COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.582  -0.486  -0.072  1.00  0.00           C  
HETATM    2  C   UNL     1       1.740  -0.879   0.971  1.00  0.00           C  
HETATM    3  C   UNL     1       0.514  -1.439   0.652  1.00  0.00           C  
HETATM    4  C   UNL     1       0.165  -1.589  -0.677  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.168  -2.198  -1.030  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.803  -3.995  -0.446  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.738   0.232  -0.294  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.564   1.043   2.058  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.537   2.352   0.783  1.00  0.00           C  
HETATM   10  C   UNL     1       3.905   0.118   0.214  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.714  -5.479  -0.807  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.381  -5.049   0.501  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.864  -0.740   0.100  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.590   0.398  -1.685  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.677   0.975   0.584  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.720   0.314   1.242  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.432   3.003   1.607  1.00  0.00           C  
HETATM   18  C   UNL     1       4.898  -0.635   0.842  1.00  0.00           C  
HETATM   19  C   UNL     1       6.131  -0.065   1.107  1.00  0.00           C  
HETATM   20  C   UNL     1       2.160  -0.676  -1.387  1.00  0.00           C  
HETATM   21  C   UNL     1       6.382   1.249   0.750  1.00  0.00           C  
HETATM   22  C   UNL     1       5.405   2.002   0.128  1.00  0.00           C  
HETATM   23  C   UNL     1       4.167   1.443  -0.149  1.00  0.00           C  
HETATM   24  C   UNL     1       3.265   3.493  -1.184  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.512  -3.293  -0.018  1.00  0.00           C  
HETATM   26  F   UNL     1      -5.898  -1.015   1.083  1.00  0.00           F  
HETATM   27  F   UNL     1       4.656  -1.917   1.192  1.00  0.00           F  
HETATM   28  N   UNL     1      -2.202  -1.161  -0.996  1.00  0.00           N  
HETATM   29  N   UNL     1      -2.673  -0.435  -2.098  1.00  0.00           N  
HETATM   30  N   UNL     1       0.981  -1.208  -1.643  1.00  0.00           N1+
HETATM   31  N   UNL     1      -6.399   2.342   2.215  1.00  0.00           N  
HETATM   32  N   UNL     1       3.176   2.207  -0.781  1.00  0.00           N  
HETATM   33  N   UNL     1       2.115   3.812  -1.718  1.00  0.00           N  
HETATM   34  N   UNL     1       1.308   2.814  -1.686  1.00  0.00           N  
HETATM   35  N   UNL     1       1.877   1.799  -1.132  1.00  0.00           N  
HETATM   36  O   UNL     1       0.584  -1.387  -2.990  1.00  0.00           O1-
HETATM   37 CL   UNL     1      -3.256   3.229   0.007  1.00  0.00          Cl  
HETATM   38 CL   UNL     1       7.366  -1.001   1.889  1.00  0.00          Cl  
HETATM   39  H   UNL     1       2.038  -0.751   2.002  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.162  -1.755   1.433  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.118  -2.629  -2.029  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.507  -3.381  -1.007  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.372   0.542   2.571  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.361  -5.842  -1.606  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.736  -5.956  -0.741  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.841  -5.242   1.428  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.466  -5.128   0.563  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.728  -1.105   1.107  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.140   1.093  -2.302  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.332   4.067   1.768  1.00  0.00           H  
HETATM   51  H   UNL     1       2.800  -0.376  -2.203  1.00  0.00           H  
HETATM   52  H   UNL     1       7.347   1.687   0.960  1.00  0.00           H  
HETATM   53  H   UNL     1       5.608   3.026  -0.148  1.00  0.00           H  
HETATM   54  H   UNL     1       4.124   4.139  -1.079  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.700  -4.019   0.021  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.650  -2.848   0.967  1.00  0.00           H  
CONECT    1   20   10    2    2                                       
CONECT    2    1    1    3   39                                       
CONECT    3    4    4    2   40                                       
CONECT    4   30    5    3    3                                       
CONECT    5   28    4   25   41                                       
CONECT    6   11   25   12   42                                       
CONECT    7   15   13   13   14                                       
CONECT    8   31   31   16   43                                       
CONECT    9   17   17   15   37                                       
CONECT   10   23   23   18    1                                       
CONECT   11    6   12   44   45                                       
CONECT   12   11    6   46   47                                       
CONECT   13    7    7   28   48                                       
CONECT   14    7   29   29   49                                       
CONECT   15   16   16    9    7                                       
CONECT   16    8   26   15   15                                       
CONECT   17   31    9    9   50                                       
CONECT   18   19   19   10   27                                       
CONECT   19   21   38   18   18                                       
CONECT   20   30   30    1   51                                       
CONECT   21   22   22   19   52                                       
CONECT   22   21   21   23   53                                       
CONECT   23   22   32   10   10                                       
CONECT   24   32   33   33   54                                       
CONECT   25    5    6   55   56                                       
CONECT   26   16                                                      
CONECT   27   18                                                      
CONECT   28   13   29    5                                            
CONECT   29   14   14   28                                            
CONECT   30   36   20   20    4                                       
CONECT   31    8    8   17                                            
CONECT   32   35   23   24                                            
CONECT   33   34   24   24                                            
CONECT   34   35   35   33                                            
CONECT   35   34   34   32                                            
CONECT   36   30                                                      
CONECT   37    9                                                      
CONECT   38   19                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    8                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   17                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
