COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.171  -0.791   0.427  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.228  -0.771  -0.429  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.116   0.319  -0.412  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.894   1.382   0.499  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.781   2.471   0.516  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.839   2.491  -0.340  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.058   1.446  -1.235  1.00  0.00           C  
HETATM    8  C   UNL     1       6.807   1.281   0.036  1.00  0.00           C  
HETATM    9  C   UNL     1       5.306   1.411  -0.008  1.00  0.00           C  
HETATM   10  C   UNL     1       4.521   0.288  -0.204  1.00  0.00           C  
HETATM   11  F   UNL     1       5.098  -0.924  -0.355  1.00  0.00           F  
HETATM   12  C   UNL     1       3.129   0.412  -0.243  1.00  0.00           C  
HETATM   13  C   UNL     1       2.543   1.670  -0.085  1.00  0.00           C  
HETATM   14  C   UNL     1       3.338   2.779   0.109  1.00  0.00           C  
HETATM   15  C   UNL     1       4.715   2.650   0.153  1.00  0.00           C  
HETATM   16  C   UNL     1       2.283  -0.780  -0.452  1.00  0.00           C  
HETATM   17  O   UNL     1       2.797  -1.873  -0.590  1.00  0.00           O  
HETATM   18  N   UNL     1       0.942  -0.657  -0.490  1.00  0.00           N  
HETATM   19  N   UNL     1       0.140  -1.788  -0.688  1.00  0.00           N  
HETATM   20  S   UNL     1      -1.056  -2.155   0.398  1.00  0.00           S  
HETATM   21  O   UNL     1      -0.439  -2.197   1.677  1.00  0.00           O  
HETATM   22  O   UNL     1      -1.776  -3.249  -0.154  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.219   0.375  -1.280  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.790   1.326   1.368  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.952   0.255   1.323  1.00  0.00           C  
HETATM   26  H   UNL     1      -3.385  -1.587  -1.118  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.625   3.288   1.205  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.520   3.330  -0.324  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.905   1.487  -1.903  1.00  0.00           H  
HETATM   30  H   UNL     1       7.211   1.397  -0.970  1.00  0.00           H  
HETATM   31  H   UNL     1       7.219   2.054   0.685  1.00  0.00           H  
HETATM   32  H   UNL     1       7.075   0.299   0.424  1.00  0.00           H  
HETATM   33  H   UNL     1       1.468   1.774  -0.119  1.00  0.00           H  
HETATM   34  H   UNL     1       2.884   3.752   0.231  1.00  0.00           H  
HETATM   35  H   UNL     1       5.332   3.523   0.305  1.00  0.00           H  
HETATM   36  H   UNL     1       0.532   0.215  -0.380  1.00  0.00           H  
HETATM   37  H   UNL     1       0.285  -2.356  -1.460  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.400  -0.427  -1.980  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.609   2.128   2.067  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.105   0.213   1.992  1.00  0.00           H  
CONECT    1   20    2    2   25                                       
CONECT    2    1    1    3   26                                       
CONECT    3    2   23   23    4                                       
CONECT    4    3   24    5    5                                       
CONECT    5    4    4    6   27                                       
CONECT    6    7    7    5   28                                       
CONECT    7   23    6    6   29                                       
CONECT    8    9   30   31   32                                       
CONECT    9   15   15   10    8                                       
CONECT   10   12   12    9   11                                       
CONECT   11   10                                                      
CONECT   12   13   16   10   10                                       
CONECT   13   14   14   12   33                                       
CONECT   14   13   13   15   34                                       
CONECT   15   14    9    9   35                                       
CONECT   16   17   17   12   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   36                                            
CONECT   19   18   20   37                                            
CONECT   20   19   22   22   21                                       
CONECT   20   21    1                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23    3    3    7   38                                       
CONECT   24   25   25    4   39                                       
CONECT   25    1   24   24   40                                       
CONECT   26    2                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
CONECT   40   25                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
