COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1       4.018  -0.416  -0.866  1.00  0.00           N  
HETATM    2  C   UNK     1       2.927   0.557  -0.720  1.00  0.00           C  
HETATM    3  C   UNK     1       3.453   1.806  -0.063  1.00  0.00           C  
HETATM    4  O   UNK     1       4.481   1.769   0.571  1.00  0.00           O  
HETATM    5  C   UNK     1       1.818  -0.046   0.144  1.00  0.00           C  
HETATM    6  C   UNK     1      -1.299  -0.804   0.125  1.00  0.00           C  
HETATM    7  C   UNK     1      -1.510   0.178   1.076  1.00  0.00           C  
HETATM    8  C   UNK     1      -2.618   0.996   0.994  1.00  0.00           C  
HETATM    9  C   UNK     1      -3.527   0.830  -0.053  1.00  0.00           C  
HETATM   10  C   UNK     1      -4.680   1.676  -0.145  1.00  0.00           C  
HETATM   11  C   UNK     1      -3.309  -0.163  -1.009  1.00  0.00           C  
HETATM   12  C   UNK     1      -2.193  -0.970  -0.918  1.00  0.00           C  
HETATM   13  N   UNK     1      -5.594   2.346  -0.218  1.00  0.00           N  
HETATM   14  O   UNK     1      -0.196  -3.032  -0.476  1.00  0.00           O  
HETATM   15  O   UNK     1       1.240  -1.163  -0.535  1.00  0.00           O  
HETATM   16  O   UNK     1       0.512  -1.839   1.603  1.00  0.00           O  
HETATM   17  S   UNK     1       0.119  -1.844   0.238  1.00  0.00           S  
HETATM   18  H   UNK     1       4.734  -0.067  -1.485  1.00  0.00           H  
HETATM   19  H   UNK     1       4.405  -0.662   0.032  1.00  0.00           H  
HETATM   20  H   UNK     1       2.527   0.805  -1.704  1.00  0.00           H  
HETATM   21  H   UNK     1       2.237  -0.375   1.095  1.00  0.00           H  
HETATM   22  H   UNK     1       1.050   0.706   0.326  1.00  0.00           H  
HETATM   23  H   UNK     1      -0.806   0.305   1.885  1.00  0.00           H  
HETATM   24  H   UNK     1      -2.781   1.762   1.737  1.00  0.00           H  
HETATM   25  H   UNK     1      -4.008  -0.297  -1.821  1.00  0.00           H  
HETATM   26  H   UNK     1      -2.020  -1.736  -1.659  1.00  0.00           H  
HETATM   27  O   UNK     1       2.780   2.961  -0.180  1.00  0.00           O  
HETATM   28  H   UNK     1       3.156   3.736   0.259  1.00  0.00           H  
CONECT    1    2   18   19                                            
CONECT    2    1    3    5   20                                       
CONECT    3    2    4    4   27                                       
CONECT    4    3    3                                                 
CONECT    5    2   15   21   22                                       
CONECT    6    7   17   12   12                                       
CONECT    7    8    8    6   23                                       
CONECT    8    7    7    9   24                                       
CONECT    9    8   10   11   11                                       
CONECT   10   13   13   13    9                                       
CONECT   11    9    9   12   25                                       
CONECT   12    6    6   11   26                                       
CONECT   13   10   10   10                                            
CONECT   14   17   17                                                 
CONECT   15   17    5                                                 
CONECT   16   17   17                                                 
CONECT   17   14   14    6   16                                       
CONECT   17   16   15                                                 
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    2                                                      
CONECT   21    5                                                      
CONECT   22    5                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27    3   28                                                 
CONECT   28   27                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
