COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.806   1.214   0.057  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.622   4.017  -0.302  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.641  -0.964   0.293  1.00  0.00           C  
HETATM    4  C   UNL     1       0.507  -0.028   0.145  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.654  -2.955  -0.807  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.556  -2.105  -0.689  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.964  -2.585  -0.526  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.827   0.765   0.619  1.00  0.00           C  
HETATM    9  C   UNL     1       5.877  -0.284   0.361  1.00  0.00           C  
HETATM   10  C   UNL     1       4.865  -2.512  -0.141  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.494   1.954   0.725  1.00  0.00           C  
HETATM   12  C   UNL     1       1.093   2.308  -0.373  1.00  0.00           C  
HETATM   13  C   UNL     1       2.865   0.570  -0.239  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.759   0.278  -0.077  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.508   0.865   0.494  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.739  -0.808  -0.269  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.186  -1.278  -0.094  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.070  -0.444   0.025  1.00  0.00           C  
HETATM   19  C   UNL     1       1.555   1.034   0.344  1.00  0.00           C  
HETATM   20  CA  UNL     1       4.723  -1.002  -0.341  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.260   1.696  -0.151  1.00  0.00           C  
HETATM   22  N   UNL     1       3.450  -0.551   0.226  1.00  0.00           N  
HETATM   23  N   UNL     1      -0.228   2.679   0.157  1.00  0.00           N  
HETATM   24  N   UNL     1      -5.249  -0.509   0.271  1.00  0.00           N  
HETATM   25  O   UNL     1       3.392   1.206  -1.127  1.00  0.00           O  
HETATM   26  O   UNL     1       4.950  -2.801   1.256  1.00  0.00           O  
HETATM   27  H   UNL     1       6.628   1.726   0.558  1.00  0.00           H  
HETATM   28  H   UNL     1       5.883   1.370  -1.019  1.00  0.00           H  
HETATM   29  H   UNL     1       4.858   1.613   0.416  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.547   4.314   0.193  1.00  0.00           H  
HETATM   31  H   UNL     1       0.165   4.731  -0.060  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.777   4.000  -1.381  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.101  -0.773  -0.676  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.671  -2.033   0.506  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.188  -0.424   1.067  1.00  0.00           H  
HETATM   36  H   UNL     1       0.797  -1.068   0.191  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.476  -3.967  -1.138  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.565  -2.464  -0.927  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.780  -3.284  -0.639  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.478   1.563   0.945  1.00  0.00           H  
HETATM   41  H   UNL     1       6.826  -0.683   0.003  1.00  0.00           H  
HETATM   42  H   UNL     1       5.801  -0.440   1.437  1.00  0.00           H  
HETATM   43  H1  UNL     1       3.997  -3.018  -0.564  1.00  0.00           H  
HETATM   44  H2  UNL     1       5.769  -2.862  -0.640  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.930   2.918   0.464  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.200   1.960   1.775  1.00  0.00           H  
HETATM   47  H   UNL     1       1.801   3.114  -0.181  1.00  0.00           H  
HETATM   48  H   UNL     1       1.029   2.123  -1.445  1.00  0.00           H  
HETATM   49  H   UNL     1       1.677   1.235   1.408  1.00  0.00           H  
HETATM   50  HA  UNL     1       4.748  -0.773  -1.407  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.559   1.877  -1.183  1.00  0.00           H  
HETATM   52  H   UNL     1       3.028  -1.060   0.936  1.00  0.00           H  
HETATM   53  H   UNL     1       5.041  -3.742   1.458  1.00  0.00           H  
CONECT    1    9   27   28   29                                       
CONECT    2   23   30   31   32                                       
CONECT    3   24   33   34   35                                       
CONECT    4   14   14   19   36                                       
CONECT    5    7    7    6   37                                       
CONECT    6   16   16    5   38                                       
CONECT    7   17    5    5   39                                       
CONECT    8   24   15   15   40                                       
CONECT    9    1   20   41   42                                       
CONECT   10   20   26   43   44                                       
CONECT   11   15   21   45   46                                       
CONECT   12   23   19   47   48                                       
CONECT   13   19   22   25   25                                       
CONECT   14   21   16    4    4                                       
CONECT   15    8    8   11   18                                       
CONECT   16   18   14    6    6                                       
CONECT   17   24   18   18    7                                       
CONECT   18   15   17   17   16                                       
CONECT   19   12    4   13   49                                       
CONECT   20   22    9   10   50                                       
CONECT   21   11   23   14   51                                       
CONECT   22   13   20   52                                            
CONECT   23    2   21   12                                            
CONECT   24    3    8   17                                            
CONECT   25   13   13                                                 
CONECT   26   10   53                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   26                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
