COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.515  -4.002   1.106  1.00  0.00           C  
HETATM    2  O   UNL     1      -1.777  -5.205   0.381  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.336  -2.843   0.122  1.00  0.00           C  
HETATM    4  C   UNL     1       0.068  -2.734  -0.421  1.00  0.00           C  
HETATM    5  O   UNL     1       0.781  -3.421  -1.121  1.00  0.00           O  
HETATM    6  N   UNL     1       0.188  -1.543   0.204  1.00  0.00           N  
HETATM    7  C   UNL     1       1.257  -0.639   0.256  1.00  0.00           C  
HETATM    8  C   UNL     1       2.439  -0.922  -0.414  1.00  0.00           C  
HETATM    9  C   UNL     1       3.497  -0.028  -0.363  1.00  0.00           C  
HETATM   10  O   UNL     1       4.654  -0.306  -1.021  1.00  0.00           O  
HETATM   11  C   UNL     1       4.710  -1.537  -1.745  1.00  0.00           C  
HETATM   12  C   UNL     1       3.374   1.152   0.359  1.00  0.00           C  
HETATM   13  O   UNL     1       4.413   2.031   0.410  1.00  0.00           O  
HETATM   14  C   UNL     1       4.460   3.038  -0.603  1.00  0.00           C  
HETATM   15  C   UNL     1       2.191   1.435   1.031  1.00  0.00           C  
HETATM   16  O   UNL     1       2.069   2.590   1.738  1.00  0.00           O  
HETATM   17  C   UNL     1       0.825   2.816   2.404  1.00  0.00           C  
HETATM   18  C   UNL     1       1.132   0.543   0.974  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.147  -1.488   0.811  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.026  -0.392   0.266  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.182  -0.038   0.937  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.992   0.969   0.438  1.00  0.00           C  
HETATM   23  O   UNL     1      -5.129   1.319   1.097  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.639   1.623  -0.739  1.00  0.00           C  
HETATM   25  O   UNL     1      -4.431   2.612  -1.233  1.00  0.00           O  
HETATM   26  C   UNL     1      -4.006   3.239  -2.445  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.479   1.263  -1.406  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.673   0.261  -0.900  1.00  0.00           C  
HETATM   29  H   UNL     1      -2.353  -3.788   1.770  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.606  -4.122   1.694  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.901  -5.983   0.943  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.101  -2.832  -0.655  1.00  0.00           H  
HETATM   33  H   UNL     1       2.534  -1.840  -0.976  1.00  0.00           H  
HETATM   34  H   UNL     1       4.556  -2.369  -1.058  1.00  0.00           H  
HETATM   35  H   UNL     1       3.931  -1.546  -2.507  1.00  0.00           H  
HETATM   36  H   UNL     1       5.685  -1.635  -2.221  1.00  0.00           H  
HETATM   37  H   UNL     1       5.334   3.670  -0.447  1.00  0.00           H  
HETATM   38  H   UNL     1       4.523   2.566  -1.583  1.00  0.00           H  
HETATM   39  H   UNL     1       3.557   3.648  -0.552  1.00  0.00           H  
HETATM   40  H   UNL     1       0.862   3.770   2.929  1.00  0.00           H  
HETATM   41  H   UNL     1       0.019   2.836   1.670  1.00  0.00           H  
HETATM   42  H   UNL     1       0.645   2.014   3.119  1.00  0.00           H  
HETATM   43  H   UNL     1       0.210   0.764   1.492  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.144  -1.538   1.900  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.454  -0.547   1.850  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.004   2.017   1.754  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.942   2.492  -3.237  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.724   4.008  -2.728  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.027   3.694  -2.295  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.203   1.768  -2.320  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.767  -0.015  -1.418  1.00  0.00           H  
CONECT    1    2    3   29   30                                       
CONECT    2    1   31                                                 
CONECT    3    1    4   19   32                                       
CONECT    4    3    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    7   19    4                                            
CONECT    7    6    8    8   18                                       
CONECT    8    7    7    9   33                                       
CONECT    9    8   10   12   12                                       
CONECT   10    9   11                                                 
CONECT   11   10   34   35   36                                       
CONECT   12    9    9   13   15                                       
CONECT   13   12   14                                                 
CONECT   14   13   37   38   39                                       
CONECT   15   12   16   18   18                                       
CONECT   16   15   17                                                 
CONECT   17   16   40   41   42                                       
CONECT   18    7   15   15   43                                       
CONECT   19    3    6   20   44                                       
CONECT   20   19   21   21   28                                       
CONECT   21   20   20   22   45                                       
CONECT   22   21   23   24   24                                       
CONECT   23   22   46                                                 
CONECT   24   22   22   25   27                                       
CONECT   25   24   26                                                 
CONECT   26   25   47   48   49                                       
CONECT   27   24   28   28   50                                       
CONECT   28   20   27   27   51                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    8                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
