COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.073   2.049   0.258  1.00  0.00           C  
HETATM    2  O   UNL     1      -4.495   0.734  -0.102  1.00  0.00           O  
HETATM    3  C   UNL     1      -3.580   0.126  -1.018  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.384  -0.819  -1.916  1.00  0.00           C  
HETATM    5  O   UNL     1      -5.279  -0.062  -2.730  1.00  0.00           O  
HETATM    6  C   UNL     1      -3.476  -1.644  -2.826  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.766  -0.756  -3.695  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.479  -2.447  -1.989  1.00  0.00           C  
HETATM    9  O   UNL     1      -1.634  -3.174  -2.879  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.634  -1.535  -1.094  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.845  -2.344  -0.216  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.503  -0.622  -0.223  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.639   0.333   0.400  1.00  0.00           O  
HETATM   14  O   UNL     1      -4.543   3.036  -0.663  1.00  0.00           O  
HETATM   15  C   UNL     1      -5.969   3.162  -0.713  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.278   4.214  -1.776  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.527   3.554   0.662  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.053   2.568   1.734  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.536   2.352   1.689  1.00  0.00           C  
HETATM   20  N   UNL     1      -3.819   3.526   2.195  1.00  0.00           N  
HETATM   21  N   UNL     1      -7.975   3.565   0.635  1.00  0.00           N  
HETATM   22  C   UNL     1      -8.749   4.384   1.416  1.00  0.00           C  
HETATM   23  N   UNL     1      -8.351   5.255   2.288  1.00  0.00           N  
HETATM   24  C   UNL     1     -10.236   4.250   1.244  1.00  0.00           C  
HETATM   25  O   UNL     1     -10.899   3.472   1.897  1.00  0.00           O  
HETATM   26  O   UNL     1     -10.646   5.100   0.293  1.00  0.00           O  
HETATM   27  H   UNL     1      -2.980   2.047   0.203  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.142   0.947  -1.597  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.005  -1.481  -1.301  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.173  -0.364  -2.509  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.063  -2.302  -3.476  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.943  -0.531  -3.238  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.006  -3.189  -1.378  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.219  -3.703  -3.443  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.920  -0.952  -1.688  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.093  -2.658  -0.740  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.960  -1.192   0.596  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.347  -0.068   1.232  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.398   2.210  -1.052  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.176   4.778  -1.510  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.446   4.917  -1.874  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.444   3.740  -2.749  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.173   4.558   0.926  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.364   2.913   2.728  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.551   1.599   1.586  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.290   1.506   2.341  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.033   4.409   1.791  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.018   3.371   2.763  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.417   2.919  -0.010  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.327   5.279   2.339  1.00  0.00           H  
HETATM   51  H   UNL     1     -11.614   5.050   0.142  1.00  0.00           H  
CONECT    1   14    2   19   27                                       
CONECT    2    1    3                                                 
CONECT    3    2   12    4   28                                       
CONECT    4    3    6    5   29                                       
CONECT    5    4   30                                                 
CONECT    6    4    7    8   31                                       
CONECT    7    6   32                                                 
CONECT    8    6   10    9   33                                       
CONECT    9    8   34                                                 
CONECT   10    8   11   12   35                                       
CONECT   11   10   36                                                 
CONECT   12    3   10   13   37                                       
CONECT   13   12   38                                                 
CONECT   14    1   15                                                 
CONECT   15   14   16   17   39                                       
CONECT   16   15   40   41   42                                       
CONECT   17   15   18   21   43                                       
CONECT   18   17   19   44   45                                       
CONECT   19    1   18   20   46                                       
CONECT   20   19   47   48                                            
CONECT   21   17   22   49                                            
CONECT   22   21   23   23   24                                       
CONECT   23   22   22   50                                            
CONECT   24   22   25   25   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   51                                                 
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   26                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
