COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.694   0.777  -0.002  1.00  0.00           C  
HETATM    2  C   UNL     1       6.702  -0.154   0.003  1.00  0.00           C  
HETATM    3  C   UNL     1       6.297  -1.431   0.007  1.00  0.00           C  
HETATM    4  S   UNL     1       4.594  -1.533   0.004  1.00  0.00           S  
HETATM    5  C   UNL     1       4.441   0.219  -0.002  1.00  0.00           C  
HETATM    6  C   UNL     1       3.224   0.936  -0.002  1.00  0.00           C  
HETATM    7  O   UNL     1       3.235   2.150  -0.001  1.00  0.00           O  
HETATM    8  C   UNL     1       1.913   0.193  -0.002  1.00  0.00           C  
HETATM    9  S   UNL     1       0.544   1.384  -0.002  1.00  0.00           S  
HETATM   10  C   UNL     1      -0.882   0.349  -0.002  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.147   0.773  -0.002  1.00  0.00           N  
HETATM   12  N   UNL     1      -0.871  -0.965  -0.009  1.00  0.00           N  
HETATM   13  N   UNL     1      -2.211  -1.385  -0.007  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.962  -0.262  -0.003  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.441  -0.204   0.001  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.113   1.023   0.005  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.493   1.031   0.008  1.00  0.00           C  
HETATM   18  N   UNL     1      -7.176  -0.098   0.007  1.00  0.00           N  
HETATM   19  C   UNL     1      -6.583  -1.276   0.003  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.206  -1.375  -0.006  1.00  0.00           C  
HETATM   21  H   UNL     1       5.870   1.843  -0.001  1.00  0.00           H  
HETATM   22  H   UNL     1       7.746   0.123   0.004  1.00  0.00           H  
HETATM   23  H   UNL     1       6.961  -2.283   0.011  1.00  0.00           H  
HETATM   24  H   UNL     1       1.849  -0.432  -0.893  1.00  0.00           H  
HETATM   25  H   UNL     1       1.849  -0.433   0.887  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.560   1.951   0.006  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.020   1.973   0.011  1.00  0.00           H  
HETATM   28  H   UNL     1      -7.182  -2.174   0.003  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.727  -2.343  -0.009  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.533  -2.300  -0.011  1.00  0.00           H  
CONECT    1    2    5    5   21                                       
CONECT    2    3    3    1   22                                       
CONECT    3    2    2    4   23                                       
CONECT    4    3    5                                                 
CONECT    5    1    1    4    6                                       
CONECT    6    5    8    7    7                                       
CONECT    7    6    6                                                 
CONECT    8    6    9   24   25                                       
CONECT    9    8   10                                                 
CONECT   10   12   12    9   11                                       
CONECT   11   14   14   10                                            
CONECT   12   13   10   10                                            
CONECT   13   12   14   30                                            
CONECT   14   13   15   11   11                                       
CONECT   15   20   14   16   16                                       
CONECT   16   15   15   17   26                                       
CONECT   17   18   18   16   27                                       
CONECT   18   19   17   17                                            
CONECT   19   20   20   18   28                                       
CONECT   20   19   19   15   29                                       
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    8                                                      
CONECT   25    8                                                      
CONECT   26   16                                                      
CONECT   27   17                                                      
CONECT   28   19                                                      
CONECT   29   20                                                      
CONECT   30   13                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
