COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.712  -1.008  -0.226  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.019  -1.208   0.316  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.879   0.028   0.041  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.199   1.260   0.647  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.789   1.390   0.062  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.010   0.102   0.337  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.641   0.200  -0.286  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.119   2.494   0.675  1.00  0.00           O  
HETATM    9  O   UNL     1      -5.958   2.428   0.331  1.00  0.00           O  
HETATM   10  O   UNL     1      -7.168  -0.146   0.631  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.661  -2.433  -0.338  1.00  0.00           C  
HETATM   12  O   UNL     1      -4.921  -3.604   0.015  1.00  0.00           O  
HETATM   13  N   UNL     1      -0.451   0.032   0.353  1.00  0.00           N  
HETATM   14  C   UNL     1       0.513   0.211  -0.602  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.109   0.468  -1.732  1.00  0.00           N  
HETATM   16  N   UNL     1      -1.380   0.456  -1.540  1.00  0.00           N  
HETATM   17  C   UNL     1       1.975   0.130  -0.401  1.00  0.00           C  
HETATM   18  C   UNL     1       2.841   0.337  -1.478  1.00  0.00           C  
HETATM   19  C   UNL     1       4.203   0.261  -1.290  1.00  0.00           C  
HETATM   20  C   UNL     1       4.718  -0.022  -0.025  1.00  0.00           C  
HETATM   21  C   UNL     1       3.854  -0.229   1.050  1.00  0.00           C  
HETATM   22  C   UNL     1       2.492  -0.148   0.866  1.00  0.00           C  
HETATM   23  C   UNL     1       6.185  -0.103   0.176  1.00  0.00           C  
HETATM   24  C   UNL     1       6.703  -0.385   1.439  1.00  0.00           C  
HETATM   25  C   UNL     1       8.069  -0.460   1.620  1.00  0.00           C  
HETATM   26  C   UNL     1       8.924  -0.255   0.552  1.00  0.00           C  
HETATM   27  C   UNL     1       8.415   0.027  -0.703  1.00  0.00           C  
HETATM   28  C   UNL     1       7.051   0.098  -0.898  1.00  0.00           C  
HETATM   29  H   UNL     1      -4.945  -1.367   1.392  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.987   0.164  -1.036  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.136   1.145   1.729  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.855   1.554  -1.013  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.910  -0.040   1.413  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.562   3.344   0.545  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.584   3.247   0.684  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.768   0.600   0.495  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.689  -2.534   0.010  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.654  -2.312  -1.421  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.273  -4.420  -0.366  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.315  -0.171   1.291  1.00  0.00           H  
HETATM   41  H   UNL     1       2.442   0.556  -2.457  1.00  0.00           H  
HETATM   42  H   UNL     1       4.872   0.421  -2.122  1.00  0.00           H  
HETATM   43  H   UNL     1       4.254  -0.449   2.029  1.00  0.00           H  
HETATM   44  H   UNL     1       1.824  -0.303   1.699  1.00  0.00           H  
HETATM   45  H   UNL     1       6.037  -0.545   2.274  1.00  0.00           H  
HETATM   46  H   UNL     1       8.472  -0.679   2.598  1.00  0.00           H  
HETATM   47  H   UNL     1       9.992  -0.314   0.698  1.00  0.00           H  
HETATM   48  H   UNL     1       9.087   0.187  -1.534  1.00  0.00           H  
HETATM   49  H   UNL     1       6.655   0.313  -1.879  1.00  0.00           H  
CONECT    1    2    6                                                 
CONECT    2    3   11    1   29                                       
CONECT    3   10    4    2   30                                       
CONECT    4    9    3    5   31                                       
CONECT    5    4    8    6   32                                       
CONECT    6    5    1    7   33                                       
CONECT    7    6   16   16   13                                       
CONECT    8    5   34                                                 
CONECT    9    4   35                                                 
CONECT   10    3   36                                                 
CONECT   11   12    2   37   38                                       
CONECT   12   11   39                                                 
CONECT   13    7   14   40                                            
CONECT   14   15   15   13   17                                       
CONECT   15   16   14   14                                            
CONECT   16    7    7   15                                            
CONECT   17   14   18   18   22                                       
CONECT   18   17   17   19   41                                       
CONECT   19   18   20   20   42                                       
CONECT   20   19   19   21   23                                       
CONECT   21   22   22   20   43                                       
CONECT   22   17   21   21   44                                       
CONECT   23   20   24   24   28                                       
CONECT   24   23   23   25   45                                       
CONECT   25   24   26   26   46                                       
CONECT   26   25   25   27   47                                       
CONECT   27   28   28   26   48                                       
CONECT   28   23   27   27   49                                       
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
