COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.233   0.621  -0.730  1.00  0.00           C  
HETATM    2  C   UNL     1       3.608   1.030   0.546  1.00  0.00           C  
HETATM    3  C   UNL     1       2.876   0.614   1.646  1.00  0.00           C  
HETATM    4  C   UNL     1       1.776  -0.205   1.475  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.403  -0.610  -0.210  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.607   1.034  -0.541  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.875   0.623  -1.644  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.235   0.615   0.733  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.132  -0.208   0.893  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.184  -2.335   1.231  1.00  0.00           O  
HETATM   11  S   UNL     1       0.000  -1.656  -0.004  1.00  0.00           S  
HETATM   12  O   UNL     1       0.184  -2.330  -1.241  1.00  0.00           O  
HETATM   13  O   UNL     1      -3.950   1.015   1.818  1.00  0.00           O  
HETATM   14  O   UNL     1      -4.689   1.841  -0.704  1.00  0.00           O  
HETATM   15  C   UNL     1      -1.775  -0.198  -1.476  1.00  0.00           C  
HETATM   16  C   UNL     1       1.403  -0.612   0.208  1.00  0.00           C  
HETATM   17  O   UNL     1       4.691   1.835   0.712  1.00  0.00           O  
HETATM   18  O   UNL     1       3.948   1.026  -1.814  1.00  0.00           O  
HETATM   19  C   UNL     1       2.132  -0.204  -0.894  1.00  0.00           C  
HETATM   20  H   UNL     1       3.166   0.929   2.638  1.00  0.00           H  
HETATM   21  H   UNL     1       1.206  -0.529   2.334  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.162   0.946  -2.633  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.841  -0.535   1.881  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.678   0.423   2.050  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.484   2.785  -0.669  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.205  -0.518  -2.336  1.00  0.00           H  
HETATM   27  H   UNL     1       4.487   2.780   0.685  1.00  0.00           H  
HETATM   28  H   UNL     1       4.673   0.432  -2.052  1.00  0.00           H  
HETATM   29  H   UNL     1       1.838  -0.523  -1.884  1.00  0.00           H  
CONECT    1   19   18    2    2                                       
CONECT    2    1    1   17    3                                       
CONECT    3    2    4    4   20                                       
CONECT    4    3    3   16   21                                       
CONECT    5   11   15   15    9                                       
CONECT    6    7    7   14    8                                       
CONECT    7   15    6    6   22                                       
CONECT    8    6   13    9    9                                       
CONECT    9    8    8    5   23                                       
CONECT   10   11   11                                                 
CONECT   11   12   12   16    5                                       
CONECT   11   10   10                                                 
CONECT   12   11   11                                                 
CONECT   13    8   24                                                 
CONECT   14    6   25                                                 
CONECT   15    5    5    7   26                                       
CONECT   16   11   19   19    4                                       
CONECT   17    2   27                                                 
CONECT   18    1   28                                                 
CONECT   19   16   16    1   29                                       
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    7                                                      
CONECT   23    9                                                      
CONECT   24   13                                                      
CONECT   25   14                                                      
CONECT   26   15                                                      
CONECT   27   17                                                      
CONECT   28   18                                                      
CONECT   29   19                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
