COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.946  -2.893  -0.324  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.795  -0.096   0.304  1.00  0.00           C  
HETATM    3  C   UNL     1       3.587  -2.947  -0.073  1.00  0.00           C  
HETATM    4  C   UNL     1       2.874  -1.781   0.129  1.00  0.00           C  
HETATM    5  C   UNL     1       3.524  -0.554   0.081  1.00  0.00           C  
HETATM    6  C   UNL     1       0.950   0.374   0.430  1.00  0.00           C  
HETATM    7  C   UNL     1       0.263   0.476   1.583  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.157  -0.007   1.692  1.00  0.00           C  
HETATM    9  C   UNL     1       5.598  -1.674  -0.368  1.00  0.00           C  
HETATM   10 CL   UNL     1       5.709   1.026  -0.227  1.00  0.00          Cl  
HETATM   11  C   UNL     1       4.891  -0.504  -0.171  1.00  0.00           C  
HETATM   12  S   UNL     1       2.618   0.936   0.338  1.00  0.00           S  
HETATM   13  O   UNL     1       0.862   1.023   2.664  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.033   1.292  -0.234  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.290   2.334   0.558  1.00  0.00           C  
HETATM   16  S   UNL     1      -2.511   3.778  -0.421  1.00  0.00           S  
HETATM   17  C   UNL     1      -2.234   2.858  -1.894  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.996   1.582  -1.587  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.106  -0.833   0.398  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.552  -1.585  -0.671  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.760  -2.264  -0.584  1.00  0.00           C  
HETATM   22  N   UNL     1      -5.214  -3.027  -1.663  1.00  0.00           N  
HETATM   23  C   UNL     1      -5.516  -2.185   0.579  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.064  -1.431   1.644  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.858  -0.760   1.556  1.00  0.00           C  
HETATM   26  O   UNL     1      -0.907  -0.805  -0.572  1.00  0.00           O  
HETATM   27  C   UNL     1       0.300  -0.207  -0.751  1.00  0.00           C  
HETATM   28  O   UNL     1       0.822  -0.156  -1.849  1.00  0.00           O  
HETATM   29  H   UNL     1       5.501  -3.807  -0.482  1.00  0.00           H  
HETATM   30  H   UNL     1       3.083  -3.901  -0.036  1.00  0.00           H  
HETATM   31  H   UNL     1       1.813  -1.824   0.324  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.728   0.687   2.308  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.168  -0.993   2.158  1.00  0.00           H  
HETATM   34  H   UNL     1       6.660  -1.637  -0.564  1.00  0.00           H  
HETATM   35  H   UNL     1       1.744   1.378   2.488  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.354   2.296   1.636  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.245   3.266  -2.894  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.798   0.831  -2.337  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.962  -1.645  -1.574  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.686  -3.082  -2.474  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.058  -3.501  -1.601  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.456  -2.711   0.650  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.651  -1.368   2.548  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.505  -0.174   2.391  1.00  0.00           H  
CONECT    1    9    9    3   29                                       
CONECT    2    8   14   26   19                                       
CONECT    3    1    4    4   30                                       
CONECT    4    3    3    5   31                                       
CONECT    5   11   11    4   12                                       
CONECT    6   12    7    7   27                                       
CONECT    7   13    6    6    8                                       
CONECT    8    7    2   32   33                                       
CONECT    9    1    1   11   34                                       
CONECT   10   11                                                      
CONECT   11    9   10    5    5                                       
CONECT   12    5    6                                                 
CONECT   13    7   35                                                 
CONECT   14   18    2   15   15                                       
CONECT   15   14   14   16   36                                       
CONECT   16   17   15                                                 
CONECT   17   18   18   16   37                                       
CONECT   18   17   17   14   38                                       
CONECT   19    2   25   25   20                                       
CONECT   20   19   21   21   39                                       
CONECT   21   20   20   23   22                                       
CONECT   22   21   40   41                                            
CONECT   23   24   24   21   42                                       
CONECT   24   25   23   23   43                                       
CONECT   25   19   19   24   44                                       
CONECT   26   27    2                                                 
CONECT   27    6   28   28   26                                       
CONECT   28   27   27                                                 
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   13                                                      
CONECT   36   15                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
