COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.632  -0.430   0.315  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.923   0.451   0.006  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.691   0.174   0.568  1.00  0.00           C  
HETATM    4  C   UNL     1       0.859  -2.864   1.564  1.00  0.00           C  
HETATM    5  O   UNL     1       0.679  -2.435  -1.063  1.00  0.00           O  
HETATM    6  C   UNL     1       2.106   1.493   0.198  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.015   0.085  -2.182  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.085   0.407  -1.368  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.781  -0.193  -1.627  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.615  -0.150  -0.249  1.00  0.00           C  
HETATM   11  C   UNL     1       1.321   0.588   1.111  1.00  0.00           C  
HETATM   12  O   UNL     1       2.723  -1.653   0.089  1.00  0.00           O  
HETATM   13  S   UNL     1       1.327  -1.916   0.090  1.00  0.00           S  
HETATM   14  O   UNL     1       2.091   1.307  -1.001  1.00  0.00           O  
HETATM   15  N   UNL     1       2.825   2.511   0.712  1.00  0.00           N  
HETATM   16  C   UNL     1       3.588   3.391  -0.176  1.00  0.00           C  
HETATM   17 CL   UNL     1      -4.272   0.848   1.025  1.00  0.00          Cl  
HETATM   18  H   UNL     1      -1.566   0.208   1.640  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.220  -2.803   1.707  1.00  0.00           H  
HETATM   20  H   UNL     1       1.150  -3.906   1.434  1.00  0.00           H  
HETATM   21  H   UNL     1       1.365  -2.451   2.437  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.144   0.051  -3.254  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.048   0.623  -1.805  1.00  0.00           H  
HETATM   24  H   UNL     1       0.054  -0.444  -2.264  1.00  0.00           H  
HETATM   25  H   UNL     1       0.588   1.176   1.663  1.00  0.00           H  
HETATM   26  H   UNL     1       2.000   0.103   1.813  1.00  0.00           H  
HETATM   27  H   UNL     1       2.837   2.660   1.670  1.00  0.00           H  
HETATM   28  H   UNL     1       2.909   3.876  -0.878  1.00  0.00           H  
HETATM   29  H   UNL     1       4.101   4.149   0.416  1.00  0.00           H  
HETATM   30  H   UNL     1       4.321   2.803  -0.728  1.00  0.00           H  
CONECT    1   10   13   11                                            
CONECT    2    8   17    3    3                                       
CONECT    3    2    2   10   18                                       
CONECT    4   13   19   20   21                                       
CONECT    5   13   13                                                 
CONECT    6   11   14   14   15                                       
CONECT    7    8    8    9   22                                       
CONECT    8    7    7    2   23                                       
CONECT    9    7   10   10   24                                       
CONECT   10    9    9    3    1                                       
CONECT   11    1    6   25   26                                       
CONECT   12   13   13                                                 
CONECT   13    5    5    1    4                                       
CONECT   13   12   12                                                 
CONECT   14    6    6                                                 
CONECT   15    6   16   27                                            
CONECT   16   15   28   29   30                                       
CONECT   17    2                                                      
CONECT   18    3                                                      
CONECT   19    4                                                      
CONECT   20    4                                                      
CONECT   21    4                                                      
CONECT   22    7                                                      
CONECT   23    8                                                      
CONECT   24    9                                                      
CONECT   25   11                                                      
CONECT   26   11                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
CONECT   29   16                                                      
CONECT   30   16                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
