COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.050  -0.698  -0.197  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.311   0.419  -0.814  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.753   1.723  -0.936  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.241   2.706  -0.109  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.843   1.081   0.957  1.00  0.00           C  
HETATM    6  C   UNL     1       1.743   4.906  -0.104  1.00  0.00           C  
HETATM    7  C   UNL     1       1.661   3.379  -0.152  1.00  0.00           C  
HETATM    8  C   UNL     1       3.071   1.470  -0.003  1.00  0.00           C  
HETATM    9  C   UNL     1       4.313   0.868   0.155  1.00  0.00           C  
HETATM   10  C   UNL     1       4.427  -0.509   0.132  1.00  0.00           C  
HETATM   11  C   UNL     1       5.779  -1.154   0.299  1.00  0.00           C  
HETATM   12  C   UNL     1       3.304  -1.297  -0.043  1.00  0.00           C  
HETATM   13  C   UNL     1       1.940   0.693  -0.179  1.00  0.00           C  
HETATM   14  C   UNL     1       0.847  -1.534  -0.384  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.358   0.097   0.134  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.288   2.384   0.839  1.00  0.00           C  
HETATM   17  F   UNL     1       3.418  -2.643  -0.064  1.00  0.00           F  
HETATM   18  N   UNL     1      -0.360  -0.954  -0.538  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.501  -1.747  -0.716  1.00  0.00           N  
HETATM   20  O   UNL     1       2.968   2.826   0.016  1.00  0.00           O  
HETATM   21  O   UNL     1       0.945  -2.746  -0.400  1.00  0.00           O  
HETATM   22  O   UNL     1      -2.302  -1.697   1.618  1.00  0.00           O  
HETATM   23  O   UNL     1      -3.835  -2.388  -0.231  1.00  0.00           O  
HETATM   24  S   UNL     1      -2.801  -1.566   0.294  1.00  0.00           S  
HETATM   25  H   UNL     1      -4.714  -0.350  -1.457  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.497   1.975  -1.677  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.585   3.725  -0.204  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.099   0.830   1.699  1.00  0.00           H  
HETATM   29  H   UNL     1       0.746   5.328  -0.231  1.00  0.00           H  
HETATM   30  H   UNL     1       2.149   5.218   0.859  1.00  0.00           H  
HETATM   31  H   UNL     1       2.393   5.260  -0.904  1.00  0.00           H  
HETATM   32  H   UNL     1       1.011   3.024   0.648  1.00  0.00           H  
HETATM   33  H   UNL     1       1.255   3.067  -1.114  1.00  0.00           H  
HETATM   34  H   UNL     1       5.193   1.478   0.291  1.00  0.00           H  
HETATM   35  H   UNL     1       6.243  -1.281  -0.679  1.00  0.00           H  
HETATM   36  H   UNL     1       6.410  -0.519   0.921  1.00  0.00           H  
HETATM   37  H   UNL     1       5.661  -2.127   0.775  1.00  0.00           H  
HETATM   38  H   UNL     1       0.975   1.162  -0.301  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.888   3.152   1.485  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.439   0.013  -0.526  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.530  -2.403  -1.431  1.00  0.00           H  
CONECT    1   12   14   13   13                                       
CONECT    2    3   15   15   25                                       
CONECT    3    4    4    2   26                                       
CONECT    4    3    3   16   27                                       
CONECT    5   16   16   15   28                                       
CONECT    6    7   29   30   31                                       
CONECT    7   20    6   32   33                                       
CONECT    8    9    9   13   20                                       
CONECT    9   10    8    8   34                                       
CONECT   10   11   12   12    9                                       
CONECT   11   10   35   36   37                                       
CONECT   12   17   10   10    1                                       
CONECT   13    1    1    8   38                                       
CONECT   14   18    1   21   21                                       
CONECT   15    2    2    5   24                                       
CONECT   16    4    5    5   39                                       
CONECT   17   12                                                      
CONECT   18   19   14   40                                            
CONECT   19   24   18   41                                            
CONECT   20    8    7                                                 
CONECT   21   14   14                                                 
CONECT   22   24   24                                                 
CONECT   23   24   24                                                 
CONECT   24   15   23   23   22                                       
CONECT   24   22   19                                                 
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   16                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
