COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.274   2.705   0.015  1.00  0.00           C  
HETATM    2  C   UNL     1       3.236  -0.918  -0.057  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.499  -0.175   1.155  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.530   0.530  -0.126  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.095   0.074  -0.068  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.376  -0.093  -1.238  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.061  -0.510  -1.189  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.459  -0.762   0.038  1.00  0.00           C  
HETATM    9  S   UNL     1       0.219  -1.293   0.106  1.00  0.00           S  
HETATM   10  C   UNL     1       1.037   0.267   0.065  1.00  0.00           C  
HETATM   11  N   UNL     1       0.326   1.385   0.114  1.00  0.00           N  
HETATM   12  C   UNL     1       0.898   2.572   0.087  1.00  0.00           C  
HETATM   13  C   UNL     1       3.067   1.572  -0.034  1.00  0.00           C  
HETATM   14  C   UNL     1       2.440   0.320  -0.008  1.00  0.00           C  
HETATM   15  O   UNL     1       2.681  -1.998  -0.035  1.00  0.00           O  
HETATM   16  O   UNL     1       4.581  -0.852  -0.127  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.184  -0.592   1.212  1.00  0.00           C  
HETATM   18  H   UNL     1       2.725   3.686  -0.007  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.061  -0.039   2.067  1.00  0.00           H  
HETATM   20  H   UNL     1      -5.568   1.618  -0.090  1.00  0.00           H  
HETATM   21  H   UNL     1      -5.985   0.181  -1.053  1.00  0.00           H  
HETATM   22  H   UNL     1      -6.076   0.119   0.724  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.845   0.104  -2.191  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.501  -0.641  -2.103  1.00  0.00           H  
HETATM   25  H   UNL     1       0.281   3.458   0.121  1.00  0.00           H  
HETATM   26  H   UNL     1       4.142   1.652  -0.090  1.00  0.00           H  
HETATM   27  H   UNL     1       5.060  -1.691  -0.157  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.719  -0.787   2.167  1.00  0.00           H  
CONECT    1   13   12   12   18                                       
CONECT    2   15   15   16   14                                       
CONECT    3   17   17    5   19                                       
CONECT    4    5   20   21   22                                       
CONECT    5    3    4    6    6                                       
CONECT    6    5    5    7   23                                       
CONECT    7    8    8    6   24                                       
CONECT    8   17    9    7    7                                       
CONECT    9    8   10                                                 
CONECT   10   14    9   11   11                                       
CONECT   11   10   10   12                                            
CONECT   12    1    1   11   25                                       
CONECT   13   14   14    1   26                                       
CONECT   14    2   13   13   10                                       
CONECT   15    2    2                                                 
CONECT   16    2   27                                                 
CONECT   17    3    3    8   28                                       
CONECT   18    1                                                      
CONECT   19    3                                                      
CONECT   20    4                                                      
CONECT   21    4                                                      
CONECT   22    4                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
CONECT   27   16                                                      
CONECT   28   17                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
