COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.893   1.297   0.345  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.358   0.488   1.335  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.047   0.069   1.254  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.257   0.460   0.173  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.800   1.276  -0.824  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.115   1.690  -0.732  1.00  0.00           C  
HETATM    7  F   UNL     1      -7.180   1.700   0.427  1.00  0.00           F  
HETATM    8  F   UNL     1      -3.041   1.659  -1.874  1.00  0.00           F  
HETATM    9  C   UNL     1      -1.849   0.013   0.082  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.780   0.939   0.152  1.00  0.00           C  
HETATM   11  C   UNL     1       0.550   0.462   0.060  1.00  0.00           C  
HETATM   12  N   UNL     1       0.783  -0.841  -0.090  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.196  -1.714  -0.157  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.528  -1.331  -0.069  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.992   2.317   0.309  1.00  0.00           C  
HETATM   16  C   UNL     1       0.089   3.148   0.368  1.00  0.00           C  
HETATM   17  N   UNL     1       1.328   2.689   0.280  1.00  0.00           N1+
HETATM   18  C   UNL     1       1.604   1.405   0.131  1.00  0.00           C  
HETATM   19  C   UNL     1       3.011   0.954   0.040  1.00  0.00           C  
HETATM   20  C   UNL     1       3.714   0.609   1.195  1.00  0.00           C  
HETATM   21  C   UNL     1       5.026   0.188   1.102  1.00  0.00           C  
HETATM   22  C   UNL     1       5.644   0.109  -0.133  1.00  0.00           C  
HETATM   23  C   UNL     1       4.954   0.450  -1.282  1.00  0.00           C  
HETATM   24  C   UNL     1       3.640   0.866  -1.204  1.00  0.00           C  
HETATM   25 CL   UNL     1       2.773   1.286  -2.648  1.00  0.00          Cl  
HETATM   26 CL   UNL     1       2.940   0.708   2.746  1.00  0.00          Cl  
HETATM   27  O   UNL     1       2.400   3.611   0.348  1.00  0.00           O1-
HETATM   28  C   UNL     1       0.136  -3.174  -0.327  1.00  0.00           C  
HETATM   29  C   UNL     1       0.169  -3.854   1.044  1.00  0.00           C  
HETATM   30  C   UNL     1       0.446  -5.348   0.860  1.00  0.00           C  
HETATM   31  N   UNL     1      -0.604  -5.943   0.023  1.00  0.00           N  
HETATM   32  C   UNL     1      -0.624  -5.338  -1.315  1.00  0.00           C  
HETATM   33  C   UNL     1      -0.933  -3.843  -1.196  1.00  0.00           C  
HETATM   34  H   UNL     1      -5.970   0.186   2.172  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.632  -0.561   2.027  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.536   2.320  -1.501  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.311  -2.074  -0.123  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.994   2.714   0.382  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.071   4.209   0.488  1.00  0.00           H  
HETATM   40  H   UNL     1       5.571  -0.079   1.996  1.00  0.00           H  
HETATM   41  H   UNL     1       6.671  -0.220  -0.200  1.00  0.00           H  
HETATM   42  H   UNL     1       5.443   0.386  -2.243  1.00  0.00           H  
HETATM   43  H   UNL     1       1.110  -3.272  -0.806  1.00  0.00           H  
HETATM   44  H   UNL     1       0.956  -3.410   1.652  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.793  -3.721   1.539  1.00  0.00           H  
HETATM   46  H   UNL     1       1.414  -5.481   0.377  1.00  0.00           H  
HETATM   47  H   UNL     1       0.456  -5.838   1.834  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.497  -6.944  -0.034  1.00  0.00           H  
HETATM   49  H   UNL     1       0.349  -5.471  -1.787  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.391  -5.820  -1.920  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.912  -3.710  -0.735  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.932  -3.392  -2.188  1.00  0.00           H  
CONECT    1    2    2    6    7                                       
CONECT    2    1    1    3   34                                       
CONECT    3    2    4    4   35                                       
CONECT    4    3    3    5    9                                       
CONECT    5    4    6    6    8                                       
CONECT    6    1    5    5   36                                       
CONECT    7    1                                                      
CONECT    8    5                                                      
CONECT    9    4   10   10   14                                       
CONECT   10    9    9   11   15                                       
CONECT   11   10   12   12   18                                       
CONECT   12   11   11   13                                            
CONECT   13   12   14   14   28                                       
CONECT   14    9   13   13   37                                       
CONECT   15   10   16   16   38                                       
CONECT   16   15   15   17   39                                       
CONECT   17   16   18   18   27                                       
CONECT   18   11   17   17   19                                       
CONECT   19   18   20   20   24                                       
CONECT   20   19   19   21   26                                       
CONECT   21   20   22   22   40                                       
CONECT   22   21   21   23   41                                       
CONECT   23   22   24   24   42                                       
CONECT   24   19   23   23   25                                       
CONECT   25   24                                                      
CONECT   26   20                                                      
CONECT   27   17                                                      
CONECT   28   13   29   33   43                                       
CONECT   29   28   30   44   45                                       
CONECT   30   29   31   46   47                                       
CONECT   31   30   32   48                                            
CONECT   32   31   33   49   50                                       
CONECT   33   28   32   51   52                                       
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    6                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   28                                                      
CONECT   44   29                                                      
CONECT   45   29                                                      
CONECT   46   30                                                      
CONECT   47   30                                                      
CONECT   48   31                                                      
CONECT   49   32                                                      
CONECT   50   32                                                      
CONECT   51   33                                                      
CONECT   52   33                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
