COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  CA  UNL     1      -0.612  -0.894  -0.387  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.904  -0.133  -0.237  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.853  -0.178  -1.241  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.038   0.519  -1.105  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.275   1.263   0.038  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.324   1.309   1.044  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.141   0.606   0.907  1.00  0.00           C  
HETATM    8  F   UNL     1      -5.433   1.946   0.173  1.00  0.00           F  
HETATM    9  N   UNL     1       0.495  -0.084   0.128  1.00  0.00           N  
HETATM   10  C   UNL     1       1.748  -0.288  -0.325  1.00  0.00           C  
HETATM   11  O   UNL     1       1.959  -1.142  -1.160  1.00  0.00           O  
HETATM   12  C   UNL     1       2.886   0.545   0.205  1.00  0.00           C  
HETATM   13  C   UNL     1       4.190   0.115  -0.470  1.00  0.00           C  
HETATM   14  S   UNL     1       5.580   1.013   0.273  1.00  0.00           S  
HETATM   15  C   UNL     1       2.620   2.022  -0.096  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.695  -2.183   0.390  1.00  0.00           C  
HETATM   17  O   UNL     1       0.090  -2.402   1.283  1.00  0.00           O  
HETATM   18  OXT UNL     1      -1.641  -3.087   0.091  1.00  0.00           O  
HETATM   19  HA  UNL     1      -0.440  -1.115  -1.440  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.667  -0.759  -2.133  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.779   0.483  -1.890  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.507   1.889   1.936  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.399   0.641   1.691  1.00  0.00           H  
HETATM   24  H   UNL     1       0.326   0.599   0.796  1.00  0.00           H  
HETATM   25  H   UNL     1       2.970   0.403   1.282  1.00  0.00           H  
HETATM   26  H   UNL     1       4.334  -0.957  -0.331  1.00  0.00           H  
HETATM   27  H   UNL     1       4.140   0.340  -1.535  1.00  0.00           H  
HETATM   28  H   UNL     1       6.642   0.543  -0.406  1.00  0.00           H  
HETATM   29  H   UNL     1       1.691   2.329   0.385  1.00  0.00           H  
HETATM   30  H   UNL     1       3.443   2.625   0.287  1.00  0.00           H  
HETATM   31  H   UNL     1       2.536   2.164  -1.173  1.00  0.00           H  
HETATM   32  HXT UNL     1      -1.655  -3.898   0.617  1.00  0.00           H  
CONECT    1    9    2   16   19                                       
CONECT    2    7    7    3    1                                       
CONECT    3    4    4    2   20                                       
CONECT    4    5    3    3   21                                       
CONECT    5    8    6    6    4                                       
CONECT    6    5    5    7   22                                       
CONECT    7    6    2    2   23                                       
CONECT    8    5                                                      
CONECT    9   10    1   24                                            
CONECT   10   12   11   11    9                                       
CONECT   11   10   10                                                 
CONECT   12   15   10   13   25                                       
CONECT   13   12   14   26   27                                       
CONECT   14   13   28                                                 
CONECT   15   12   29   30   31                                       
CONECT   16    1   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   32                                                 
CONECT   19    1                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    6                                                      
CONECT   23    7                                                      
CONECT   24    9                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   15                                                      
CONECT   30   15                                                      
CONECT   31   15                                                      
CONECT   32   18                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
