COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.372   3.123  -0.285  1.00  0.00           C  
HETATM    2  N   UNL     1      -3.053   1.701  -0.144  1.00  0.00           N  
HETATM    3  C   UNL     1      -3.992   0.685  -0.041  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.383   0.695  -0.039  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.082  -0.487   0.080  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.409  -1.696   0.199  1.00  0.00           C  
HETATM    7  F   UNL     1      -6.107  -2.847   0.315  1.00  0.00           F  
HETATM    8  C   UNL     1      -4.029  -1.725   0.199  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.312  -0.536   0.079  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.874  -0.217   0.043  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.782   1.183  -0.100  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.573   1.733  -0.160  1.00  0.00           N  
HETATM   13  C   UNL     1       0.498   0.955  -0.083  1.00  0.00           C  
HETATM   14  S   UNL     1       2.101   1.681  -0.161  1.00  0.00           S  
HETATM   15  C   UNL     1       3.127   0.197  -0.012  1.00  0.00           C  
HETATM   16  C   UNL     1       4.604   0.592  -0.056  1.00  0.00           C  
HETATM   17  N   UNL     1       5.437  -0.613   0.064  1.00  0.00           N  
HETATM   18  C   UNL     1       5.273  -1.485  -1.106  1.00  0.00           C  
HETATM   19  C   UNL     1       5.818  -2.878  -0.784  1.00  0.00           C  
HETATM   20  C   UNL     1       6.848  -0.259   0.264  1.00  0.00           C  
HETATM   21  C   UNL     1       7.057   0.211   1.705  1.00  0.00           C  
HETATM   22  N   UNL     1       0.386  -0.363   0.052  1.00  0.00           N  
HETATM   23  N   UNL     1      -0.766  -0.939   0.111  1.00  0.00           N  
HETATM   24  H   UNL     1      -3.449   3.578   0.702  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.583   3.618  -0.852  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.320   3.233  -0.811  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.916   1.630  -0.131  1.00  0.00           H  
HETATM   28  H   UNL     1      -7.162  -0.473   0.082  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.507  -2.665   0.291  1.00  0.00           H  
HETATM   30  H   UNL     1       2.911  -0.300   0.934  1.00  0.00           H  
HETATM   31  H   UNL     1       2.907  -0.480  -0.837  1.00  0.00           H  
HETATM   32  H   UNL     1       4.820   1.089  -1.002  1.00  0.00           H  
HETATM   33  H   UNL     1       4.824   1.270   0.769  1.00  0.00           H  
HETATM   34  H   UNL     1       4.215  -1.559  -1.359  1.00  0.00           H  
HETATM   35  H   UNL     1       5.821  -1.067  -1.950  1.00  0.00           H  
HETATM   36  H   UNL     1       6.872  -2.802  -0.516  1.00  0.00           H  
HETATM   37  H   UNL     1       5.261  -3.302   0.051  1.00  0.00           H  
HETATM   38  H   UNL     1       5.710  -3.521  -1.657  1.00  0.00           H  
HETATM   39  H   UNL     1       7.472  -1.132   0.073  1.00  0.00           H  
HETATM   40  H   UNL     1       7.123   0.541  -0.423  1.00  0.00           H  
HETATM   41  H   UNL     1       6.510   1.139   1.868  1.00  0.00           H  
HETATM   42  H   UNL     1       6.692  -0.552   2.393  1.00  0.00           H  
HETATM   43  H   UNL     1       8.120   0.380   1.882  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    3   11    1                                            
CONECT    3    9    9    4    2                                       
CONECT    4    5    5    3   27                                       
CONECT    5    6    4    4   28                                       
CONECT    6    7    8    8    5                                       
CONECT    7    6                                                      
CONECT    8    6    6    9   29                                       
CONECT    9    8   10    3    3                                       
CONECT   10   23   23    9   11                                       
CONECT   11   10    2   12   12                                       
CONECT   12   11   11   13                                            
CONECT   13   22   22   12   14                                       
CONECT   14   13   15                                                 
CONECT   15   14   16   30   31                                       
CONECT   16   15   17   32   33                                       
CONECT   17   16   20   18                                            
CONECT   18   17   19   34   35                                       
CONECT   19   18   36   37   38                                       
CONECT   20   17   21   39   40                                       
CONECT   21   20   41   42   43                                       
CONECT   22   23   13   13                                            
CONECT   23   10   10   22                                            
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    8                                                      
CONECT   30   15                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   16                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   19                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
