COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.175   1.155   0.037  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.592  -0.926  -1.218  1.00  0.00           C  
HETATM    3  C   UNL     1       1.891   0.118  -0.061  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.530  -0.220  -0.026  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.837   0.329   0.005  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.285  -0.090   0.026  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.557  -0.923   1.280  1.00  0.00           C  
HETATM    8  N   UNL     1       4.165   0.065   1.488  1.00  0.00           N  
HETATM    9  N   UNL     1       1.154   1.183  -0.052  1.00  0.00           N  
HETATM   10  N   UNL     1      -0.096   1.005  -0.034  1.00  0.00           N  
HETATM   11  N   UNL     1      -1.866  -0.606  -0.007  1.00  0.00           N  
HETATM   12  O   UNL     1       4.015  -1.187  -0.633  1.00  0.00           O  
HETATM   13  O   UNL     1       4.077   1.312  -0.639  1.00  0.00           O  
HETATM   14  O   UNL     1      -2.546   1.506   0.000  1.00  0.00           O  
HETATM   15  S   UNL     1       3.653   0.074  -0.086  1.00  0.00           S  
HETATM   16  S   UNL     1       0.816  -1.280  -0.036  1.00  0.00           S  
HETATM   17  H   UNL     1      -4.981   1.748  -0.856  1.00  0.00           H  
HETATM   18  H   UNL     1      -6.222   0.852   0.052  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.956   1.750   0.923  1.00  0.00           H  
HETATM   20  H   UNL     1      -4.398  -0.332  -2.111  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.958  -1.812  -1.226  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.639  -1.228  -1.203  1.00  0.00           H  
HETATM   23  H   UNL     1      -5.604  -1.225   1.295  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.923  -1.809   1.273  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.338  -0.327   2.167  1.00  0.00           H  
HETATM   26  H   UNL     1       3.517   0.083   2.210  1.00  0.00           H  
HETATM   27  H   UNL     1       5.114   0.041   1.689  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.099  -1.547  -0.003  1.00  0.00           H  
CONECT    1    6   17   18   19                                       
CONECT    2    6   20   21   22                                       
CONECT    3   16    9    9   15                                       
CONECT    4   11   10   10   16                                       
CONECT    5    6   11   14   14                                       
CONECT    6    7    1    5    2                                       
CONECT    7    6   23   24   25                                       
CONECT    8   15   26   27                                            
CONECT    9   10    3    3                                            
CONECT   10    4    4    9                                            
CONECT   11    5    4   28                                            
CONECT   12   15   15                                                 
CONECT   13   15   15                                                 
CONECT   14    5    5                                                 
CONECT   15    3    8   12   12                                       
CONECT   15   13   13                                                 
CONECT   16    4    3                                                 
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    2                                                      
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    7                                                      
CONECT   24    7                                                      
CONECT   25    7                                                      
CONECT   26    8                                                      
CONECT   27    8                                                      
CONECT   28   11                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
