COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.954   1.517  -0.522  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.474   1.586  -0.357  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.030   2.718  -1.222  1.00  0.00           C  
HETATM    4  O   UNL     1      -5.432   2.858  -0.980  1.00  0.00           O  
HETATM    5  O   UNL     1      -4.053   0.345  -0.767  1.00  0.00           O  
HETATM    6  O   UNL     1      -1.631   1.324  -1.901  1.00  0.00           O  
HETATM    7  C   UNL     1      -1.410   0.344   0.299  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.101  -0.946  -0.153  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.619  -0.782  -0.003  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.942  -0.576   1.373  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.341  -0.636   1.657  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.647  -2.054   0.668  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.622  -3.267   0.094  1.00  0.00           C  
HETATM   14  O   UNL     1      -1.969  -3.399  -1.056  1.00  0.00           O  
HETATM   15  C   UNL     1      -1.161  -4.465   0.884  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.001   0.228   0.093  1.00  0.00           O  
HETATM   17  C   UNL     1       0.786   0.977   1.022  1.00  0.00           C  
HETATM   18  C   UNL     1       2.248   0.783   0.713  1.00  0.00           C  
HETATM   19  C   UNL     1       2.626  -0.010  -0.321  1.00  0.00           C  
HETATM   20  C   UNL     1       4.059  -0.169  -0.585  1.00  0.00           C  
HETATM   21  C   UNL     1       4.515  -0.972  -1.634  1.00  0.00           C  
HETATM   22  C   UNL     1       5.858  -1.101  -1.855  1.00  0.00           C  
HETATM   23  C   UNL     1       6.771  -0.441  -1.045  1.00  0.00           C  
HETATM   24  C   UNL     1       6.341   0.356  -0.004  1.00  0.00           C  
HETATM   25  C   UNL     1       4.982   0.502   0.238  1.00  0.00           C  
HETATM   26  O   UNL     1       4.540   1.277   1.251  1.00  0.00           O  
HETATM   27  C   UNL     1       3.229   1.431   1.495  1.00  0.00           C  
HETATM   28  O   UNL     1       2.877   2.140   2.420  1.00  0.00           O  
HETATM   29  H   UNL     1      -1.507   2.446  -0.170  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.718   1.773   0.688  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.523   3.650  -0.970  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.865   2.487  -2.274  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.852   3.560  -1.496  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.947   2.030  -2.481  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.612   0.514   1.357  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.858  -1.143  -1.197  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.119  -1.681  -0.364  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.503  -0.470   2.722  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.861   0.133   1.086  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.727  -1.617   1.380  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.016  -4.920   1.385  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.706  -5.191   0.211  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.430  -4.150   1.628  1.00  0.00           H  
HETATM   44  H   UNL     1       0.535   2.035   0.941  1.00  0.00           H  
HETATM   45  H   UNL     1       0.580   0.631   2.035  1.00  0.00           H  
HETATM   46  H   UNL     1       1.890  -0.512  -0.933  1.00  0.00           H  
HETATM   47  H   UNL     1       3.809  -1.489  -2.267  1.00  0.00           H  
HETATM   48  H   UNL     1       6.211  -1.721  -2.665  1.00  0.00           H  
HETATM   49  H   UNL     1       7.829  -0.553  -1.231  1.00  0.00           H  
HETATM   50  H   UNL     1       7.060   0.865   0.621  1.00  0.00           H  
CONECT    1    7    2    6   29                                       
CONECT    2    1    5    3   30                                       
CONECT    3    2    4   31   32                                       
CONECT    4    3   33                                                 
CONECT    5    9    2                                                 
CONECT    6    1   34                                                 
CONECT    7   16    8    1   35                                       
CONECT    8   12    7    9   36                                       
CONECT    9   10    8    5   37                                       
CONECT   10   11    9                                                 
CONECT   11   10   38   39   40                                       
CONECT   12   13    8                                                 
CONECT   13   12   15   14   14                                       
CONECT   14   13   13                                                 
CONECT   15   13   41   42   43                                       
CONECT   16   17    7                                                 
CONECT   17   18   16   44   45                                       
CONECT   18   27   17   19   19                                       
CONECT   19   18   18   20   46                                       
CONECT   20   25   19   21   21                                       
CONECT   21   20   20   22   47                                       
CONECT   22   23   23   21   48                                       
CONECT   23   24   22   22   49                                       
CONECT   24   25   25   23   50                                       
CONECT   25   26   24   24   20                                       
CONECT   26   27   25                                                 
CONECT   27   28   28   26   18                                       
CONECT   28   27   27                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
