COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.797   2.060   0.615  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.348  -0.661   0.287  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.104   5.338  -0.267  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.028   3.221  -0.028  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.080  -1.112   2.247  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.405  -2.092   3.174  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.881  -3.308   2.419  1.00  0.00           C  
HETATM    8  C   UNL     1       2.981  -2.435  -0.019  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.963   1.097   0.040  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.179   0.286   0.850  1.00  0.00           C  
HETATM   11  C   UNL     1       5.566   2.879  -0.426  1.00  0.00           C  
HETATM   12  C   UNL     1       1.811   0.122  -0.258  1.00  0.00           C  
HETATM   13  C   UNL     1       5.633   3.418   0.847  1.00  0.00           C  
HETATM   14 CL   UNL     1       6.457   3.609  -1.724  1.00  0.00          Cl  
HETATM   15  C   UNL     1       0.928  -3.452  -0.826  1.00  0.00           C  
HETATM   16  C   UNL     1       0.565  -4.046   0.528  1.00  0.00           C  
HETATM   17  C   UNL     1       0.357  -2.966   1.589  1.00  0.00           C  
HETATM   18  N   UNL     1       1.810  -2.297  -0.666  1.00  0.00           N  
HETATM   19  C   UNL     1      -0.318  -3.055  -1.574  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.326  -1.750  -1.700  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.264  -0.767  -1.113  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.082   0.017  -1.916  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.922   0.950  -1.343  1.00  0.00           C  
HETATM   24  O   UNL     1      -5.446   3.468  -1.066  1.00  0.00           O  
HETATM   25  O   UNL     1      -6.905   4.108   0.479  1.00  0.00           O  
HETATM   26  N   UNL     1      -2.580  -1.551   1.061  1.00  0.00           N  
HETATM   27  O   UNL     1      -2.161   0.062   2.564  1.00  0.00           O  
HETATM   28  C   UNL     1       3.796  -1.256   0.271  1.00  0.00           C  
HETATM   29  C   UNL     1       3.256  -0.026   0.141  1.00  0.00           C  
HETATM   30  C   UNL     1       1.411  -0.999  -1.211  1.00  0.00           C  
HETATM   31  O   UNL     1       3.359  -3.539   0.329  1.00  0.00           O  
HETATM   32  C   UNL     1       4.077   1.168   0.385  1.00  0.00           C  
HETATM   33  C   UNL     1       4.148   1.726   1.669  1.00  0.00           C  
HETATM   34  C   UNL     1       4.928   2.844   1.889  1.00  0.00           C  
HETATM   35  C   UNL     1       4.795   1.756  -0.665  1.00  0.00           C  
HETATM   36  F   UNL     1       3.460   1.168   2.688  1.00  0.00           F  
HETATM   37  F   UNL     1       4.735   1.227  -1.907  1.00  0.00           F  
HETATM   38  C   UNL     1      -0.265  -1.392   3.917  1.00  0.00           C  
HETATM   39  N   UNL     1      -0.598  -3.609  -2.737  1.00  0.00           N  
HETATM   40  C   UNL     1      -1.685  -3.290  -3.415  1.00  0.00           C  
HETATM   41  C   UNL     1      -2.584  -2.362  -2.932  1.00  0.00           C  
HETATM   42  C   UNL     1      -1.152  -2.105  -1.029  1.00  0.00           C  
HETATM   43  H   UNL     1      -6.206   1.893   1.479  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.158   5.873  -0.345  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.471   5.102  -1.266  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.834   5.962   0.250  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.142  -2.430   3.916  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.611  -4.088   3.141  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.657  -3.709   1.767  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.233   0.395   1.925  1.00  0.00           H  
HETATM   51  H   UNL     1       1.183   0.076   0.632  1.00  0.00           H  
HETATM   52  H   UNL     1       1.668   1.084  -0.751  1.00  0.00           H  
HETATM   53  H   UNL     1       6.241   4.293   1.027  1.00  0.00           H  
HETATM   54  H   UNL     1       1.457  -4.214  -1.414  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.351  -4.634   0.431  1.00  0.00           H  
HETATM   56  H   UNL     1       1.369  -4.713   0.854  1.00  0.00           H  
HETATM   57  H   UNL     1       0.239  -1.990   1.135  1.00  0.00           H  
HETATM   58  H   UNL     1       1.235  -2.955   2.244  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.062  -0.100  -2.991  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.547   1.568  -1.969  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.439  -2.469   0.757  1.00  0.00           H  
HETATM   62  H   UNL     1       4.823  -1.368   0.588  1.00  0.00           H  
HETATM   63  H   UNL     1       0.330  -0.982  -1.354  1.00  0.00           H  
HETATM   64  H   UNL     1       1.902  -0.847  -2.172  1.00  0.00           H  
HETATM   65  H   UNL     1       4.987   3.272   2.879  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.665  -0.561   4.497  1.00  0.00           H  
HETATM   67  H   UNL     1       0.222  -2.101   4.586  1.00  0.00           H  
HETATM   68  H   UNL     1       0.461  -1.016   3.196  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.875  -3.765  -4.366  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.473  -2.114  -3.493  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.889  -1.613  -0.104  1.00  0.00           H  
CONECT    1    9    4   43                                            
CONECT    2   21   26   10   10                                       
CONECT    3   25   44   45   46                                       
CONECT    4   24   24    1   25                                       
CONECT    5   27   27    6   26                                       
CONECT    6   38    7    5   47                                       
CONECT    7   17    6   48   49                                       
CONECT    8   18   28   31   31                                       
CONECT    9   23   23   10    1                                       
CONECT   10    2    2    9   50                                       
CONECT   11   13   13   35   14                                       
CONECT   12   30   29   51   52                                       
CONECT   13   34   11   11   53                                       
CONECT   14   11                                                      
CONECT   15   16   19   18   54                                       
CONECT   16   17   15   55   56                                       
CONECT   17   16    7   57   58                                       
CONECT   18   30   15    8                                            
CONECT   19   39   15   42   42                                       
CONECT   20   41   41   42   21                                       
CONECT   21   20   22   22    2                                       
CONECT   22   21   21   23   59                                       
CONECT   23   22    9    9   60                                       
CONECT   24    4    4                                                 
CONECT   25    4    3                                                 
CONECT   26    5    2   61                                            
CONECT   27    5    5                                                 
CONECT   28   29   29    8   62                                       
CONECT   29   12   32   28   28                                       
CONECT   30   12   18   63   64                                       
CONECT   31    8    8                                                 
CONECT   32   33   29   35   35                                       
CONECT   33   36   34   34   32                                       
CONECT   34   33   33   13   65                                       
CONECT   35   32   32   11   37                                       
CONECT   36   33                                                      
CONECT   37   35                                                      
CONECT   38    6   66   67   68                                       
CONECT   39   40   40   19                                            
CONECT   40   39   39   41   69                                       
CONECT   41   40   20   20   70                                       
CONECT   42   19   19   20   71                                       
CONECT   43    1                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46    3                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50   10                                                      
CONECT   51   12                                                      
CONECT   52   12                                                      
CONECT   53   13                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   16                                                      
CONECT   57   17                                                      
CONECT   58   17                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   26                                                      
CONECT   62   28                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   34                                                      
CONECT   66   38                                                      
CONECT   67   38                                                      
CONECT   68   38                                                      
CONECT   69   40                                                      
CONECT   70   41                                                      
CONECT   71   42                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
