COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.678  -2.032   0.213  1.00  0.00           C  
HETATM    2  C   UNL     1       3.696  -2.946   0.033  1.00  0.00           C  
HETATM    3 CL   UNL     1       3.322  -4.623  -0.212  1.00  0.00          Cl  
HETATM    4  C   UNL     1       5.017  -2.527   0.046  1.00  0.00           C  
HETATM    5 CL   UNL     1       6.293  -3.682  -0.183  1.00  0.00          Cl  
HETATM    6  C   UNL     1       5.324  -1.190   0.240  1.00  0.00           C  
HETATM    7  C   UNL     1       4.315  -0.268   0.422  1.00  0.00           C  
HETATM    8  C   UNL     1       2.981  -0.683   0.410  1.00  0.00           C  
HETATM    9  C   UNL     1       1.898   0.299   0.603  1.00  0.00           C  
HETATM   10  N   UNL     1       0.638   0.031   0.579  1.00  0.00           N  
HETATM   11  C   UNL     1       2.096   1.775   0.866  1.00  0.00           C  
HETATM   12  N   UNL     1       2.797   2.408  -0.254  1.00  0.00           N  
HETATM   13  C   UNL     1       2.283   2.259  -1.617  1.00  0.00           C  
HETATM   14  C   UNL     1       1.438   3.482  -1.981  1.00  0.00           C  
HETATM   15  C   UNL     1       3.914   3.127  -0.030  1.00  0.00           C  
HETATM   16  O   UNL     1       4.340   3.250   1.099  1.00  0.00           O  
HETATM   17  C   UNL     1       4.635   3.777  -1.182  1.00  0.00           C  
HETATM   18  O   UNL     1       5.781   4.477  -0.693  1.00  0.00           O  
HETATM   19  C   UNL     1       0.661   2.326   0.987  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.183   1.137   0.789  1.00  0.00           N  
HETATM   21  C   UNL     1      -1.550   1.119   0.811  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.222   2.238   1.020  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.562   2.197   1.216  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.686   2.162   1.381  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.223  -0.057   0.616  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.521  -0.042   0.096  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.457  -0.966   0.539  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.877   0.901  -0.860  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.159   0.915  -1.373  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.091  -0.007  -0.938  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.743  -0.948   0.021  1.00  0.00           C  
HETATM   32  O   UNL     1      -6.662  -1.852   0.453  1.00  0.00           O  
HETATM   33  C   UNL     1      -7.967  -1.775  -0.124  1.00  0.00           C  
HETATM   34  F   UNL     1      -8.522  -0.518   0.142  1.00  0.00           F  
HETATM   35  F   UNL     1      -7.877  -1.962  -1.508  1.00  0.00           F  
HETATM   36  H   UNL     1       1.648  -2.358   0.198  1.00  0.00           H  
HETATM   37  H   UNL     1       6.355  -0.870   0.249  1.00  0.00           H  
HETATM   38  H   UNL     1       4.556   0.774   0.574  1.00  0.00           H  
HETATM   39  H   UNL     1       2.645   1.928   1.795  1.00  0.00           H  
HETATM   40  H   UNL     1       0.495   2.751   1.977  1.00  0.00           H  
HETATM   41  H   UNL     1       0.469   3.069   0.213  1.00  0.00           H  
HETATM   42  H   UNL     1       3.117   2.174  -2.313  1.00  0.00           H  
HETATM   43  H   UNL     1       1.667   1.362  -1.678  1.00  0.00           H  
HETATM   44  H   UNL     1       1.165   3.435  -3.035  1.00  0.00           H  
HETATM   45  H   UNL     1       0.535   3.494  -1.371  1.00  0.00           H  
HETATM   46  H   UNL     1       2.014   4.389  -1.794  1.00  0.00           H  
HETATM   47  H   UNL     1       4.952   3.013  -1.891  1.00  0.00           H  
HETATM   48  H   UNL     1       3.966   4.479  -1.679  1.00  0.00           H  
HETATM   49  H   UNL     1       6.295   4.921  -1.381  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.799  -0.900   0.838  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.185  -1.698   1.285  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.151   1.623  -1.202  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.434   1.649  -2.116  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.093   0.007  -1.340  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.601  -2.550   0.307  1.00  0.00           H  
CONECT    1    2    8    8   36                                       
CONECT    2    1    3    4    4                                       
CONECT    3    2                                                      
CONECT    4    2    2    5    6                                       
CONECT    5    4                                                      
CONECT    6    4    7    7   37                                       
CONECT    7    6    6    8   38                                       
CONECT    8    1    1    7    9                                       
CONECT    9    8   10   10   11                                       
CONECT   10    9    9   20                                            
CONECT   11    9   12   19   39                                       
CONECT   12   11   13   15                                            
CONECT   13   12   14   42   43                                       
CONECT   14   13   44   45   46                                       
CONECT   15   12   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   47   48                                       
CONECT   18   17   49                                                 
CONECT   19   11   20   40   41                                       
CONECT   20   10   19   21                                            
CONECT   21   20   22   22   25                                       
CONECT   22   21   21   23                                            
CONECT   23   22   24   24   24                                       
CONECT   24   23   23   23                                            
CONECT   25   21   26   50                                            
CONECT   26   25   27   28   28                                       
CONECT   27   26   31   31   51                                       
CONECT   28   26   26   29   52                                       
CONECT   29   28   30   30   53                                       
CONECT   30   29   29   31   54                                       
CONECT   31   27   27   30   32                                       
CONECT   32   31   33                                                 
CONECT   33   32   34   35   55                                       
CONECT   34   33                                                      
CONECT   35   33                                                      
CONECT   36    1                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39   11                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   33                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
