COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.230   1.862  -1.538  1.00  0.00           O  
HETATM    2  S   UNL     1      -0.201   1.827  -0.184  1.00  0.00           S  
HETATM    3  O   UNL     1      -0.787   2.941   0.474  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.366   0.510  -0.067  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.309   0.512   0.944  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.224  -0.518   1.039  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.338  -0.520  -0.989  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.253  -1.551  -0.903  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.196  -1.557   0.117  1.00  0.00           C  
HETATM   10  N   UNL     1      -4.123  -2.598   0.207  1.00  0.00           N  
HETATM   11  N   UNL     1       1.120   1.394   0.716  1.00  0.00           N  
HETATM   12  C   UNL     1       1.893   0.301   0.336  1.00  0.00           C  
HETATM   13  N   UNL     1       1.704  -0.471  -0.703  1.00  0.00           N  
HETATM   14  O   UNL     1       2.544  -1.339  -0.767  1.00  0.00           O  
HETATM   15  C   UNL     1       3.422  -1.257   0.243  1.00  0.00           C  
HETATM   16  C   UNL     1       3.049  -0.197   0.995  1.00  0.00           C  
HETATM   17  C   UNL     1       4.599  -2.165   0.489  1.00  0.00           C  
HETATM   18  H   UNL     1      -2.331   1.320   1.660  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.961  -0.516   1.829  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.600  -0.519  -1.777  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.229  -2.357  -1.622  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.110  -3.317  -0.444  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.781  -2.602   0.920  1.00  0.00           H  
HETATM   24  H   UNL     1       1.356   1.902   1.507  1.00  0.00           H  
HETATM   25  H   UNL     1       3.520   0.183   1.890  1.00  0.00           H  
HETATM   26  H   UNL     1       4.642  -2.924  -0.293  1.00  0.00           H  
HETATM   27  H   UNL     1       5.519  -1.580   0.477  1.00  0.00           H  
HETATM   28  H   UNL     1       4.488  -2.649   1.459  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    4   11    1    1                                       
CONECT    2    3    3                                                 
CONECT    3    2    2                                                 
CONECT    4    7    7    5    2                                       
CONECT    5    6    6    4   18                                       
CONECT    6    9    5    5   19                                       
CONECT    7    8    4    4   20                                       
CONECT    8    9    9    7   21                                       
CONECT    9   10    8    8    6                                       
CONECT   10    9   22   23                                            
CONECT   11   12    2   24                                            
CONECT   12   11   16   13   13                                       
CONECT   13   12   12   14                                            
CONECT   14   13   15                                                 
CONECT   15   16   16   14   17                                       
CONECT   16   12   15   15   25                                       
CONECT   17   15   26   27   28                                       
CONECT   18    5                                                      
CONECT   19    6                                                      
CONECT   20    7                                                      
CONECT   21    8                                                      
CONECT   22   10                                                      
CONECT   23   10                                                      
CONECT   24   11                                                      
CONECT   25   16                                                      
CONECT   26   17                                                      
CONECT   27   17                                                      
CONECT   28   17                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
