COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.249   1.737   0.110  1.00  0.00           C  
HETATM    2  C   UNL     1       1.916   2.134   0.000  1.00  0.00           C  
HETATM    3  C   UNL     1       3.619   0.408   0.168  1.00  0.00           C  
HETATM    4  C   UNL     1       2.647  -0.590   0.126  1.00  0.00           C  
HETATM    5  C   UNL     1       0.943   1.171  -0.051  1.00  0.00           C  
HETATM    6  C   UNL     1       1.323  -0.180   0.024  1.00  0.00           C  
HETATM    7  C   UNL     1       0.475  -1.380   0.000  1.00  0.00           C  
HETATM    8  C   UNL     1       1.307  -2.412   0.097  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.515   0.001   0.557  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.023  -1.285  -0.114  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.015   0.077   0.436  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.415  -1.268  -1.593  1.00  0.00           C  
HETATM   13  N   UNL     1       2.612  -1.965   0.157  1.00  0.00           N  
HETATM   14  O   UNL     1      -3.715  -0.498   1.235  1.00  0.00           O  
HETATM   15  O   UNL     1      -3.573   0.782  -0.561  1.00  0.00           O  
HETATM   16  S   UNL     1      -0.785   1.479  -0.196  1.00  0.00           S  
HETATM   17  H   UNL     1       4.018   2.494   0.146  1.00  0.00           H  
HETATM   18  H   UNL     1       1.657   3.181  -0.044  1.00  0.00           H  
HETATM   19  H   UNL     1       4.663   0.141   0.247  1.00  0.00           H  
HETATM   20  H   UNL     1       1.007  -3.449   0.107  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.244  -0.022   1.612  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.483  -2.145   0.371  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.970  -0.398  -2.077  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.053  -2.176  -2.075  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.500  -1.218  -1.681  1.00  0.00           H  
HETATM   26  H   UNL     1       3.391  -2.538   0.221  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.539   0.802  -0.597  1.00  0.00           H  
CONECT    1    2    3    3   17                                       
CONECT    2    5    5    1   18                                       
CONECT    3    1    1    4   19                                       
CONECT    4    6    6    3   13                                       
CONECT    5   16    2    2    6                                       
CONECT    6    5    7    4    4                                       
CONECT    7   10    6    8    8                                       
CONECT    8    7    7   13   20                                       
CONECT    9   11   16   10   21                                       
CONECT   10   12    9    7   22                                       
CONECT   11   14   14   15    9                                       
CONECT   12   10   23   24   25                                       
CONECT   13    8    4   26                                            
CONECT   14   11   11                                                 
CONECT   15   11   27                                                 
CONECT   16    9    5                                                 
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    3                                                      
CONECT   20    8                                                      
CONECT   21    9                                                      
CONECT   22   10                                                      
CONECT   23   12                                                      
CONECT   24   12                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
CONECT   27   15                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
