COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1       4.767  -1.652  -0.895  1.00  0.00           N  
HETATM    2  C   UNK     1       4.313  -1.224   0.435  1.00  0.00           C  
HETATM    3  C   UNK     1       3.158  -0.267   0.289  1.00  0.00           C  
HETATM    4  N   UNK     1       1.902  -0.602   0.251  1.00  0.00           N  
HETATM    5  C   UNK     1       1.158   0.526   0.111  1.00  0.00           C  
HETATM    6  C   UNK     1      -0.316   0.600   0.025  1.00  0.00           C  
HETATM    7  N   UNK     1      -1.123  -0.417   0.072  1.00  0.00           N  
HETATM    8  C   UNK     1      -2.416  -0.132  -0.023  1.00  0.00           C  
HETATM    9  C   UNK     1      -3.457  -1.171   0.014  1.00  0.00           C  
HETATM   10  O   UNK     1      -4.629  -0.861  -0.076  1.00  0.00           O  
HETATM   11  C   UNK     1      -2.707   1.181  -0.154  1.00  0.00           C  
HETATM   12  S   UNK     1      -1.252   2.080  -0.148  1.00  0.00           S  
HETATM   13  C   UNK     1       2.022   1.573   0.064  1.00  0.00           C  
HETATM   14  O   UNK     1       3.262   1.064   0.182  1.00  0.00           O  
HETATM   15  H   UNK     1       5.541  -2.295  -0.823  1.00  0.00           H  
HETATM   16  H   UNK     1       4.008  -2.057  -1.422  1.00  0.00           H  
HETATM   17  H   UNK     1       3.993  -2.094   1.008  1.00  0.00           H  
HETATM   18  H   UNK     1       5.132  -0.727   0.956  1.00  0.00           H  
HETATM   19  H   UNK     1      -3.699   1.597  -0.245  1.00  0.00           H  
HETATM   20  H   UNK     1       1.762   2.616  -0.043  1.00  0.00           H  
HETATM   21  O   UNK     1      -3.112  -2.467   0.147  1.00  0.00           O  
HETATM   22  H   UNK     1      -3.831  -3.114   0.166  1.00  0.00           H  
CONECT    1    2   15   16                                            
CONECT    2    1    3   17   18                                       
CONECT    3    4    4    2   14                                       
CONECT    4    3    3    5                                            
CONECT    5    4    6   13   13                                       
CONECT    6   12    7    7    5                                       
CONECT    7    8    6    6                                            
CONECT    8   11   11    9    7                                       
CONECT    9   10   10    8   21                                       
CONECT   10    9    9                                                 
CONECT   11    8    8   12   19                                       
CONECT   12   11    6                                                 
CONECT   13    5    5   14   20                                       
CONECT   14    3   13                                                 
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    2                                                      
CONECT   18    2                                                      
CONECT   19   11                                                      
CONECT   20   13                                                      
CONECT   21    9   22                                                 
CONECT   22   21                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
