UNL     1       3.315  -1.385  -0.400  1.00  0.00           O  
HETATM    8  C   UNL     1       1.959  -1.335  -0.391  1.00  0.00           C  
HETATM    9  C   UNL     1       1.222  -2.480  -0.672  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.154  -2.433  -0.664  1.00  0.00           C  
HETATM   11  C   UNL     1       1.311  -0.142  -0.095  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.064  -0.087  -0.084  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.809  -1.234  -0.372  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.284  -1.180  -0.362  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.931  -2.180  -0.608  1.00  0.00           O  
HETATM   16  N   UNL     1      -2.914  -0.022  -0.080  1.00  0.00           N  
HETATM   17  C   UNL     1      -4.378   0.032  -0.070  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.896  -0.413   1.299  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.555  -1.889   1.519  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.236   0.430   2.392  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.831   1.442  -0.344  1.00  0.00           C  
HETATM   22  O   UNL     1      -4.084   2.372  -0.125  1.00  0.00           O  
HETATM   23  N   UNL     1      -6.067   1.671  -0.832  1.00  0.00           N  
HETATM   24  O   UNL     1      -6.530   2.999  -0.994  1.00  0.00           O  
HETATM   25  H   UNL     1      10.296   0.910   1.092  1.00  0.00           H  
HETATM   26  H   UNL     1      10.299   1.332  -0.637  1.00  0.00           H  
HETATM   27  H   UNL     1      10.556   2.597   0.589  1.00  0.00           H  
HETATM   28  H   UNL     1       8.243   2.263   1.418  1.00  0.00           H  
HETATM   29  H   UNL     1       8.247   2.685  -0.311  1.00  0.00           H  
HETATM   30  H   UNL     1       8.046   0.285  -0.898  1.00  0.00           H  
HETATM   31  H   UNL     1       8.043  -0.138   0.831  1.00  0.00           H  
HETATM   32  H   UNL     1       5.990   1.215   1.157  1.00  0.00           H  
HETATM   33  H   UNL     1       5.994   1.638  -0.572  1.00  0.00           H  
HETATM   34  H   UNL     1       5.793  -0.763  -1.159  1.00  0.00           H  
HETATM   35  H   UNL     1       5.790  -1.186   0.570  1.00  0.00           H  
HETATM   36  H   UNL     1       3.737   0.167   0.896  1.00  0.00           H  
HETATM   37  H   UNL     1       3.741   0.590  -0.833  1.00  0.00           H  
HETATM   38  H   UNL     1       1.729  -3.406  -0.898  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.727  -3.322  -0.883  1.00  0.00           H  
HETATM   40  H   UNL     1       1.888   0.744   0.128  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.567   0.840   0.147  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.399   0.775   0.116  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.772  -0.632  -0.840  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.977  -0.280   1.340  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.474  -2.022   1.478  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.924  -2.205   2.494  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.025  -2.490   0.740  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.508   1.477   2.256  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.578   0.090   3.370  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.153   0.324   2.329  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.639   0.925  -1.073  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.426   3.063  -1.350  1.00  0.00           H  
CONECT    1    2   25   26   27                                       
CONECT    2    3    1   28   29                                       
CONECT    3    4    2   30   31                                       
CONECT    4    5    3   32   33                                       
CONECT    5    6    4   34   35                                       
CONECT    6    7    5   36   37                                       
CONECT    7    6    8                                                 
CONECT    8    7    9    9   11                                       
CONECT    9    8    8   10   38                                       
CONECT   10    9   13   13   39                                       
CONECT   11    8   12   12   40                                       
CONECT   12   11   11   13   41                                       
CONECT   13   10   10   12   14                                       
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   42                                            
CONECT   17   16   18   21   43                                       
CONECT   18   20   17   19   44                                       
CONECT   19   18   45   46   47                                       
CONECT   20   18   48   49   50                                       
CONECT   21   17   22   22   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   24   51                                            
CONECT   24   23   52                                                 
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
