COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.016  -4.476   2.491  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.720  -3.555   1.752  1.00  0.00           C  
HETATM    3  N   UNL     1      -5.321  -3.798   0.487  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.995  -2.779  -0.329  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.637  -3.013  -1.467  1.00  0.00           O  
HETATM    6  C   UNL     1      -5.797  -2.217   2.211  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.463  -1.214   1.371  1.00  0.00           C  
HETATM    8  N   UNL     1      -5.058  -1.504   0.097  1.00  0.00           N  
HETATM    9  C   UNL     1      -4.696  -0.415  -0.814  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.721   0.453  -0.198  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.919   0.489  -1.085  1.00  0.00           C  
HETATM   12  O   UNL     1      -6.536   0.140  -2.326  1.00  0.00           O  
HETATM   13  C   UNL     1      -5.324   1.913  -1.157  1.00  0.00           C  
HETATM   14  O   UNL     1      -5.558   2.488  -2.444  1.00  0.00           O  
HETATM   15  C   UNL     1      -3.810   1.700  -0.922  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.234   2.844  -0.086  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.782   2.687   0.024  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.057   3.585   0.720  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.608   4.525   1.256  1.00  0.00           O  
HETATM   20  C   UNL     1       0.412   3.425   0.831  1.00  0.00           C  
HETATM   21  C   UNL     1       1.155   4.357   1.552  1.00  0.00           C  
HETATM   22  C   UNL     1       2.528   4.194   1.647  1.00  0.00           C  
HETATM   23  C   UNL     1       3.110   3.104   1.018  1.00  0.00           C  
HETATM   24  C   UNL     1       2.309   2.217   0.317  1.00  0.00           C  
HETATM   25  N   UNL     1       1.008   2.392   0.247  1.00  0.00           N  
HETATM   26  C   UNL     1       2.937   1.031  -0.368  1.00  0.00           C  
HETATM   27  O   UNL     1       4.349   1.046  -0.150  1.00  0.00           O  
HETATM   28  H   UNL     1      -5.270  -4.711   0.164  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.118  -2.003   3.220  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.515  -0.188   1.704  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.308  -0.818  -1.750  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.636   0.415  -0.267  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.273   0.715  -2.574  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.748   2.544  -0.375  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.494   2.588  -2.667  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.285   1.625  -1.875  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.461   3.796  -0.568  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.678   2.826   0.909  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.342   1.936  -0.405  1.00  0.00           H  
HETATM   40  H   UNL     1       0.669   5.194   2.029  1.00  0.00           H  
HETATM   41  H   UNL     1       3.131   4.900   2.199  1.00  0.00           H  
HETATM   42  H   UNL     1       4.177   2.949   1.072  1.00  0.00           H  
HETATM   43  H   UNL     1       2.517   0.111   0.039  1.00  0.00           H  
HETATM   44  H   UNL     1       2.734   1.080  -1.438  1.00  0.00           H  
HETATM   45  C   UNL     1       5.044  -0.042  -0.762  1.00  0.00           C  
HETATM   46  C   UNL     1       6.552   0.143  -0.570  1.00  0.00           C  
HETATM   47  C   UNL     1       7.286  -1.057  -1.175  1.00  0.00           C  
HETATM   48  C   UNL     1       6.770  -2.342  -0.519  1.00  0.00           C  
HETATM   49  C   UNL     1       5.254  -2.431  -0.713  1.00  0.00           C  
HETATM   50  O   UNL     1       4.635  -1.270  -0.155  1.00  0.00           O  
HETATM   51  H   UNL     1       4.814  -0.068  -1.827  1.00  0.00           H  
HETATM   52  H   UNL     1       6.873   1.057  -1.069  1.00  0.00           H  
HETATM   53  H   UNL     1       7.100  -1.095  -2.248  1.00  0.00           H  
HETATM   54  H   UNL     1       7.248  -3.205  -0.983  1.00  0.00           H  
HETATM   55  H   UNL     1       5.026  -2.488  -1.778  1.00  0.00           H  
HETATM   56  C   UNL     1       4.722  -3.681  -0.009  1.00  0.00           C  
HETATM   57  O   UNL     1       3.328  -3.826  -0.287  1.00  0.00           O  
HETATM   58  H   UNL     1       5.259  -4.557  -0.371  1.00  0.00           H  
HETATM   59  H   UNL     1       4.870  -3.583   1.066  1.00  0.00           H  
HETATM   60  H   UNL     1       2.923  -4.600   0.128  1.00  0.00           H  
HETATM   61  O   UNL     1       7.073  -2.320   0.877  1.00  0.00           O  
HETATM   62  O   UNL     1       8.689  -0.929  -0.936  1.00  0.00           O  
HETATM   63  O   UNL     1       6.848   0.230   0.825  1.00  0.00           O  
HETATM   64  H   UNL     1       8.017  -2.260   1.074  1.00  0.00           H  
HETATM   65  H   UNL     1       9.082  -0.132  -1.318  1.00  0.00           H  
HETATM   66  H   UNL     1       6.412   0.967   1.275  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    6    1    1                                       
CONECT    3    4    2   28                                            
CONECT    4    5    5    8    3                                       
CONECT    5    4    4                                                 
CONECT    6    7    7    2   29                                       
CONECT    7    8    6    6   30                                       
CONECT    8    9    4    7                                            
CONECT    9   11   10    8   31                                       
CONECT   10   15    9                                                 
CONECT   11   12   13    9   32                                       
CONECT   12   11   33                                                 
CONECT   13   14   11   15   34                                       
CONECT   14   13   35                                                 
CONECT   15   13   16   10   36                                       
CONECT   16   15   17   37   38                                       
CONECT   17   16   18   39                                            
CONECT   18   19   19   17   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   25   25   21                                       
CONECT   21   20   22   22   40                                       
CONECT   22   21   21   23   41                                       
CONECT   23   24   24   22   42                                       
CONECT   24   25   26   23   23                                       
CONECT   25   20   20   24                                            
CONECT   26   27   24   43   44                                       
CONECT   27   26   45                                                 
CONECT   28    3                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
CONECT   45   27   46   50   51                                       
CONECT   46   45   47   52   63                                       
CONECT   47   46   48   53   62                                       
CONECT   48   47   49   54   61                                       
CONECT   49   48   50   55   56                                       
CONECT   50   49   45                                                 
CONECT   51   45                                                      
CONECT   52   46                                                      
CONECT   53   47                                                      
CONECT   54   48                                                      
CONECT   55   49                                                      
CONECT   56   49   57   58   59                                       
CONECT   57   56   60                                                 
CONECT   58   56                                                      
CONECT   59   56                                                      
CONECT   60   57                                                      
CONECT   61   48   64                                                 
CONECT   62   47   65                                                 
CONECT   63   46   66                                                 
CONECT   64   61                                                      
CONECT   65   62                                                      
CONECT   66   63                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
