COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.741  -0.118  -1.057  1.00  0.00           C  
HETATM    2  C   UNL     1       2.017   1.041  -1.748  1.00  0.00           C  
HETATM    3  C   UNL     1       0.817   1.463  -0.895  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.096   0.251  -0.682  1.00  0.00           C  
HETATM    5  C   UNL     1       0.710  -0.877  -0.033  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.179  -2.112   0.128  1.00  0.00           C  
HETATM    7  O   UNL     1       3.241   0.319   0.208  1.00  0.00           O  
HETATM    8  O   UNL     1       2.912   2.145  -1.892  1.00  0.00           O  
HETATM    9  O   UNL     1       0.092   2.495  -1.567  1.00  0.00           O  
HETATM   10  O   UNL     1      -1.182   0.615   0.173  1.00  0.00           O  
HETATM   11  O   UNL     1       1.828  -1.200  -0.862  1.00  0.00           O  
HETATM   12  O   UNL     1       0.544  -3.132   0.819  1.00  0.00           O  
HETATM   13  P   UNL     1       4.568  -0.292   0.885  1.00  0.00           P  
HETATM   14  O   UNL     1       4.438  -1.762   0.989  1.00  0.00           O  
HETATM   15  O   UNL     1       4.758   0.336   2.355  1.00  0.00           O  
HETATM   16  O   UNL     1       5.848   0.071  -0.022  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.286   1.210  -0.512  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.242   1.835   0.507  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.797   0.735   1.418  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.482  -0.329   0.555  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.478  -0.871  -0.466  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.172  -1.891  -1.372  1.00  0.00           C  
HETATM   23  O   UNL     1      -2.537   2.797   1.295  1.00  0.00           O  
HETATM   24  O   UNL     1      -4.746   1.299   2.325  1.00  0.00           O  
HETATM   25  O   UNL     1      -4.940  -1.396   1.387  1.00  0.00           O  
HETATM   26  O   UNL     1      -2.978   0.208  -1.260  1.00  0.00           O  
HETATM   27  O   UNL     1      -3.210  -2.482  -2.248  1.00  0.00           O  
HETATM   28  H   UNL     1       3.571  -0.451  -1.681  1.00  0.00           H  
HETATM   29  H   UNL     1       1.672   0.721  -2.731  1.00  0.00           H  
HETATM   30  H   UNL     1       1.166   1.832   0.070  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.486  -0.084  -1.643  1.00  0.00           H  
HETATM   32  H   UNL     1       1.064  -0.554   0.946  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.069  -1.847   0.699  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.474  -2.478  -0.856  1.00  0.00           H  
HETATM   35  H   UNL     1       3.699   1.948  -2.418  1.00  0.00           H  
HETATM   36  H   UNL     1       0.612   3.292  -1.740  1.00  0.00           H  
HETATM   37  H   UNL     1       0.040  -3.946   0.957  1.00  0.00           H  
HETATM   38  H   UNL     1       5.540   0.012   2.823  1.00  0.00           H  
HETATM   39  H   UNL     1       5.995   1.020  -0.134  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.921   1.982  -1.189  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.063   2.325  -0.016  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.980   0.280   1.979  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.330   0.116   0.033  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.651  -1.351   0.056  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.941  -1.391  -1.960  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.631  -2.667  -0.759  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.154   3.521   0.782  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.381   1.986   2.899  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.576  -1.124   2.062  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.580  -3.140  -2.852  1.00  0.00           H  
CONECT    1    2    7   11   28                                       
CONECT    2    1    8    3   29                                       
CONECT    3    2    9    4   30                                       
CONECT    4   10    3    5   31                                       
CONECT    5    4   11    6   32                                       
CONECT    6    5   12   33   34                                       
CONECT    7   13    1                                                 
CONECT    8    2   35                                                 
CONECT    9    3   36                                                 
CONECT   10   17    4                                                 
CONECT   11    1    5                                                 
CONECT   12    6   37                                                 
CONECT   13   14   14   16    7                                       
CONECT   13   15                                                      
CONECT   14   13   13                                                 
CONECT   15   13   38                                                 
CONECT   16   13   39                                                 
CONECT   17   10   18   26   40                                       
CONECT   18   17   23   19   41                                       
CONECT   19   18   24   20   42                                       
CONECT   20   19   25   21   43                                       
CONECT   21   20   26   22   44                                       
CONECT   22   21   27   46   45                                       
CONECT   23   18   47                                                 
CONECT   24   19   48                                                 
CONECT   25   20   49                                                 
CONECT   26   17   21                                                 
CONECT   27   22   50                                                 
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   12                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   27                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
