COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.018  -0.089   0.425  1.00  0.00           C  
HETATM    2  C   UNL     1       5.699  -1.212  -0.074  1.00  0.00           C  
HETATM    3  C   UNL     1       7.070  -1.336   0.206  1.00  0.00           C  
HETATM    4  C   UNL     1       3.630  -1.378  -0.703  1.00  0.00           C  
HETATM    5  N   UNL     1       7.657  -0.387   0.929  1.00  0.00           N  
HETATM    6  C   UNL     1       6.975   0.651   1.377  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.780  -1.715  -1.546  1.00  0.00           O  
HETATM    8  P   UNL     1      -2.937  -1.030  -0.243  1.00  0.00           P  
HETATM    9  O   UNL     1      -3.294  -2.113   0.893  1.00  0.00           O  
HETATM   10  N   UNL     1      -4.178   0.101  -0.350  1.00  0.00           N  
HETATM   11  C   UNL     1      -5.465  -0.553  -0.703  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.439   0.732   0.969  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.873   1.293   0.856  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.548   0.447  -0.244  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.737  -0.289   0.317  1.00  0.00           C  
HETATM   16  O   UNL     1      -7.759  -1.497   0.307  1.00  0.00           O  
HETATM   17  O   UNL     1      -8.771   0.396   0.829  1.00  0.00           O  
HETATM   18  O   UNL     1      -1.562  -0.284   0.140  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.869   0.581  -0.762  1.00  0.00           C  
HETATM   20  C   UNL     1       0.392   1.120  -0.084  1.00  0.00           C  
HETATM   21  C   UNL     1       1.113   2.125  -1.009  1.00  0.00           C  
HETATM   22  O   UNL     1       0.779   3.467  -0.647  1.00  0.00           O  
HETATM   23  C   UNL     1       2.614   1.853  -0.763  1.00  0.00           C  
HETATM   24  O   UNL     1       3.256   3.017  -0.241  1.00  0.00           O  
HETATM   25  C   UNL     1       2.622   0.715   0.282  1.00  0.00           C  
HETATM   26  O   UNL     1       1.346   0.055   0.123  1.00  0.00           O  
HETATM   27  N   UNL     1       3.717  -0.219   0.009  1.00  0.00           N  
HETATM   28  N   UNL     1       5.690   0.811   1.135  1.00  0.00           N  
HETATM   29  N   UNL     1       7.793  -2.420  -0.259  1.00  0.00           N  
HETATM   30  N   UNL     1       4.795  -1.956  -0.756  1.00  0.00           N  
HETATM   31  H   UNL     1       2.729  -1.757  -1.163  1.00  0.00           H  
HETATM   32  H   UNL     1       7.490   1.399   1.961  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.411  -1.734   1.775  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.527  -0.713  -1.779  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.569  -1.499  -0.172  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.383  -0.012   1.764  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.727   1.537   1.153  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.401   1.174   1.802  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.847   2.343   0.566  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.853   1.083  -1.076  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.511  -0.120   1.177  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.590   0.025  -1.657  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.517   1.413  -1.038  1.00  0.00           H  
HETATM   44  H   UNL     1       0.139   1.592   0.866  1.00  0.00           H  
HETATM   45  H   UNL     1       0.856   1.937  -2.051  1.00  0.00           H  
HETATM   46  H   UNL     1       1.204   4.140  -1.196  1.00  0.00           H  
HETATM   47  H   UNL     1       3.098   1.529  -1.684  1.00  0.00           H  
HETATM   48  H   UNL     1       3.280   3.763  -0.855  1.00  0.00           H  
HETATM   49  H   UNL     1       2.713   1.124   1.288  1.00  0.00           H  
HETATM   50  H   UNL     1       7.354  -3.106  -0.785  1.00  0.00           H  
HETATM   51  H   UNL     1       8.739  -2.494  -0.058  1.00  0.00           H  
CONECT    1    2   27   28   28                                       
CONECT    2    3    3   30    1                                       
CONECT    3   29    2    2    5                                       
CONECT    4   30   30   27   31                                       
CONECT    5    3    6    6                                            
CONECT    6    5    5   28   32                                       
CONECT    7    8    8                                                 
CONECT    8   18   10    7    7                                       
CONECT    8    9                                                      
CONECT    9    8   33                                                 
CONECT   10   12   11    8                                            
CONECT   11   14   10   34   35                                       
CONECT   12   13   10   36   37                                       
CONECT   13   14   12   38   39                                       
CONECT   14   15   13   11   40                                       
CONECT   15   16   16   17   14                                       
CONECT   16   15   15                                                 
CONECT   17   15   41                                                 
CONECT   18   19    8                                                 
CONECT   19   20   18   42   43                                       
CONECT   20   21   26   19   44                                       
CONECT   21   23   22   20   45                                       
CONECT   22   21   46                                                 
CONECT   23   24   25   21   47                                       
CONECT   24   23   48                                                 
CONECT   25   27   23   26   49                                       
CONECT   26   25   20                                                 
CONECT   27    4    1   25                                            
CONECT   28    1    1    6                                            
CONECT   29    3   50   51                                            
CONECT   30    2    4    4                                            
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
