COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.607  -1.416   0.005  1.00  0.00           C  
HETATM    2  C   UNL     1       4.268  -1.722   0.002  1.00  0.00           C  
HETATM    3  C   UNL     1       3.460  -0.616  -0.001  1.00  0.00           C  
HETATM    4  C   UNL     1       1.997  -0.633  -0.004  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.503   0.278  -0.010  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.666   0.149  -0.005  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.011   0.481  -0.002  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.982  -0.530   0.000  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.352  -0.192   0.002  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.334  -1.205   0.005  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.656  -0.866   0.007  1.00  0.00           C  
HETATM   12  C   UNL     1      -9.036   0.469   0.007  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.079   1.475   0.005  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.750   1.161   0.008  1.00  0.00           C  
HETATM   15  C   UNL     1       5.891  -0.107   0.004  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.862  -1.024  -0.008  1.00  0.00           N  
HETATM   17  N   UNL     1      -2.147  -1.107  -0.005  1.00  0.00           N  
HETATM   18  N   UNL     1       7.261   0.454   0.006  1.00  0.00           N1+
HETATM   19  O   UNL     1       1.401  -1.694  -0.004  1.00  0.00           O  
HETATM   20  O   UNL     1      -1.628   1.015  -0.008  1.00  0.00           O  
HETATM   21  O   UNL     1       8.302  -0.352   0.009  1.00  0.00           O  
HETATM   22  O   UNL     1       7.438   1.759   0.005  1.00  0.00           O1-
HETATM   23  S   UNL     1       4.464   0.828  -0.001  1.00  0.00           S  
HETATM   24  S   UNL     1       1.098   0.882  -0.008  1.00  0.00           S  
HETATM   25  H   UNL     1       6.374  -2.176   0.012  1.00  0.00           H  
HETATM   26  H   UNL     1       3.890  -2.734   0.002  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.312   1.518  -0.003  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.682  -1.567   0.000  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.041  -2.245   0.004  1.00  0.00           H  
HETATM   30  H   UNL     1      -9.410  -1.639   0.009  1.00  0.00           H  
HETATM   31  H   UNL     1     -10.085   0.728   0.009  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.387   2.510   0.005  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.008   1.945   0.010  1.00  0.00           H  
CONECT    1    2   15   15   25                                       
CONECT    2    1    3    3   26                                       
CONECT    3    2    2    4   23                                       
CONECT    4    3   19   19   24                                       
CONECT    5   16   16   20   24                                       
CONECT    6    7   17   17   20                                       
CONECT    7    6    8    8   27                                       
CONECT    8    7    7    9   28                                       
CONECT    9    8   10   10   14                                       
CONECT   10    9    9   11   29                                       
CONECT   11   10   12   12   30                                       
CONECT   12   11   11   13   31                                       
CONECT   13   12   14   14   32                                       
CONECT   14    9   13   13   33                                       
CONECT   15    1    1   18   23                                       
CONECT   16    5    5   17                                            
CONECT   17    6    6   16                                            
CONECT   18   15   21   21   22                                       
CONECT   19    4    4                                                 
CONECT   20    5    6                                                 
CONECT   21   18   18                                                 
CONECT   22   18                                                      
CONECT   23    3   15                                                 
CONECT   24    4    5                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
