COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.043   0.383   0.854  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.623   1.842  -0.244  1.00  0.00           C  
HETATM    3  N   UNL     1       3.650  -0.471  -0.435  1.00  0.00           N  
HETATM    4  C   UNL     1      -6.170   2.936  -0.894  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.361  -3.288   0.011  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.746  -3.838  -0.334  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.606  -4.966  -1.359  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.885  -5.557  -1.594  1.00  0.00           O  
HETATM    9  O   UNL     1      -2.550  -2.793  -0.883  1.00  0.00           O  
HETATM   10  N   UNL     1      -1.251  -1.097   0.635  1.00  0.00           N  
HETATM   11  N   UNL     1       5.405   0.084   1.028  1.00  0.00           N  
HETATM   12  C   UNL     1      -5.920   4.214  -0.425  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.125   4.398   0.691  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.579   3.305   1.339  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.827   2.028   0.872  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.231   0.838   1.580  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.341  -0.675   1.306  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.829  -0.405  -0.586  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.489  -2.247   1.126  1.00  0.00           C  
HETATM   20  C   UNL     1       0.905  -1.788   1.557  1.00  0.00           C  
HETATM   21  C   UNL     1       2.905  -0.901   0.603  1.00  0.00           C  
HETATM   22  C   UNL     1       4.910   0.083  -0.207  1.00  0.00           C  
HETATM   23  C   UNL     1       5.614   0.615  -1.267  1.00  0.00           C  
HETATM   24  C   UNL     1       6.881   1.169  -1.021  1.00  0.00           C  
HETATM   25  C   UNL     1       7.376   1.153   0.310  1.00  0.00           C  
HETATM   26  C   UNL     1       6.582   0.587   1.320  1.00  0.00           C  
HETATM   27  C   UNL     1       7.662   1.730  -2.042  1.00  0.00           C  
HETATM   28  C   UNL     1       8.884   2.251  -1.743  1.00  0.00           C  
HETATM   29  C   UNL     1       9.371   2.236  -0.437  1.00  0.00           C  
HETATM   30  C   UNL     1       8.641   1.700   0.580  1.00  0.00           C  
HETATM   31  O   UNL     1      -2.692  -1.249   2.319  1.00  0.00           O  
HETATM   32  O   UNL     1       1.649  -1.340   0.394  1.00  0.00           O  
HETATM   33  O   UNL     1       3.366  -0.892   1.727  1.00  0.00           O  
HETATM   34 CL   UNL     1      -5.940   0.237  -0.826  1.00  0.00          Cl  
HETATM   35  F   UNL     1      -6.947   2.756  -1.984  1.00  0.00           F  
HETATM   36  H   UNL     1      -2.763   0.841   0.046  1.00  0.00           H  
HETATM   37  H   UNL     1       3.309  -0.546  -1.340  1.00  0.00           H  
HETATM   38  H   UNL     1       0.280  -4.103   0.347  1.00  0.00           H  
HETATM   39  H   UNL     1       0.076  -2.822  -0.872  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.219  -4.224   0.569  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.215  -4.562  -2.293  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.921  -5.722  -0.975  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.872  -6.281  -2.235  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.189  -2.401  -1.691  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.346   5.068  -0.931  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.930   5.395   1.057  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.958   3.450   2.210  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.965   0.033   1.617  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.951   1.122   2.594  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.248  -0.913  -1.454  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.183   0.625  -0.560  1.00  0.00           H  
HETATM   52  H   UNL     1       0.259  -0.414  -0.650  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.006  -2.689   1.978  1.00  0.00           H  
HETATM   54  H   UNL     1       0.814  -0.967   2.269  1.00  0.00           H  
HETATM   55  H   UNL     1       1.432  -2.619   2.027  1.00  0.00           H  
HETATM   56  H   UNL     1       5.200   0.607  -2.264  1.00  0.00           H  
HETATM   57  H   UNL     1       6.940   0.565   2.339  1.00  0.00           H  
HETATM   58  H   UNL     1       7.297   1.748  -3.059  1.00  0.00           H  
HETATM   59  H   UNL     1       9.485   2.683  -2.530  1.00  0.00           H  
HETATM   60  H   UNL     1      10.344   2.656  -0.228  1.00  0.00           H  
HETATM   61  H   UNL     1       9.032   1.695   1.586  1.00  0.00           H  
CONECT    1   16   17   36                                            
CONECT    2    4   34   15   15                                       
CONECT    3   22   21   37                                            
CONECT    4   35   12   12    2                                       
CONECT    5   19    6   38   39                                       
CONECT    6    5    9    7   40                                       
CONECT    7    6    8   41   42                                       
CONECT    8    7   43                                                 
CONECT    9    6   44                                                 
CONECT   10   18   17   19                                            
CONECT   11   26   26   22                                            
CONECT   12    4    4   13   45                                       
CONECT   13   12   14   14   46                                       
CONECT   14   13   13   15   47                                       
CONECT   15    2    2   14   16                                       
CONECT   16   15    1   48   49                                       
CONECT   17    1   10   31   31                                       
CONECT   18   10   50   51   52                                       
CONECT   19   10   20    5   53                                       
CONECT   20   32   19   54   55                                       
CONECT   21    3   32   33   33                                       
CONECT   22   23   23   11    3                                       
CONECT   23   24   22   22   56                                       
CONECT   24   27   27   25   23                                       
CONECT   25   30   30   24   26                                       
CONECT   26   25   11   11   57                                       
CONECT   27   28   24   24   58                                       
CONECT   28   29   29   27   59                                       
CONECT   29   28   28   30   60                                       
CONECT   30   29   25   25   61                                       
CONECT   31   17   17                                                 
CONECT   32   21   20                                                 
CONECT   33   21   21                                                 
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   23                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
