COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.442  -2.770  -1.361  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.478  -3.865  -1.706  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.231  -0.991   1.259  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.502   1.191   0.294  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.368   2.222  -0.329  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.724   1.971  -0.525  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.525   2.934  -1.105  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.639   4.404  -1.293  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.252  -2.895   0.956  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.829   3.448  -0.715  1.00  0.00           C  
HETATM   11  O   UNL     1       0.253  -1.273   2.747  1.00  0.00           O  
HETATM   12  C   UNL     1       4.870   2.447   0.243  1.00  0.00           C  
HETATM   13  C   UNL     1       5.323   1.362  -0.484  1.00  0.00           C  
HETATM   14  C   UNL     1       4.456   0.329  -0.801  1.00  0.00           C  
HETATM   15  C   UNL     1       3.122   0.388  -0.382  1.00  0.00           C  
HETATM   16  C   UNL     1       2.677   1.487   0.351  1.00  0.00           C  
HETATM   17  C   UNL     1       3.552   2.506   0.664  1.00  0.00           C  
HETATM   18  C   UNL     1       2.187  -0.712  -0.717  1.00  0.00           C  
HETATM   19  C   UNL     1       1.406  -1.287   0.281  1.00  0.00           C  
HETATM   20  C   UNL     1       0.532  -2.316  -0.034  1.00  0.00           C  
HETATM   21  C   UNL     1       1.235  -2.181  -2.353  1.00  0.00           C  
HETATM   22  C   UNL     1       2.093  -1.170  -2.034  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.885  -0.736   1.451  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.041  -0.035   0.680  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.147   1.444   0.496  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.345   0.480   1.071  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.984   4.147  -1.491  1.00  0.00           C  
HETATM   28 CL   UNL     1       5.961   3.739   0.638  1.00  0.00          Cl  
HETATM   29  O   UNL     1      -0.562  -4.299  -2.979  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.162  -4.378  -0.842  1.00  0.00           O  
HETATM   31  O   UNL     1       4.898  -0.737  -1.517  1.00  0.00           O  
HETATM   32  O   UNL     1      -1.712  -2.805   2.943  1.00  0.00           O  
HETATM   33  S   UNL     1      -0.855  -1.963   2.185  1.00  0.00           S  
HETATM   34  H   UNL     1      -3.647  -1.941   1.558  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.148   1.024  -0.225  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.577   2.740  -1.257  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.222   5.354  -1.592  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.445  -3.845   0.928  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.779   3.649  -0.561  1.00  0.00           H  
HETATM   40  H   UNL     1       6.353   1.319  -0.806  1.00  0.00           H  
HETATM   41  H   UNL     1       1.648   1.538   0.677  1.00  0.00           H  
HETATM   42  H   UNL     1       3.206   3.356   1.233  1.00  0.00           H  
HETATM   43  H   UNL     1       1.481  -0.932   1.299  1.00  0.00           H  
HETATM   44  H   UNL     1       1.168  -2.530  -3.373  1.00  0.00           H  
HETATM   45  H   UNL     1       2.702  -0.720  -2.804  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.090  -0.237   0.525  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.724   2.393   0.199  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.294   0.675   1.228  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.614   4.897  -1.944  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.181  -5.021  -3.157  1.00  0.00           H  
HETATM   51  H   UNL     1       5.245  -1.459  -0.974  1.00  0.00           H  
CONECT    1    2   20   20   21                                       
CONECT    2   30   30   29    1                                       
CONECT    3   23   23   24   34                                       
CONECT    4   25    5   24   24                                       
CONECT    5    6    4   10   10                                       
CONECT    6    7    7    5   35                                       
CONECT    7    6    6   27   36                                       
CONECT    8   27   27   10   37                                       
CONECT    9   33   20   38                                            
CONECT   10    5    5    8   39                                       
CONECT   11   33   33                                                 
CONECT   12   13   13   17   28                                       
CONECT   13   14   12   12   40                                       
CONECT   14   31   15   15   13                                       
CONECT   15   18   14   14   16                                       
CONECT   16   15   17   17   41                                       
CONECT   17   16   16   12   42                                       
CONECT   18   19   19   22   15                                       
CONECT   19   20   18   18   43                                       
CONECT   20    9    1    1   19                                       
CONECT   21    1   22   22   44                                       
CONECT   22   21   21   18   45                                       
CONECT   23   26    3    3   33                                       
CONECT   24    4    4    3   46                                       
CONECT   25   26   26    4   47                                       
CONECT   26   25   25   23   48                                       
CONECT   27    7    8    8   49                                       
CONECT   28   12                                                      
CONECT   29    2   50                                                 
CONECT   30    2    2                                                 
CONECT   31   14   51                                                 
CONECT   32   33   33                                                 
CONECT   33   23   11   11    9                                       
CONECT   33   32   32                                                 
CONECT   34    3                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   13                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   19                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
CONECT   51   31                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
