COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.095  -0.100   0.232  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.202  -0.966  -0.373  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.221  -0.782  -1.892  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.939  -2.436  -0.040  1.00  0.00           C  
HETATM    5  O   UNL     1       2.548   1.743  -0.381  1.00  0.00           O  
HETATM    6  O   UNL     1       2.717   0.155   1.573  1.00  0.00           O  
HETATM    7  O   UNL     1       1.167  -0.493  -0.311  1.00  0.00           O  
HETATM    8  P   UNL     1       2.556   0.208   0.103  1.00  0.00           P  
HETATM    9  O   UNL     1      -2.581  -0.835   1.607  1.00  0.00           O  
HETATM   10  O   UNL     1      -2.733   1.690   0.945  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.553  -0.545   0.208  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.752   0.934  -0.003  1.00  0.00           C  
HETATM   13  N   UNL     1      -2.952   1.416  -1.245  1.00  0.00           N  
HETATM   14  H   UNL     1      -0.282   0.947  -0.005  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.081  -0.231   1.314  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.305  -1.191  -2.318  1.00  0.00           H  
HETATM   17  H   UNL     1      -2.081  -1.305  -2.310  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.290   0.279  -2.129  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.005  -2.582   1.038  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.681  -3.060  -0.538  1.00  0.00           H  
HETATM   21  H   UNL     1       0.058  -2.713  -0.383  1.00  0.00           H  
HETATM   22  H   UNL     1       2.446   1.854  -1.336  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.897  -0.379   2.117  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.351  -1.094  -0.292  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.009   2.374  -1.390  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.040   0.806  -1.994  1.00  0.00           H  
HETATM   27  O   UNL     1       3.780  -0.569  -0.599  1.00  0.00           O  
HETATM   28  H   UNL     1       4.649  -0.201  -0.393  1.00  0.00           H  
CONECT    1    7    2   14   15                                       
CONECT    2    1    4   11    3                                       
CONECT    3    2   16   17   18                                       
CONECT    4    2   19   20   21                                       
CONECT    5    8   22                                                 
CONECT    6    8    8                                                 
CONECT    7    8    1                                                 
CONECT    8    5    6    6    7                                       
CONECT    8   27                                                      
CONECT    9   11   23                                                 
CONECT   10   12   12                                                 
CONECT   11    2    9   12   24                                       
CONECT   12   11   10   10   13                                       
CONECT   13   12   25   26                                            
CONECT   14    1                                                      
CONECT   15    1                                                      
CONECT   16    3                                                      
CONECT   17    3                                                      
CONECT   18    3                                                      
CONECT   19    4                                                      
CONECT   20    4                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    9                                                      
CONECT   24   11                                                      
CONECT   25   13                                                      
CONECT   26   13                                                      
CONECT   27    8   28                                                 
CONECT   28   27                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
