COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.187  -0.155  -0.061  1.00  0.00           C  
HETATM    2  C   UNL     1       3.701  -0.358   0.244  1.00  0.00           C  
HETATM    3  C   UNL     1       2.883  -0.118  -1.027  1.00  0.00           C  
HETATM    4  C   UNL     1       1.420  -0.318  -0.727  1.00  0.00           C  
HETATM    5  C   UNL     1       0.585   0.632  -0.317  1.00  0.00           C  
HETATM    6  S   UNL     1       0.554  -1.840  -0.872  1.00  0.00           S  
HETATM    7  C   UNL     1      -0.940  -1.079  -0.345  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.729   0.227  -0.099  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.831   1.168   0.371  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.731   2.474  -0.373  1.00  0.00           C  
HETATM   11  O   UNL     1      -2.396   2.658  -1.365  1.00  0.00           O  
HETATM   12  O   UNL     1      -0.903   3.435   0.067  1.00  0.00           O  
HETATM   13  O   UNL     1      -1.695   1.403   1.774  1.00  0.00           O  
HETATM   14  C   UNL     1      -3.187   0.519   0.086  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.198  -0.903   0.656  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.527  -1.426   0.612  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.273  -1.783  -0.192  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.079  -3.042   0.456  1.00  0.00           O  
HETATM   19  C   UNL     1       6.185  -0.464   1.057  1.00  0.00           C  
HETATM   20  C   UNL     1       5.906   0.987   0.660  1.00  0.00           C  
HETATM   21  H   UNL     1       5.492  -0.376  -1.083  1.00  0.00           H  
HETATM   22  H   UNL     1       3.538  -1.377   0.594  1.00  0.00           H  
HETATM   23  H   UNL     1       3.389   0.346   1.015  1.00  0.00           H  
HETATM   24  H   UNL     1       5.784  -0.812   2.009  1.00  0.00           H  
HETATM   25  H   UNL     1       7.147  -0.888   0.769  1.00  0.00           H  
HETATM   26  H   UNL     1       6.684   1.518   0.111  1.00  0.00           H  
HETATM   27  H   UNL     1       5.321   1.594   1.351  1.00  0.00           H  
HETATM   28  H   UNL     1       3.046   0.901  -1.377  1.00  0.00           H  
HETATM   29  H   UNL     1       3.195  -0.822  -1.798  1.00  0.00           H  
HETATM   30  H   UNL     1       0.905   1.652  -0.164  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.717  -1.940  -1.175  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.852   1.805   2.025  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.977   1.105   0.556  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.354   0.480  -0.990  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.873   4.256  -0.443  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.847  -0.885   1.688  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.607  -2.326   0.958  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.492  -3.644  -0.022  1.00  0.00           H  
CONECT    1    2   19   20   21                                       
CONECT    2    1    3   22   23                                       
CONECT    3    2    4   28   29                                       
CONECT    4    3    5    5    6                                       
CONECT    5    4    4    8   30                                       
CONECT    6    4    7                                                 
CONECT    7    6    8    8   17                                       
CONECT    8    5    7    7    9                                       
CONECT    9    8   10   13   14                                       
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   35                                                 
CONECT   13    9   32                                                 
CONECT   14    9   15   33   34                                       
CONECT   15   14   16   17   36                                       
CONECT   16   15   37                                                 
CONECT   17    7   15   18   31                                       
CONECT   18   17   38                                                 
CONECT   19    1   20   24   25                                       
CONECT   20    1   19   26   27                                       
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    2                                                      
CONECT   24   19                                                      
CONECT   25   19                                                      
CONECT   26   20                                                      
CONECT   27   20                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    5                                                      
CONECT   31   17                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   12                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   18                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
