COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.386   2.831   1.546  1.00  0.00           C  
HETATM    2  C   UNL     1       0.655   1.488   1.493  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.533   0.511   1.598  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.323  -0.220   0.269  1.00  0.00           C  
HETATM    5  C   UNL     1       0.169  -0.517   0.088  1.00  0.00           C  
HETATM    6  C   UNL     1       0.952   0.798   0.159  1.00  0.00           C  
HETATM    7  O   UNL     1       1.207   3.421   2.835  1.00  0.00           O  
HETATM    8  O   UNL     1      -0.752   1.708   1.611  1.00  0.00           O  
HETATM    9  O   UNL     1      -1.780   0.604  -0.805  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.131   0.906  -0.185  1.00  0.00           O  
HETATM   11  O   UNL     1      -3.425   1.068  -2.428  1.00  0.00           O  
HETATM   12  O   UNL     1      -3.372  -1.094  -1.176  1.00  0.00           O  
HETATM   13  O   UNL     1       0.610  -1.395   1.125  1.00  0.00           O  
HETATM   14  O   UNL     1       0.867  -3.598   1.926  1.00  0.00           O  
HETATM   15  O   UNL     1      -0.565  -3.065  -0.052  1.00  0.00           O  
HETATM   16  O   UNL     1       1.789  -3.097  -0.186  1.00  0.00           O  
HETATM   17  O   UNL     1       2.352   0.525   0.064  1.00  0.00           O  
HETATM   18  O   UNL     1       2.983   2.178  -1.631  1.00  0.00           O  
HETATM   19  O   UNL     1       4.265   0.231  -1.281  1.00  0.00           O  
HETATM   20  O   UNL     1       1.953   0.143  -2.227  1.00  0.00           O  
HETATM   21  S   UNL     1      -3.209   0.316  -1.242  1.00  0.00           S  
HETATM   22  S   UNL     1       0.600  -2.867   0.737  1.00  0.00           S  
HETATM   23  S   UNL     1       2.920   0.686  -1.338  1.00  0.00           S  
HETATM   24  H   UNL     1       2.449   2.673   1.364  1.00  0.00           H  
HETATM   25  H   UNL     1       0.982   3.496   0.783  1.00  0.00           H  
HETATM   26  H   UNL     1       0.994   0.857   2.313  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.222  -0.134   2.420  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.883  -1.155   0.275  1.00  0.00           H  
HETATM   29  H   UNL     1       0.332  -0.987  -0.882  1.00  0.00           H  
HETATM   30  H   UNL     1       0.650   1.447  -0.663  1.00  0.00           H  
HETATM   31  H   UNL     1       1.645   4.276   2.941  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.072   0.777  -0.368  1.00  0.00           H  
HETATM   33  H   UNL     1       1.876  -4.009  -0.494  1.00  0.00           H  
HETATM   34  H   UNL     1       3.333   2.393  -2.506  1.00  0.00           H  
HETATM   35  O   UNL     1      -2.915   0.840   1.748  1.00  0.00           O  
HETATM   36  H   UNL     1      -3.121   1.306   2.570  1.00  0.00           H  
CONECT    1    7    2   24   25                                       
CONECT    2    1    8    6   26                                       
CONECT    3    8    4   27   35                                       
CONECT    4    3    5    9   28                                       
CONECT    5    6   13    4   29                                       
CONECT    6    2   17    5   30                                       
CONECT    7    1   31                                                 
CONECT    8    2    3                                                 
CONECT    9    4   21                                                 
CONECT   10   21   32                                                 
CONECT   11   21   21                                                 
CONECT   12   21   21                                                 
CONECT   13    5   22                                                 
CONECT   14   22   22                                                 
CONECT   15   22   22                                                 
CONECT   16   22   33                                                 
CONECT   17    6   23                                                 
CONECT   18   23   34                                                 
CONECT   19   23   23                                                 
CONECT   20   23   23                                                 
CONECT   21    9   11   11   12                                       
CONECT   21   12   10                                                 
CONECT   22   13   14   14   15                                       
CONECT   22   15   16                                                 
CONECT   23   17   20   20   19                                       
CONECT   23   19   18                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32   10                                                      
CONECT   33   16                                                      
CONECT   34   18                                                      
CONECT   35    3   36                                                 
CONECT   36   35                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
