COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.710  -2.604  -0.079  1.00  0.00           C  
HETATM    2  C   UNL     1       4.544  -2.981   1.163  1.00  0.00           C  
HETATM    3  C   UNL     1       4.523  -1.703   2.037  1.00  0.00           C  
HETATM    4  C   UNL     1       3.081  -1.174   1.836  1.00  0.00           C  
HETATM    5  C   UNL     1       2.780  -1.455   0.349  1.00  0.00           C  
HETATM    6  N   UNL     1       3.056  -0.261  -0.454  1.00  0.00           N  
HETATM    7  S   UNL     1       1.901   0.330  -1.483  1.00  0.00           S  
HETATM    8  O   UNL     1       2.442   1.513  -2.056  1.00  0.00           O  
HETATM    9  O   UNL     1       1.451  -0.773  -2.257  1.00  0.00           O  
HETATM   10  C   UNL     1       0.533   0.837  -0.495  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.684   0.199  -0.626  1.00  0.00           C  
HETATM   12  C   UNL     1       0.681   1.870   0.413  1.00  0.00           C  
HETATM   13 CL   UNL     1       2.217   2.664   0.576  1.00  0.00          Cl  
HETATM   14  C   UNL     1      -0.390   2.274   1.192  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.612   1.648   1.067  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.767   0.601   0.157  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.074  -0.079   0.022  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.247  -1.085  -0.845  1.00  0.00           C  
HETATM   19  S   UNL     1      -4.940  -1.578  -0.660  1.00  0.00           S  
HETATM   20  C   UNL     1      -5.300  -0.374   0.591  1.00  0.00           C  
HETATM   21  O   UNL     1      -6.362  -0.194   1.160  1.00  0.00           O  
HETATM   22  N   UNL     1      -4.149   0.294   0.781  1.00  0.00           N  
HETATM   23  H   UNL     1       4.367  -2.273  -0.883  1.00  0.00           H  
HETATM   24  H   UNL     1       3.120  -3.460  -0.406  1.00  0.00           H  
HETATM   25  H   UNL     1       4.083  -3.814   1.694  1.00  0.00           H  
HETATM   26  H   UNL     1       5.565  -3.230   0.875  1.00  0.00           H  
HETATM   27  H   UNL     1       4.702  -1.948   3.084  1.00  0.00           H  
HETATM   28  H   UNL     1       5.256  -0.979   1.681  1.00  0.00           H  
HETATM   29  H   UNL     1       2.384  -1.715   2.475  1.00  0.00           H  
HETATM   30  H   UNL     1       3.035  -0.105   2.041  1.00  0.00           H  
HETATM   31  H   UNL     1       1.738  -1.754   0.229  1.00  0.00           H  
HETATM   32  H   UNL     1       3.915   0.184  -0.382  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.798  -0.610  -1.332  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.268   3.081   1.900  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.447   1.964   1.675  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.512  -1.507  -1.514  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.084   1.013   1.428  1.00  0.00           H  
CONECT    1    5    2   23   24                                       
CONECT    2    1    3   25   26                                       
CONECT    3    2    4   27   28                                       
CONECT    4    5    3   29   30                                       
CONECT    5    1    6    4   31                                       
CONECT    6    7    5   32                                            
CONECT    7    8    8    9    9                                       
CONECT    7    6   10                                                 
CONECT    8    7    7                                                 
CONECT    9    7    7                                                 
CONECT   10    7   12   12   11                                       
CONECT   11   10   16   16   33                                       
CONECT   12   13   10   10   14                                       
CONECT   13   12                                                      
CONECT   14   12   15   15   34                                       
CONECT   15   14   14   16   35                                       
CONECT   16   11   11   15   17                                       
CONECT   17   16   22   18   18                                       
CONECT   18   17   17   19   36                                       
CONECT   19   20   18                                                 
CONECT   20   22   21   21   19                                       
CONECT   21   20   20                                                 
CONECT   22   17   20   37                                            
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33   11                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   18                                                      
CONECT   37   22                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
