COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.205   1.722  -0.151  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.077   2.462   0.164  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.870   1.834   0.394  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.779   0.451   0.311  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.920  -0.303  -0.008  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.136   0.348  -0.233  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.836  -1.771  -0.101  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.908  -2.483  -0.503  1.00  0.00           O  
HETATM    9  O   UNL     1      -1.802  -2.340   0.186  1.00  0.00           O  
HETATM   10  N   UNL     1      -0.561  -0.185   0.537  1.00  0.00           N  
HETATM   11  C   UNL     1       0.588   0.400   0.146  1.00  0.00           C  
HETATM   12  O   UNL     1       0.568   1.516  -0.329  1.00  0.00           O  
HETATM   13  C   UNL     1       1.896  -0.331   0.298  1.00  0.00           C  
HETATM   14  S   UNL     1       3.245   0.711  -0.313  1.00  0.00           S  
HETATM   15  C   UNL     1       4.614  -0.359  -0.023  1.00  0.00           C  
HETATM   16  O   UNL     1       4.434  -1.457   0.468  1.00  0.00           O  
HETATM   17  N   UNL     1       5.860   0.039  -0.346  1.00  0.00           N  
HETATM   18  H   UNL     1      -5.145   2.224  -0.330  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.143   3.538   0.230  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.996   2.418   0.639  1.00  0.00           H  
HETATM   21  H   UNL     1      -5.018  -0.224  -0.479  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.805  -3.443  -0.548  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.540  -1.050   0.976  1.00  0.00           H  
HETATM   24  H   UNL     1       2.063  -0.562   1.350  1.00  0.00           H  
HETATM   25  H   UNL     1       1.864  -1.257  -0.276  1.00  0.00           H  
HETATM   26  H   UNL     1       6.004   0.914  -0.738  1.00  0.00           H  
HETATM   27  H   UNL     1       6.614  -0.551  -0.186  1.00  0.00           H  
CONECT    1    6    6    2   18                                       
CONECT    2    3    3    1   19                                       
CONECT    3    4    2    2   20                                       
CONECT    4   10    5    5    3                                       
CONECT    5    7    4    4    6                                       
CONECT    6    5    1    1   21                                       
CONECT    7    9    9    5    8                                       
CONECT    8    7   22                                                 
CONECT    9    7    7                                                 
CONECT   10   11    4   23                                            
CONECT   11   13   12   12   10                                       
CONECT   12   11   11                                                 
CONECT   13   14   11   24   25                                       
CONECT   14   15   13                                                 
CONECT   15   17   16   16   14                                       
CONECT   16   15   15                                                 
CONECT   17   15   26   27                                            
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    3                                                      
CONECT   21    6                                                      
CONECT   22    8                                                      
CONECT   23   10                                                      
CONECT   24   13                                                      
CONECT   25   13                                                      
CONECT   26   17                                                      
CONECT   27   17                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
