COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.024  -1.031 -16.580  1.00  0.00           C  
HETATM    2  N   UNL     1      11.389  -0.572 -16.893  1.00  0.00           N  
HETATM    3  O   UNL     1      14.676   0.123 -18.153  1.00  0.00           O  
HETATM    4  C   UNL     1      10.129  -0.105 -16.754  1.00  0.00           C  
HETATM    5  N   UNL     1      13.996  -0.762 -16.178  1.00  0.00           N  
HETATM    6  O   UNL     1       9.873   1.085 -16.829  1.00  0.00           O  
HETATM    7  C   UNL     1      12.369   0.312 -17.530  1.00  0.00           C  
HETATM    8  O   UNL     1       3.127   4.786 -17.759  1.00  0.00           O  
HETATM    9  C   UNL     1      13.802  -0.089 -17.314  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.620   3.494 -15.555  1.00  0.00           O  
HETATM   11  C   UNL     1      13.185  -1.908 -15.777  1.00  0.00           C  
HETATM   12  O   UNL     1       1.301   3.666 -14.424  1.00  0.00           O  
HETATM   13  C   UNL     1      14.969  -0.294 -15.198  1.00  0.00           C  
HETATM   14  C   UNL     1       5.004   0.718 -16.393  1.00  0.00           C  
HETATM   15  C   UNL     1       3.915   1.547 -16.201  1.00  0.00           C  
HETATM   16  C   UNL     1       3.794   2.701 -16.968  1.00  0.00           C  
HETATM   17  C   UNL     1       4.727   3.029 -17.946  1.00  0.00           C  
HETATM   18  C   UNL     1       1.325   3.437 -16.833  1.00  0.00           C  
HETATM   19  C   UNL     1       0.675   3.553 -15.479  1.00  0.00           C  
HETATM   20  C   UNL     1       5.811   2.178 -18.127  1.00  0.00           C  
HETATM   21  C   UNL     1       2.796   3.814 -16.784  1.00  0.00           C  
HETATM   22  B   UNL     1       4.281   4.471 -18.544  1.00  0.00           B  
HETATM   23  C   UNL     1       5.965   1.031 -17.352  1.00  0.00           C  
HETATM   24  C   UNL     1       7.200   0.229 -17.584  1.00  0.00           C  
HETATM   25  O   UNL     1       7.624   0.045 -18.726  1.00  0.00           O  
HETATM   26  N   UNL     1       7.792  -0.276 -16.500  1.00  0.00           N  
HETATM   27  C   UNL     1      11.835  -1.931 -16.521  1.00  0.00           C  
HETATM   28  H   UNL     1       8.981  -1.720 -17.436  1.00  0.00           H  
HETATM   29  H   UNL     1       9.166  -1.606 -15.653  1.00  0.00           H  
HETATM   30  H   UNL     1      12.231   1.326 -17.126  1.00  0.00           H  
HETATM   31  H   UNL     1      12.173   0.319 -18.612  1.00  0.00           H  
HETATM   32  H   UNL     1      12.996  -1.851 -14.695  1.00  0.00           H  
HETATM   33  H   UNL     1      13.735  -2.833 -16.005  1.00  0.00           H  
HETATM   34  H   UNL     1       0.692   3.702 -13.696  1.00  0.00           H  
HETATM   35  H   UNL     1      14.982  -0.979 -14.337  1.00  0.00           H  
HETATM   36  H   UNL     1      15.968  -0.265 -15.658  1.00  0.00           H  
HETATM   37  H   UNL     1      14.692   0.715 -14.859  1.00  0.00           H  
HETATM   38  H   UNL     1       5.111  -0.176 -15.797  1.00  0.00           H  
HETATM   39  H   UNL     1       3.166   1.301 -15.463  1.00  0.00           H  
HETATM   40  H   UNL     1       0.808   4.108 -17.535  1.00  0.00           H  
HETATM   41  H   UNL     1       1.235   2.398 -17.184  1.00  0.00           H  
HETATM   42  H   UNL     1       6.547   2.410 -18.882  1.00  0.00           H  
HETATM   43  H   UNL     1       2.980   4.250 -15.791  1.00  0.00           H  
HETATM   44  H   UNL     1       7.371  -0.128 -15.605  1.00  0.00           H  
HETATM   45  H   UNL     1      11.077  -2.388 -15.868  1.00  0.00           H  
HETATM   46  H   UNL     1      11.943  -2.533 -17.435  1.00  0.00           H  
HETATM   47  O   UNL     1       4.216   4.774 -19.899  1.00  0.00           O  
HETATM   48  H   UNL     1       3.372   5.162 -20.097  1.00  0.00           H  
CONECT    1    4   26   28   29                                       
CONECT    2    7    4   27                                            
CONECT    3    9    9                                                 
CONECT    4    2    6    6    1                                       
CONECT    5    9   11   13                                            
CONECT    6    4    4                                                 
CONECT    7    9    2   30   31                                       
CONECT    8   22   21                                                 
CONECT    9    3    3    7    5                                       
CONECT   10   19   19                                                 
CONECT   11   27    5   32   33                                       
CONECT   12   19   34                                                 
CONECT   13    5   35   36   37                                       
CONECT   14   23   23   15   38                                       
CONECT   15   16   16   14   39                                       
CONECT   16   17   21   15   15                                       
CONECT   17   22   20   20   16                                       
CONECT   18   21   19   40   41                                       
CONECT   19   18   10   10   12                                       
CONECT   20   17   17   23   42                                       
CONECT   21    8   16   18   43                                       
CONECT   22   17    8   47                                            
CONECT   23   20   24   14   14                                       
CONECT   24   25   25   23   26                                       
CONECT   25   24   24                                                 
CONECT   26   24    1   44                                            
CONECT   27    2   11   45   46                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   26                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   22   48                                                 
CONECT   48   47                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
