COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.780  -1.835  -0.293  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.776  -2.994  -0.472  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.181  -2.361  -0.540  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.921  -0.907  -1.007  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.614  -0.537  -0.260  1.00  0.00           C  
HETATM    6  N   UNL     1      -2.913   0.543  -0.959  1.00  0.00           N  
HETATM    7  S   UNL     1      -2.081   1.685  -0.095  1.00  0.00           S  
HETATM    8  O   UNL     1      -1.493   2.559  -1.049  1.00  0.00           O  
HETATM    9  O   UNL     1      -2.958   2.130   0.930  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.749   0.860   0.712  1.00  0.00           C  
HETATM   11  C   UNL     1       0.472   0.744   0.080  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.929   0.336   1.980  1.00  0.00           C  
HETATM   13  C   UNL     1       0.112  -0.312   2.620  1.00  0.00           C  
HETATM   14  C   UNL     1       1.337  -0.441   1.997  1.00  0.00           C  
HETATM   15  C   UNL     1       1.526   0.090   0.721  1.00  0.00           C  
HETATM   16  C   UNL     1       2.837  -0.038   0.050  1.00  0.00           C  
HETATM   17  C   UNL     1       3.043   0.463  -1.175  1.00  0.00           C  
HETATM   18  S   UNL     1       4.730   0.077  -1.563  1.00  0.00           S  
HETATM   19  C   UNL     1       5.042  -0.746  -0.024  1.00  0.00           C  
HETATM   20  O   UNL     1       6.083  -1.265   0.339  1.00  0.00           O  
HETATM   21  N   UNL     1       3.887  -0.670   0.659  1.00  0.00           N  
HETATM   22  H   UNL     1      -2.235  -1.952   0.643  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.083  -1.809  -1.131  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.563  -3.531  -1.396  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.713  -3.674   0.377  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.802  -2.889  -1.265  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.653  -2.370   0.442  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.773  -0.868  -2.086  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.738  -0.252  -0.703  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.831  -0.250   0.768  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.936   0.589  -1.928  1.00  0.00           H  
HETATM   32  H   UNL     1       0.612   1.157  -0.908  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.885   0.434   2.472  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.034  -0.719   3.610  1.00  0.00           H  
HETATM   35  H   UNL     1       2.148  -0.947   2.498  1.00  0.00           H  
HETATM   36  H   UNL     1       2.333   0.991  -1.794  1.00  0.00           H  
HETATM   37  H   UNL     1       3.800  -1.050   1.547  1.00  0.00           H  
CONECT    1    5    2   22   23                                       
CONECT    2    3    1   24   25                                       
CONECT    3    4    2   26   27                                       
CONECT    4    3    5   28   29                                       
CONECT    5    4    6    1   30                                       
CONECT    6    5    7   31                                            
CONECT    7    9    9    6    8                                       
CONECT    7    8   10                                                 
CONECT    8    7    7                                                 
CONECT    9    7    7                                                 
CONECT   10    7   11   11   12                                       
CONECT   11   10   10   15   32                                       
CONECT   12   10   13   13   33                                       
CONECT   13   12   12   14   34                                       
CONECT   14   15   15   13   35                                       
CONECT   15   11   16   14   14                                       
CONECT   16   15   21   17   17                                       
CONECT   17   16   16   18   36                                       
CONECT   18   19   17                                                 
CONECT   19   21   20   20   18                                       
CONECT   20   19   19                                                 
CONECT   21   16   19   37                                            
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   17                                                      
CONECT   37   21                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
