COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.485  -1.018   1.194  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.573  -0.166   1.196  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.114   0.267   0.000  1.00  0.00           C  
HETATM    4  N   UNL     1      -5.280   1.179   0.002  1.00  0.00           N1+
HETATM    5  O   UNL     1      -5.763   1.548   1.058  1.00  0.00           O  
HETATM    6  O   UNL     1      -5.757   1.561  -1.052  1.00  0.00           O1-
HETATM    7  C   UNL     1      -3.566  -0.151  -1.198  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.478  -1.003  -1.200  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.933  -1.432  -0.003  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.747  -2.361  -0.005  1.00  0.00           C  
HETATM   11  C   UNL     1       0.525  -1.552  -0.004  1.00  0.00           C  
HETATM   12  C   UNL     1       1.108  -1.183   1.195  1.00  0.00           C  
HETATM   13  C   UNL     1       2.274  -0.441   1.196  1.00  0.00           C  
HETATM   14  C   UNL     1       2.857  -0.067   0.000  1.00  0.00           C  
HETATM   15  S   UNL     1       4.343   0.879   0.002  1.00  0.00           S  
HETATM   16  O   UNL     1       4.390   1.556  -1.246  1.00  0.00           O  
HETATM   17  O   UNL     1       4.389   1.552   1.253  1.00  0.00           O  
HETATM   18  N   UNL     1       5.607  -0.191   0.001  1.00  0.00           N  
HETATM   19  C   UNL     1       2.275  -0.437  -1.198  1.00  0.00           C  
HETATM   20  C   UNL     1       1.111  -1.183  -1.200  1.00  0.00           C  
HETATM   21  H   UNL     1      -2.063  -1.356   2.129  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.002   0.162   2.132  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.988   0.187  -2.132  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.049  -1.330  -2.136  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.777  -2.991   0.883  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.777  -2.987  -0.897  1.00  0.00           H  
HETATM   27  H   UNL     1       0.652  -1.475   2.129  1.00  0.00           H  
HETATM   28  H   UNL     1       2.729  -0.153   2.132  1.00  0.00           H  
HETATM   29  H   UNL     1       5.433  -1.146  -0.001  1.00  0.00           H  
HETATM   30  H   UNL     1       6.520   0.136   0.002  1.00  0.00           H  
HETATM   31  H   UNL     1       2.731  -0.146  -2.132  1.00  0.00           H  
HETATM   32  H   UNL     1       0.658  -1.474  -2.136  1.00  0.00           H  
CONECT    1    9    9    2   21                                       
CONECT    2    3    3    1   22                                       
CONECT    3    7    4    2    2                                       
CONECT    4    6    3    5    5                                       
CONECT    5    4    4                                                 
CONECT    6    4                                                      
CONECT    7    8    8    3   23                                       
CONECT    8    7    7    9   24                                       
CONECT    9    8   10    1    1                                       
CONECT   10    9   11   25   26                                       
CONECT   11   10   12   12   20                                       
CONECT   12   11   11   13   27                                       
CONECT   13   12   14   14   28                                       
CONECT   14   13   13   19   15                                       
CONECT   15   14   18   17   17                                       
CONECT   15   16   16                                                 
CONECT   16   15   15                                                 
CONECT   17   15   15                                                 
CONECT   18   15   29   30                                            
CONECT   19   20   20   14   31                                       
CONECT   20   11   19   19   32                                       
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25   10                                                      
CONECT   26   10                                                      
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29   18                                                      
CONECT   30   18                                                      
CONECT   31   19                                                      
CONECT   32   20                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
