COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.801  -1.907  -0.456  1.00  0.00           C  
HETATM    2  C   UNL     1       3.215  -0.594  -0.164  1.00  0.00           C  
HETATM    3  C   UNL     1       4.902   0.973   0.017  1.00  0.00           C  
HETATM    4  C   UNL     1       2.677   1.683   0.518  1.00  0.00           C  
HETATM    5  N   UNL     1      -4.021   0.190   0.112  1.00  0.00           N  
HETATM    6  C   UNL     1      -3.410   1.338  -0.205  1.00  0.00           C  
HETATM    7  O   UNL     1      -3.941   2.420  -0.368  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.303  -0.911   0.257  1.00  0.00           C  
HETATM    9  C   UNL     1       2.252   0.371   0.228  1.00  0.00           C  
HETATM   10  C   UNL     1       0.902   0.009   0.320  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.860  -0.743   0.039  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.889  -1.687   0.118  1.00  0.00           C  
HETATM   13  C   UNL     1       0.524  -1.296   0.025  1.00  0.00           C  
HETATM   14  C   UNL     1       1.490  -2.244  -0.368  1.00  0.00           C  
HETATM   15  C   UNL     1       4.008   1.968   0.407  1.00  0.00           C  
HETATM   16  N   UNL     1       4.503  -0.247  -0.252  1.00  0.00           N  
HETATM   17  O   UNL     1      -3.801  -1.983   0.549  1.00  0.00           O  
HETATM   18  S   UNL     1      -1.679   0.981  -0.340  1.00  0.00           S  
HETATM   19  H   UNL     1       3.528  -2.648  -0.756  1.00  0.00           H  
HETATM   20  H   UNL     1       5.951   1.213  -0.067  1.00  0.00           H  
HETATM   21  H   UNL     1       1.970   2.441   0.820  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.982   0.167   0.238  1.00  0.00           H  
HETATM   23  H   UNL     1       0.162   0.736   0.618  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.154  -2.725   0.250  1.00  0.00           H  
HETATM   25  H   UNL     1       1.183  -3.254  -0.595  1.00  0.00           H  
HETATM   26  H   UNL     1       4.367   2.964   0.622  1.00  0.00           H  
CONECT    1    2    2   14   19                                       
CONECT    2    9   16    1    1                                       
CONECT    3   15   16   16   20                                       
CONECT    4   15   15    9   21                                       
CONECT    5    6    8   22                                            
CONECT    6    7    7    5   18                                       
CONECT    7    6    6                                                 
CONECT    8    5   11   17   17                                       
CONECT    9    4   10   10    2                                       
CONECT   10    9    9   13   23                                       
CONECT   11   18    8   12   12                                       
CONECT   12   11   11   13   24                                       
CONECT   13   10   12   14   14                                       
CONECT   14   13   13    1   25                                       
CONECT   15    4    4    3   26                                       
CONECT   16    3    3    2                                            
CONECT   17    8    8                                                 
CONECT   18    6   11                                                 
CONECT   19    1                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23   10                                                      
CONECT   24   12                                                      
CONECT   25   14                                                      
CONECT   26   15                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
