COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -1.314   0.545  -1.057  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.439   0.019   0.028  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.807  -0.121   0.644  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.854   0.478  -0.297  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.225   0.449   0.381  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.248   1.160  -0.508  1.00  0.00           C  
HETATM    7  N   UNL     1      -7.561   1.132   0.142  1.00  0.00           N  
HETATM    8  C   UNL     1      -8.424   0.088  -0.095  1.00  0.00           C  
HETATM    9  N   UNL     1      -9.592   0.064   0.483  1.00  0.00           N  
HETATM   10  N   UNL     1      -8.054  -0.931  -0.941  1.00  0.00           N  
HETATM   11  C   UNL     1      -7.956   2.218   1.043  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.904  -0.308  -1.537  1.00  0.00           N  
HETATM   13  N   UNL     1      -0.355  -0.442   0.683  1.00  0.00           N  
HETATM   14  C   UNL     1       0.975  -0.306   0.084  1.00  0.00           C  
HETATM   15  C   UNL     1       1.540   1.052   0.411  1.00  0.00           C  
HETATM   16  C   UNL     1       2.769   1.188   0.822  1.00  0.00           C  
HETATM   17  C   UNL     1       1.905  -1.384   0.649  1.00  0.00           C  
HETATM   18  C   UNL     1       1.491  -2.738   0.134  1.00  0.00           C  
HETATM   19  O   UNL     1       0.306  -3.258   0.490  1.00  0.00           O  
HETATM   20  O   UNL     1       2.227  -3.357  -0.598  1.00  0.00           O  
HETATM   21  O   UNL     1       3.243  -1.100   0.232  1.00  0.00           O  
HETATM   22  C   UNL     1       3.692   0.017   0.996  1.00  0.00           C  
HETATM   23  N   UNL     1       5.037   0.392   0.554  1.00  0.00           N  
HETATM   24  C   UNL     1       6.058   0.440   1.454  1.00  0.00           C  
HETATM   25  C   UNL     1       7.298   0.789   1.032  1.00  0.00           C  
HETATM   26  C   UNL     1       7.495   1.093  -0.328  1.00  0.00           C  
HETATM   27  O   UNL     1       8.722   1.444  -0.774  1.00  0.00           O  
HETATM   28  N   UNL     1       6.473   1.033  -1.168  1.00  0.00           N  
HETATM   29  C   UNL     1       5.260   0.684  -0.741  1.00  0.00           C  
HETATM   30  O   UNL     1       4.335   0.636  -1.534  1.00  0.00           O  
HETATM   31  H   UNL     1      -2.832   0.407   1.598  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.026  -1.176   0.807  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.586   1.508  -0.531  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.165   0.957   1.344  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.533  -0.585   0.534  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.308   0.652  -1.470  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.940   2.194  -0.661  1.00  0.00           H  
HETATM   38  H   UNL     1     -10.200  -0.673   0.315  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.662  -1.667  -1.108  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.184  -0.913  -1.371  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.150   2.949   1.106  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.855   2.700   0.660  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.156   1.812   2.035  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.155  -1.250  -1.274  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.673   0.055  -2.080  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.455  -0.863   1.551  1.00  0.00           H  
HETATM   47  H   UNL     1       0.901  -0.419  -0.998  1.00  0.00           H  
HETATM   48  H   UNL     1       0.916   1.927   0.303  1.00  0.00           H  
HETATM   49  H   UNL     1       3.137   2.179   1.044  1.00  0.00           H  
HETATM   50  H   UNL     1       1.852  -1.375   1.738  1.00  0.00           H  
HETATM   51  H   UNL     1       0.041  -4.128   0.159  1.00  0.00           H  
HETATM   52  H   UNL     1       3.725  -0.260   2.050  1.00  0.00           H  
HETATM   53  H   UNL     1       5.881   0.203   2.493  1.00  0.00           H  
HETATM   54  H   UNL     1       8.122   0.834   1.729  1.00  0.00           H  
HETATM   55  H   UNL     1       8.637   1.607  -1.724  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   13                                       
CONECT    3    2    4   31   32                                       
CONECT    4    3    5   12   33                                       
CONECT    5    4    6   34   35                                       
CONECT    6    5    7   36   37                                       
CONECT    7    6    8   11                                            
CONECT    8    7    9    9   10                                       
CONECT    9    8    8   38                                            
CONECT   10    8   39   40                                            
CONECT   11    7   41   42   43                                       
CONECT   12    4   44   45                                            
CONECT   13    2   14   46                                            
CONECT   14   13   15   17   47                                       
CONECT   15   14   16   16   48                                       
CONECT   16   15   15   22   49                                       
CONECT   17   14   18   21   50                                       
CONECT   18   17   19   20   20                                       
CONECT   19   18   51                                                 
CONECT   20   18   18                                                 
CONECT   21   17   22                                                 
CONECT   22   16   21   23   52                                       
CONECT   23   22   24   29                                            
CONECT   24   23   25   25   53                                       
CONECT   25   24   24   26   54                                       
CONECT   26   25   27   28   28                                       
CONECT   27   26   55                                                 
CONECT   28   26   26   29                                            
CONECT   29   23   28   30   30                                       
CONECT   30   29   29                                                 
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   22                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
