COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.211  -1.542   0.001  1.00  0.00           C  
HETATM    2  O   UNL     1       5.740  -2.655   0.000  1.00  0.00           O  
HETATM    3  O   UNL     1       7.543  -1.378  -0.004  1.00  0.00           O  
HETATM    4  C   UNL     1       5.303  -0.340   0.002  1.00  0.00           C  
HETATM    5  S   UNL     1       3.578  -0.886   0.000  1.00  0.00           S  
HETATM    6  C   UNL     1       2.762   0.675   0.001  1.00  0.00           C  
HETATM    7  N   UNL     1       3.463   1.804   0.002  1.00  0.00           N  
HETATM    8  C   UNL     1       2.857   2.977   0.003  1.00  0.00           C  
HETATM    9  N   UNL     1       1.553   3.097   0.003  1.00  0.00           N  
HETATM   10  C   UNL     1       0.750   2.006   0.002  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.648   1.928   0.001  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.157   0.691   0.000  1.00  0.00           C  
HETATM   13  S   UNL     1       0.128  -0.506  -0.001  1.00  0.00           S  
HETATM   14  C   UNL     1       1.359   0.748  -0.005  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.601   0.375   0.000  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.543   1.406  -0.005  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.888   1.109  -0.005  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.309  -0.217  -0.001  1.00  0.00           C  
HETATM   19  S   UNL     1      -7.030  -0.594  -0.001  1.00  0.00           S  
HETATM   20  C   UNL     1      -7.051  -2.408   0.006  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.373  -1.247   0.004  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.026  -0.955  -0.002  1.00  0.00           C  
HETATM   23  H   UNL     1       8.085  -2.179  -0.008  1.00  0.00           H  
HETATM   24  H   UNL     1       5.494   0.259   0.892  1.00  0.00           H  
HETATM   25  H   UNL     1       5.495   0.261  -0.888  1.00  0.00           H  
HETATM   26  H   UNL     1       3.460   3.873   0.005  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.274   2.809   0.002  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.217   2.436  -0.008  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.616   1.906  -0.009  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.540  -2.780  -0.882  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.542  -2.773   0.898  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.083  -2.759   0.006  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.702  -2.275   0.007  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.300  -1.755  -0.002  1.00  0.00           H  
CONECT    1    4    2    2    3                                       
CONECT    2    1    1                                                 
CONECT    3    1   23                                                 
CONECT    4    5    1   24   25                                       
CONECT    5    6    4                                                 
CONECT    6    7    7   14    5                                       
CONECT    7    8    6    6                                            
CONECT    8    9    9    7   26                                       
CONECT    9    8    8   10                                            
CONECT   10    9   11   14   14                                       
CONECT   11   10   12   12   27                                       
CONECT   12   11   11   15   13                                       
CONECT   13   12   14                                                 
CONECT   14   10   10    6   13                                       
CONECT   15   16   12   22   22                                       
CONECT   16   17   17   15   28                                       
CONECT   17   16   16   18   29                                       
CONECT   18   17   19   21   21                                       
CONECT   19   18   20                                                 
CONECT   20   19   30   31   32                                       
CONECT   21   18   18   22   33                                       
CONECT   22   15   15   21   34                                       
CONECT   23    3                                                      
CONECT   24    4                                                      
CONECT   25    4                                                      
CONECT   26    8                                                      
CONECT   27   11                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   20                                                      
CONECT   31   20                                                      
CONECT   32   20                                                      
CONECT   33   21                                                      
CONECT   34   22                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
