COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.227  -1.357   0.438  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.557  -2.136   0.586  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.639  -1.038   0.590  1.00  0.00           C  
HETATM    4  O   UNL     1      -6.964   0.228   0.506  1.00  0.00           O  
HETATM    5  C   UNL     1      -5.705  -0.009  -0.160  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.722   1.089   0.156  1.00  0.00           C  
HETATM    7  O   UNL     1      -5.025   1.969   0.933  1.00  0.00           O  
HETATM    8  N   UNL     1      -3.507   1.094  -0.427  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.533   2.156  -0.133  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.202   1.503   0.254  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.117   0.033  -1.368  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.761  -0.532  -0.930  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.797   0.563  -0.801  1.00  0.00           N  
HETATM   14  C   UNL     1       0.477   0.077  -0.565  1.00  0.00           C  
HETATM   15  N   UNL     1       0.654  -1.239  -0.491  1.00  0.00           N  
HETATM   16  N   UNL     1       1.467   0.938  -0.429  1.00  0.00           N  
HETATM   17  C   UNL     1       2.717   0.505  -0.199  1.00  0.00           C  
HETATM   18  C   UNL     1       3.789   1.393  -0.050  1.00  0.00           C  
HETATM   19  C   UNL     1       5.053   0.899   0.185  1.00  0.00           C  
HETATM   20  O   UNL     1       6.095   1.758   0.331  1.00  0.00           O  
HETATM   21  C   UNL     1       5.804   3.154   0.229  1.00  0.00           C  
HETATM   22  C   UNL     1       5.276  -0.482   0.275  1.00  0.00           C  
HETATM   23  O   UNL     1       6.533  -0.947   0.507  1.00  0.00           O  
HETATM   24  C   UNL     1       6.696  -2.364   0.588  1.00  0.00           C  
HETATM   25  C   UNL     1       4.245  -1.366   0.132  1.00  0.00           C  
HETATM   26  C   UNL     1       2.950  -0.889  -0.108  1.00  0.00           C  
HETATM   27  C   UNL     1       1.849  -1.765  -0.268  1.00  0.00           C  
HETATM   28  N   UNL     1       2.017  -3.132  -0.189  1.00  0.00           N  
HETATM   29  H   UNL     1      -4.755  -1.206   1.409  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.550  -1.869  -0.246  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.701  -2.809  -0.259  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.572  -2.693   1.523  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.298  -1.164  -0.269  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.217  -1.092   1.512  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.850  -0.095  -1.237  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.392   2.779  -1.016  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.897   2.768   0.692  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.438   2.272   0.368  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.320   0.965   1.194  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.865  -0.759  -1.355  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.034   0.446  -2.374  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.870  -1.037   0.029  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.405  -1.242  -1.677  1.00  0.00           H  
HETATM   44  H   UNL     1       3.626   2.459  -0.117  1.00  0.00           H  
HETATM   45  H   UNL     1       6.721   3.727   0.364  1.00  0.00           H  
HETATM   46  H   UNL     1       5.384   3.367  -0.754  1.00  0.00           H  
HETATM   47  H   UNL     1       5.085   3.432   0.999  1.00  0.00           H  
HETATM   48  H   UNL     1       7.744  -2.599   0.776  1.00  0.00           H  
HETATM   49  H   UNL     1       6.085  -2.754   1.402  1.00  0.00           H  
HETATM   50  H   UNL     1       6.384  -2.820  -0.352  1.00  0.00           H  
HETATM   51  H   UNL     1       4.427  -2.428   0.203  1.00  0.00           H  
HETATM   52  H   UNL     1       2.897  -3.504  -0.021  1.00  0.00           H  
HETATM   53  H   UNL     1       1.254  -3.721  -0.300  1.00  0.00           H  
CONECT    1    5    2   29   30                                       
CONECT    2    3    1   31   32                                       
CONECT    3    4    2   33   34                                       
CONECT    4    3    5                                                 
CONECT    5    4    6    1   35                                       
CONECT    6    5    8    7    7                                       
CONECT    7    6    6                                                 
CONECT    8   11    6    9                                            
CONECT    9    8   10   36   37                                       
CONECT   10   13    9   38   39                                       
CONECT   11   12    8   40   41                                       
CONECT   12   11   13   42   43                                       
CONECT   13   12   14   10                                            
CONECT   14   16   13   15   15                                       
CONECT   15   14   14   27                                            
CONECT   16   17   17   14                                            
CONECT   17   18   16   16   26                                       
CONECT   18   19   19   17   44                                       
CONECT   19   20   18   18   22                                       
CONECT   20   21   19                                                 
CONECT   21   20   45   46   47                                       
CONECT   22   19   23   25   25                                       
CONECT   23   22   24                                                 
CONECT   24   23   48   49   50                                       
CONECT   25   22   22   26   51                                       
CONECT   26   17   25   27   27                                       
CONECT   27   26   26   15   28                                       
CONECT   28   27   52   53                                            
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    5                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   18                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
