COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.286   3.980   0.383  1.00  0.00           C  
HETATM    2  C   UNL     1       1.365   2.810   0.154  1.00  0.00           C  
HETATM    3  N   UNL     1       0.055   2.862   0.111  1.00  0.00           N  
HETATM    4  C   UNL     1       1.761   1.493  -0.054  1.00  0.00           C  
HETATM    5  N   UNL     1       3.065   0.959  -0.110  1.00  0.00           N  
HETATM    6  S   UNL     1       3.234  -0.636   0.346  1.00  0.00           S  
HETATM    7  O   UNL     1       4.331  -1.155  -0.394  1.00  0.00           O  
HETATM    8  O   UNL     1       3.169  -0.662   1.765  1.00  0.00           O  
HETATM    9  C   UNL     1       1.789  -1.463  -0.241  1.00  0.00           C  
HETATM   10  C   UNL     1       1.811  -2.817  -0.489  1.00  0.00           C  
HETATM   11  C   UNL     1       0.665  -3.458  -0.930  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.506  -2.745  -1.118  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.539  -1.386  -0.879  1.00  0.00           C  
HETATM   14  C   UNL     1       0.613  -0.732  -0.449  1.00  0.00           C  
HETATM   15  C   UNL     1       0.619   0.725  -0.219  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.446   1.573  -0.124  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.796   1.220  -0.243  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.308   0.168   0.505  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.641  -0.177   0.386  1.00  0.00           C  
HETATM   20 CL   UNL     1      -4.283  -1.492   1.321  1.00  0.00          Cl  
HETATM   21  C   UNL     1      -4.464   0.524  -0.478  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.956   1.571  -1.224  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.626   1.925  -1.104  1.00  0.00           C  
HETATM   24  H   UNL     1       2.544   4.433  -0.574  1.00  0.00           H  
HETATM   25  H   UNL     1       1.787   4.718   1.011  1.00  0.00           H  
HETATM   26  H   UNL     1       3.194   3.636   0.878  1.00  0.00           H  
HETATM   27  H   UNL     1       3.823   1.491  -0.398  1.00  0.00           H  
HETATM   28  H   UNL     1       2.721  -3.378  -0.341  1.00  0.00           H  
HETATM   29  H   UNL     1       0.686  -4.519  -1.129  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.398  -3.254  -1.454  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.454  -0.832  -1.025  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.666  -0.379   1.179  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.505   0.252  -0.570  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.601   2.116  -1.897  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.230   2.744  -1.687  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    3    3    1    4                                       
CONECT    3   16    2    2                                            
CONECT    4    2   15   15    5                                       
CONECT    5    4    6   27                                            
CONECT    6    5    9    8    8                                       
CONECT    6    7    7                                                 
CONECT    7    6    6                                                 
CONECT    8    6    6                                                 
CONECT    9   14    6   10   10                                       
CONECT   10    9    9   11   28                                       
CONECT   11   12   12   10   29                                       
CONECT   12   13   11   11   30                                       
CONECT   13   14   14   12   31                                       
CONECT   14   15   13   13    9                                       
CONECT   15   16    4    4   14                                       
CONECT   16   17    3   15                                            
CONECT   17   23   23   18   16                                       
CONECT   18   19   19   17   32                                       
CONECT   19   21   18   18   20                                       
CONECT   20   19                                                      
CONECT   21   22   22   19   33                                       
CONECT   22   21   21   23   34                                       
CONECT   23   22   17   17   35                                       
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    5                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   18                                                      
CONECT   33   21                                                      
CONECT   34   22                                                      
CONECT   35   23                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
