COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.668   1.771  -0.250  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.992   1.379  -0.297  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.349   0.101   0.092  1.00  0.00           C  
HETATM    4  S   UNL     1      -5.039  -0.396   0.030  1.00  0.00           S  
HETATM    5  O   UNL     1      -5.176  -1.464   0.957  1.00  0.00           O  
HETATM    6  O   UNL     1      -5.810   0.795   0.097  1.00  0.00           O  
HETATM    7  N   UNL     1      -5.305  -1.043  -1.471  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.384  -0.788   0.528  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.059  -0.401   0.577  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.696   0.879   0.182  1.00  0.00           C  
HETATM   11  N   UNL     1       0.646   1.274   0.230  1.00  0.00           N  
HETATM   12  C   UNL     1       1.622   0.377  -0.013  1.00  0.00           C  
HETATM   13  O   UNL     1       1.336  -0.750  -0.368  1.00  0.00           O  
HETATM   14  N   UNL     1       2.914   0.729   0.138  1.00  0.00           N  
HETATM   15  C   UNL     1       3.974  -0.247  -0.127  1.00  0.00           C  
HETATM   16  C   UNL     1       5.338   0.403   0.118  1.00  0.00           C  
HETATM   17  C   UNL     1       6.445  -0.616  -0.158  1.00  0.00           C  
HETATM   18  C   UNL     1       7.808   0.034   0.087  1.00  0.00           C  
HETATM   19  O   UNL     1       8.843  -0.917  -0.171  1.00  0.00           O  
HETATM   20  H   UNL     1      -1.390   2.770  -0.554  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.748   2.071  -0.637  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.582  -1.086  -2.116  1.00  0.00           H  
HETATM   23  H   UNL     1      -6.185  -1.379  -1.705  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.667  -1.785   0.831  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.306  -1.096   0.918  1.00  0.00           H  
HETATM   26  H   UNL     1       0.874   2.194   0.439  1.00  0.00           H  
HETATM   27  H   UNL     1       3.141   1.628   0.422  1.00  0.00           H  
HETATM   28  H   UNL     1       3.855  -1.102   0.538  1.00  0.00           H  
HETATM   29  H   UNL     1       3.911  -0.580  -1.163  1.00  0.00           H  
HETATM   30  H   UNL     1       5.457   1.259  -0.547  1.00  0.00           H  
HETATM   31  H   UNL     1       5.400   0.736   1.154  1.00  0.00           H  
HETATM   32  H   UNL     1       6.326  -1.471   0.507  1.00  0.00           H  
HETATM   33  H   UNL     1       6.382  -0.949  -1.194  1.00  0.00           H  
HETATM   34  H   UNL     1       7.928   0.890  -0.578  1.00  0.00           H  
HETATM   35  H   UNL     1       7.871   0.367   1.123  1.00  0.00           H  
HETATM   36  H   UNL     1       9.736  -0.573  -0.036  1.00  0.00           H  
CONECT    1   10   10    2   20                                       
CONECT    2    1    3    3   21                                       
CONECT    3    2    2    8    4                                       
CONECT    4    3    7    5    5                                       
CONECT    4    6    6                                                 
CONECT    5    4    4                                                 
CONECT    6    4    4                                                 
CONECT    7    4   22   23                                            
CONECT    8    9    9    3   24                                       
CONECT    9   10    8    8   25                                       
CONECT   10   11    1    1    9                                       
CONECT   11   12   10   26                                            
CONECT   12   14   11   13   13                                       
CONECT   13   12   12                                                 
CONECT   14   15   12   27                                            
CONECT   15   16   14   28   29                                       
CONECT   16   15   17   30   31                                       
CONECT   17   16   18   32   33                                       
CONECT   18   17   19   34   35                                       
CONECT   19   18   36                                                 
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26   11                                                      
CONECT   27   14                                                      
CONECT   28   15                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
