COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1       0.012  -1.154  -2.424  1.00  0.00           S  
HETATM    2  C   UNL     1       1.161  -0.244  -1.356  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.003  -2.429   1.018  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.691  -2.243   0.301  1.00  0.00           C  
HETATM    5  C   UNL     1       4.520   0.740   1.248  1.00  0.00           C  
HETATM    6  C   UNL     1       5.832   0.927   0.530  1.00  0.00           C  
HETATM    7  C   UNL     1       7.902   0.092  -0.038  1.00  0.00           C  
HETATM    8  C   UNL     1       8.210   1.234  -0.754  1.00  0.00           C  
HETATM    9  C   UNL     1       7.281   2.261  -0.818  1.00  0.00           C  
HETATM   10  C   UNL     1       6.071   2.099  -0.162  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.910  -1.264   0.718  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.691  -1.272  -0.423  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.523  -0.203  -0.698  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.575   0.873   0.168  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.795   0.881   1.309  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.966  -0.190   1.586  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.482   2.039  -0.133  1.00  0.00           C  
HETATM   18  C   UNL     1       2.348  -0.279   0.821  1.00  0.00           C  
HETATM   19  C   UNL     1       1.393  -1.035  -0.066  1.00  0.00           C  
HETATM   20  F   UNL     1      -6.736   1.815   0.443  1.00  0.00           F  
HETATM   21  F   UNL     1      -4.928   3.209   0.397  1.00  0.00           F  
HETATM   22  F   UNL     1      -5.622   2.175  -1.518  1.00  0.00           F  
HETATM   23  N   UNL     1       3.592   0.005   0.385  1.00  0.00           N  
HETATM   24  N   UNL     1       6.740  -0.027   0.574  1.00  0.00           N  
HETATM   25  N   UNL     1       0.118  -1.216   0.631  1.00  0.00           N  
HETATM   26  O   UNL     1      -0.363  -3.015  -0.575  1.00  0.00           O  
HETATM   27  O   UNL     1      -2.620  -3.640   0.576  1.00  0.00           O  
HETATM   28  O   UNL     1       1.998   0.073   1.928  1.00  0.00           O  
HETATM   29  H   UNL     1      -0.097  -0.355  -3.501  1.00  0.00           H  
HETATM   30  H   UNL     1       2.110  -0.109  -1.875  1.00  0.00           H  
HETATM   31  H   UNL     1       0.738   0.730  -1.113  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.825  -2.484   2.092  1.00  0.00           H  
HETATM   33  H   UNL     1       4.685   0.177   2.167  1.00  0.00           H  
HETATM   34  H   UNL     1       4.096   1.715   1.491  1.00  0.00           H  
HETATM   35  H   UNL     1       8.622  -0.711   0.021  1.00  0.00           H  
HETATM   36  H   UNL     1       9.163   1.326  -1.253  1.00  0.00           H  
HETATM   37  H   UNL     1       7.496   3.167  -1.366  1.00  0.00           H  
HETATM   38  H   UNL     1       5.324   2.879  -0.191  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.651  -2.113  -1.099  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.133  -0.209  -1.589  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.835   1.722   1.985  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.359  -0.186   2.480  1.00  0.00           H  
HETATM   43  H   UNL     1       1.817  -2.009  -0.309  1.00  0.00           H  
HETATM   44  H   UNL     1       3.872  -0.276  -0.500  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.144  -0.598   1.331  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.808  -3.661  -0.373  1.00  0.00           H  
CONECT    1    2   29                                                 
CONECT    2   19    1   30   31                                       
CONECT    3   27    4   11   32                                       
CONECT    4   26   26   25    3                                       
CONECT    5    6   23   33   34                                       
CONECT    6   10    5   24   24                                       
CONECT    7    8    8   24   35                                       
CONECT    8    9    7    7   36                                       
CONECT    9   10   10    8   37                                       
CONECT   10    9    9    6   38                                       
CONECT   11    3   12   12   16                                       
CONECT   12   11   11   13   39                                       
CONECT   13   12   14   14   40                                       
CONECT   14   13   13   15   17                                       
CONECT   15   16   16   14   41                                       
CONECT   16   11   15   15   42                                       
CONECT   17   14   22   20   21                                       
CONECT   18   23   28   28   19                                       
CONECT   19   18   25    2   43                                       
CONECT   20   17                                                      
CONECT   21   17                                                      
CONECT   22   17                                                      
CONECT   23    5   18   44                                            
CONECT   24    6    6    7                                            
CONECT   25   19    4   45                                            
CONECT   26    4    4                                                 
CONECT   27    3   46                                                 
CONECT   28   18   18                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   23                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
