COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.525   1.299   0.009  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.390   0.100  -0.123  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.472  -0.702  -0.141  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.742  -0.158  -0.007  1.00  0.00           C  
HETATM    5  N   UNL     1      -3.089   1.105   0.150  1.00  0.00           N  
HETATM    6  S   UNL     1      -4.279  -0.964   0.002  1.00  0.00           S  
HETATM    7  C   UNL     1      -5.301   0.486   0.214  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.355   1.457   0.257  1.00  0.00           C  
HETATM    9  O   UNL     1       1.111  -1.685  -0.399  1.00  0.00           O  
HETATM   10  C   UNL     1       0.976  -0.486  -0.267  1.00  0.00           C  
HETATM   11  N   UNL     1       2.059   0.317  -0.255  1.00  0.00           N  
HETATM   12  C   UNL     1       3.398  -0.258  -0.402  1.00  0.00           C  
HETATM   13  C   UNL     1       4.364   0.796  -0.972  1.00  0.00           C  
HETATM   14  C   UNL     1       3.954  -0.663   0.979  1.00  0.00           C  
HETATM   15  C   UNL     1       5.463  -0.324   0.896  1.00  0.00           C  
HETATM   16  C   UNL     1       5.473   0.994   0.082  1.00  0.00           C  
HETATM   17  H   UNL     1      -1.364  -1.661  -0.246  1.00  0.00           H  
HETATM   18  H   UNL     1      -6.376   0.567   0.288  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.632   2.493   0.381  1.00  0.00           H  
HETATM   20  H   UNL     1       1.951   1.275  -0.149  1.00  0.00           H  
HETATM   21  H   UNL     1       3.362  -1.126  -1.060  1.00  0.00           H  
HETATM   22  H   UNL     1       4.797   0.439  -1.906  1.00  0.00           H  
HETATM   23  H   UNL     1       3.836   1.735  -1.139  1.00  0.00           H  
HETATM   24  H   UNL     1       3.475  -0.083   1.768  1.00  0.00           H  
HETATM   25  H   UNL     1       3.811  -1.730   1.150  1.00  0.00           H  
HETATM   26  H   UNL     1       6.006  -1.107   0.369  1.00  0.00           H  
HETATM   27  H   UNL     1       5.879  -0.166   1.891  1.00  0.00           H  
HETATM   28  H   UNL     1       6.439   1.136  -0.402  1.00  0.00           H  
HETATM   29  H   UNL     1       5.239   1.842   0.727  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   10                                       
CONECT    3    2    4   17                                            
CONECT    4    3    5    5    6                                       
CONECT    5    4    4    8                                            
CONECT    6    4    7                                                 
CONECT    7    6    8    8   18                                       
CONECT    8    5    7    7   19                                       
CONECT    9   10   10                                                 
CONECT   10    2    9    9   11                                       
CONECT   11   10   12   20                                            
CONECT   12   11   13   14   21                                       
CONECT   13   12   16   22   23                                       
CONECT   14   12   15   24   25                                       
CONECT   15   14   16   26   27                                       
CONECT   16   13   15   28   29                                       
CONECT   17    3                                                      
CONECT   18    7                                                      
CONECT   19    8                                                      
CONECT   20   11                                                      
CONECT   21   12                                                      
CONECT   22   13                                                      
CONECT   23   13                                                      
CONECT   24   14                                                      
CONECT   25   14                                                      
CONECT   26   15                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
CONECT   29   16                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
