COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.542  -0.125  -0.625  1.00  0.00           N  
HETATM    2  C   UNL     1       1.074   0.998   0.216  1.00  0.00           C  
HETATM    3  O   UNL     1      -6.150   0.407   1.548  1.00  0.00           O  
HETATM    4  S   UNL     1      -5.471  -0.189   0.322  1.00  0.00           S  
HETATM    5  O   UNL     1      -5.669  -1.589   0.459  1.00  0.00           O  
HETATM    6  O   UNL     1      -6.031   0.526  -0.771  1.00  0.00           O  
HETATM    7  C   UNL     1      -3.718   0.230   0.527  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.921  -0.321  -0.656  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.501   0.018  -0.491  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.685  -0.679  -1.459  1.00  0.00           C  
HETATM   11  C   UNL     1       0.608  -1.158  -0.769  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.303   1.485  -0.486  1.00  0.00           C  
HETATM   13  C   UNL     1       0.177   1.879  -0.616  1.00  0.00           C  
HETATM   14  C   UNL     1       2.830  -0.642  -0.144  1.00  0.00           C  
HETATM   15  C   UNL     1       3.888   0.459  -0.236  1.00  0.00           C  
HETATM   16  S   UNL     1       5.478  -0.180   0.358  1.00  0.00           S  
HETATM   17  O   UNL     1       5.989  -1.157  -0.538  1.00  0.00           O  
HETATM   18  O   UNL     1       6.436   0.995   0.218  1.00  0.00           O  
HETATM   19  O   UNL     1       5.426  -0.425   1.757  1.00  0.00           O  
HETATM   20  H   UNL     1       0.516   0.609   1.069  1.00  0.00           H  
HETATM   21  H   UNL     1       1.930   1.572   0.570  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.606   1.314   0.568  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.346  -0.209   1.453  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.033  -1.405  -0.697  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.293   0.118  -1.582  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.232  -1.539  -1.846  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.436  -0.006  -2.279  1.00  0.00           H  
HETATM   28  H   UNL     1       1.052  -1.957  -1.364  1.00  0.00           H  
HETATM   29  H   UNL     1       0.359  -1.551   0.217  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.858   1.919  -1.319  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.694   1.891   0.447  1.00  0.00           H  
HETATM   32  H   UNL     1       0.298   2.913  -0.294  1.00  0.00           H  
HETATM   33  H   UNL     1       0.474   1.799  -1.662  1.00  0.00           H  
HETATM   34  H   UNL     1       2.728  -0.963   0.893  1.00  0.00           H  
HETATM   35  H   UNL     1       3.133  -1.490  -0.758  1.00  0.00           H  
HETATM   36  H   UNL     1       3.990   0.780  -1.273  1.00  0.00           H  
HETATM   37  H   UNL     1       3.584   1.306   0.379  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.105   0.261   1.578  1.00  0.00           H  
HETATM   39  H   UNL     1       7.340   0.801   0.502  1.00  0.00           H  
CONECT    1   14    2   11                                            
CONECT    2   13    1   20   21                                       
CONECT    3    4   38                                                 
CONECT    4    5    5    6    6                                       
CONECT    4    7    3                                                 
CONECT    5    4    4                                                 
CONECT    6    4    4                                                 
CONECT    7    4    8   22   23                                       
CONECT    8    7    9   24   25                                       
CONECT    9   12    8   10                                            
CONECT   10    9   11   26   27                                       
CONECT   11    1   10   28   29                                       
CONECT   12   13    9   30   31                                       
CONECT   13   12    2   32   33                                       
CONECT   14   15    1   34   35                                       
CONECT   15   16   14   36   37                                       
CONECT   16   17   17   19   19                                       
CONECT   16   18   15                                                 
CONECT   17   16   16                                                 
CONECT   18   16   39                                                 
CONECT   19   16   16                                                 
CONECT   20    2                                                      
CONECT   21    2                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25    8                                                      
CONECT   26   10                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38    3                                                      
CONECT   39   18                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
