COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.919   1.212   0.200  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.131   2.155   0.423  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.275   1.886  -0.556  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.882   0.616  -0.261  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.290   0.743  -0.555  1.00  0.00           C  
HETATM    6  N   UNL     1      -7.661  -2.065  -0.349  1.00  0.00           N  
HETATM    7  C   UNL     1      -6.869  -2.368   0.674  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.302  -1.159  -1.248  1.00  0.00           C  
HETATM    9  N   UNL     1      -6.149  -0.512  -1.179  1.00  0.00           N  
HETATM   10  C   UNL     1      -5.297  -0.754  -0.188  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.635  -1.706   0.788  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.641   2.162  -0.038  1.00  0.00           C  
HETATM   13  O   UNL     1      -4.782   2.685  -0.720  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.366   2.963  -0.397  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.550   3.673  -1.623  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.681  -0.918   1.305  1.00  0.00           C  
HETATM   17  N   UNL     1      -8.163  -0.879  -2.297  1.00  0.00           N  
HETATM   18  N   UNL     1      -7.252  -3.315   1.608  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.606  -1.757   1.669  1.00  0.00           N  
HETATM   20  N   UNL     1      -4.061  -0.274   0.164  1.00  0.00           N  
HETATM   21  O   UNL     1       1.954   0.843   2.588  1.00  0.00           O  
HETATM   22  O   UNL     1       5.105  -1.000   1.999  1.00  0.00           O  
HETATM   23  O   UNL     1       6.704  -2.707  -2.210  1.00  0.00           O  
HETATM   24  O   UNL     1       2.921   2.535   0.984  1.00  0.00           O  
HETATM   25  O   UNL     1       5.603   1.076   0.653  1.00  0.00           O  
HETATM   26  O   UNL     1       7.438  -0.194  -1.975  1.00  0.00           O  
HETATM   27  O   UNL     1       3.287   0.096   0.448  1.00  0.00           O  
HETATM   28  O   UNL     1       5.376  -1.094  -0.614  1.00  0.00           O  
HETATM   29  O   UNL     1       7.730  -1.832  -0.077  1.00  0.00           O  
HETATM   30  P   UNL     1       2.284   1.201   1.053  1.00  0.00           P  
HETATM   31  P   UNL     1       4.859  -0.203   0.622  1.00  0.00           P  
HETATM   32  P   UNL     1       6.832  -1.465  -1.195  1.00  0.00           P  
HETATM   33  H   UNL     1      -0.496   2.057   1.445  1.00  0.00           H  
HETATM   34  H   UNL     1       0.250   3.165   0.268  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.897   1.887  -1.578  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.466   0.669  -1.628  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.804   2.153   1.040  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.041   3.571  -0.431  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.108   3.651   0.409  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.264   4.324  -1.597  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.751  -0.754   1.829  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.012  -1.344  -2.364  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.917  -0.219  -2.964  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.107  -3.766   1.519  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.666  -3.529   2.351  1.00  0.00           H  
HETATM   46  H   UNL     1       1.535  -0.020   2.709  1.00  0.00           H  
HETATM   47  H   UNL     1       4.646  -1.850   2.048  1.00  0.00           H  
HETATM   48  H   UNL     1       7.545  -2.986  -2.599  1.00  0.00           H  
HETATM   49  H   UNL     1       6.900   0.102  -2.722  1.00  0.00           H  
CONECT    1   30    2                                                 
CONECT    2    1    3   33   34                                       
CONECT    3   14    2    4   35                                       
CONECT    4    3    5                                                 
CONECT    5   12    4   20   36                                       
CONECT    6    8    8    7                                            
CONECT    7   11   11    6   18                                       
CONECT    8    9   17    6    6                                       
CONECT    9   10   10    8                                            
CONECT   10   20    9    9   11                                       
CONECT   11   10   19    7    7                                       
CONECT   12   13   14    5   37                                       
CONECT   13   12   38                                                 
CONECT   14   15   12    3   39                                       
CONECT   15   14   40                                                 
CONECT   16   20   19   19   41                                       
CONECT   17    8   42   43                                            
CONECT   18    7   44   45                                            
CONECT   19   16   16   11                                            
CONECT   20    5   16   10                                            
CONECT   21   30   46                                                 
CONECT   22   31   47                                                 
CONECT   23   32   48                                                 
CONECT   24   30   30                                                 
CONECT   25   31   31                                                 
CONECT   26   32   49                                                 
CONECT   27   31   30                                                 
CONECT   28   32   31                                                 
CONECT   29   32   32                                                 
CONECT   30   24   24   27   21                                       
CONECT   30    1                                                      
CONECT   31   28   25   25   22                                       
CONECT   31   27                                                      
CONECT   32   29   29   23   28                                       
CONECT   32   26                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   26                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
