COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.400   1.087   0.012  1.00  0.00           C  
HETATM    2  C   UNL     1       4.733  -0.030   0.818  1.00  0.00           C  
HETATM    3  C   UNL     1       5.025   0.171   2.306  1.00  0.00           C  
HETATM    4  C   UNL     1       3.222   0.006   0.584  1.00  0.00           C  
HETATM    5  C   UNL     1       2.431  -1.113   1.254  1.00  0.00           C  
HETATM    6  C   UNL     1       1.088  -1.553   0.666  1.00  0.00           C  
HETATM    7  C   UNL     1       0.534  -0.777  -0.532  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.989  -0.608  -0.575  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.667  -1.842   0.018  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.183  -1.746  -0.192  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.650  -0.385   0.268  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.836   0.655   0.465  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.345   0.637   0.246  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.867   1.896  -0.453  1.00  0.00           C  
HETATM   15  C   UNL     1       0.590   1.809  -0.888  1.00  0.00           C  
HETATM   16  C   UNL     1       1.302   0.467  -0.980  1.00  0.00           C  
HETATM   17  C   UNL     1       2.810   0.426  -0.814  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.687   1.810   0.915  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.025   0.017   0.568  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.445  -0.416  -2.023  1.00  0.00           C  
HETATM   21  O   UNL     1       2.426   0.225   1.727  1.00  0.00           O  
HETATM   22  O   UNL     1       1.103  -2.063  -0.673  1.00  0.00           O  
HETATM   23  O   UNL     1       3.331  -0.514  -1.756  1.00  0.00           O  
HETATM   24  O   UNL     1       0.824   1.155  -2.144  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.054   1.309   0.949  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.997  -0.708   0.486  1.00  0.00           O  
HETATM   27  H   UNL     1       6.477   1.061   0.178  1.00  0.00           H  
HETATM   28  H   UNL     1       5.193   0.943  -1.048  1.00  0.00           H  
HETATM   29  H   UNL     1       5.006   2.051   0.332  1.00  0.00           H  
HETATM   30  H   UNL     1       5.127  -0.994   0.498  1.00  0.00           H  
HETATM   31  H   UNL     1       4.630   1.136   2.626  1.00  0.00           H  
HETATM   32  H   UNL     1       4.549  -0.624   2.880  1.00  0.00           H  
HETATM   33  H   UNL     1       6.102   0.146   2.472  1.00  0.00           H  
HETATM   34  H   UNL     1       2.981  -1.872   1.811  1.00  0.00           H  
HETATM   35  H   UNL     1       0.373  -1.968   1.377  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.288  -2.737  -0.475  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.452  -1.897   1.086  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.414  -1.874  -1.250  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.682  -2.523   0.387  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.854   0.572   1.217  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.487   2.068  -1.333  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.980   2.741   0.227  1.00  0.00           H  
HETATM   43  H   UNL     1       1.202   2.681  -0.655  1.00  0.00           H  
HETATM   44  H   UNL     1       3.227   1.410  -1.027  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.382   2.138   1.909  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.607   2.635   0.206  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.161  -1.289  -2.612  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.528  -0.296  -2.051  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.971   0.472  -2.439  1.00  0.00           H  
HETATM   50  H   UNL     1       4.295  -0.585  -1.748  1.00  0.00           H  
CONECT    1    2   27   28   29                                       
CONECT    2    3    1    4   30                                       
CONECT    3    2   31   32   33                                       
CONECT    4    2   17   21    5                                       
CONECT    5    4   21    6   34                                       
CONECT    6    5    7   22   35                                       
CONECT    7   16    6   22    8                                       
CONECT    8    7   13   20    9                                       
CONECT    9    8   10   36   37                                       
CONECT   10    9   11   38   39                                       
CONECT   11   12   12   10   19                                       
CONECT   12   13   18   11   11                                       
CONECT   13   14    8   12   40                                       
CONECT   14   15   13   41   42                                       
CONECT   15   24   16   14   43                                       
CONECT   16   17   24   15    7                                       
CONECT   17   23    4   16   44                                       
CONECT   18   12   25   45   46                                       
CONECT   19   25   11   26   26                                       
CONECT   20    8   47   48   49                                       
CONECT   21    4    5                                                 
CONECT   22    6    7                                                 
CONECT   23   17   50                                                 
CONECT   24   16   15                                                 
CONECT   25   18   19                                                 
CONECT   26   19   19                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   23                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
