COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.628   2.140  -0.684  1.00  0.00           C  
HETATM    2  N   UNL     1      -6.755  -1.893  -0.285  1.00  0.00           N  
HETATM    3  C   UNL     1       2.638   0.828  -0.267  1.00  0.00           C  
HETATM    4  C   UNL     1       1.184   1.378   1.695  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.067   2.267  -0.264  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.202   1.486  -0.141  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.824   1.673  -0.395  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.715   0.288  -0.402  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.369   0.262   0.013  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.040   1.382   2.339  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.031   0.276   0.456  1.00  0.00           C  
HETATM   12  O   UNL     1       4.283   4.842  -0.356  1.00  0.00           O  
HETATM   13  C   UNL     1       2.992   4.529   0.172  1.00  0.00           C  
HETATM   14  C   UNL     1       2.480   3.236  -0.466  1.00  0.00           C  
HETATM   15  N   UNL     1       3.315   2.110  -0.027  1.00  0.00           N  
HETATM   16  C   UNL     1       5.494   1.000  -0.141  1.00  0.00           C  
HETATM   17  C   UNL     1       1.303   0.824   0.433  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.147   0.833   1.723  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.150  -0.285  -0.168  1.00  0.00           N  
HETATM   20  N   UNL     1      -4.456  -0.317  -0.534  1.00  0.00           N  
HETATM   21  F   UNL     1      -4.718   2.439  -0.516  1.00  0.00           F  
HETATM   22  C   UNL     1      -8.101   0.107  -0.147  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.859  -0.498  -0.278  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.333  -2.476   0.953  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.614  -3.946   0.555  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.089  -3.823  -0.911  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.528  -2.476  -1.403  1.00  0.00           C  
HETATM   28  O   UNL     1      -3.487   1.278   0.670  1.00  0.00           O  
HETATM   29  C   UNL     1       0.201   0.269  -0.185  1.00  0.00           C  
HETATM   30  C   UNL     1       3.503  -0.313   0.275  1.00  0.00           C  
HETATM   31  N   UNL     1       4.817  -0.282  -0.382  1.00  0.00           N  
HETATM   32  C   UNL     1       5.603  -1.343   0.031  1.00  0.00           C  
HETATM   33  N   UNL     1       5.146  -2.227   0.913  1.00  0.00           N  
HETATM   34  C   UNL     1       5.893  -3.241   1.311  1.00  0.00           C  
HETATM   35  N   UNL     1       7.116  -3.439   0.869  1.00  0.00           N  
HETATM   36  C   UNL     1       7.663  -2.608  -0.017  1.00  0.00           C  
HETATM   37  C   UNL     1       6.901  -1.516  -0.474  1.00  0.00           C  
HETATM   38  C   UNL     1       7.749  -0.795  -1.420  1.00  0.00           C  
HETATM   39  C   UNL     1       8.916  -1.457  -1.480  1.00  0.00           C  
HETATM   40  N   UNL     1       8.875  -2.546  -0.648  1.00  0.00           N  
HETATM   41  H   UNL     1       4.500   2.019  -1.760  1.00  0.00           H  
HETATM   42  H   UNL     1       5.115   3.094  -0.481  1.00  0.00           H  
HETATM   43  H   UNL     1       2.486   0.692  -1.338  1.00  0.00           H  
HETATM   44  H   UNL     1       2.048   1.812   2.177  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.152   3.344  -0.263  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.170   1.954  -0.040  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.129   1.815   3.324  1.00  0.00           H  
HETATM   48  H   UNL     1       4.669   5.652   0.005  1.00  0.00           H  
HETATM   49  H   UNL     1       3.063   4.398   1.252  1.00  0.00           H  
HETATM   50  H   UNL     1       2.302   5.343  -0.051  1.00  0.00           H  
HETATM   51  H   UNL     1       1.448   3.065  -0.161  1.00  0.00           H  
HETATM   52  H   UNL     1       2.529   3.322  -1.552  1.00  0.00           H  
HETATM   53  H   UNL     1       6.459   1.003  -0.649  1.00  0.00           H  
HETATM   54  H   UNL     1       5.645   1.136   0.929  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.103   0.836   2.226  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.049  -1.068  -0.732  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.368  -1.153  -1.019  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.989  -0.499  -0.051  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.615  -2.430   1.771  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.258  -1.967   1.223  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.705  -4.543   0.617  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.397  -4.373   1.182  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.688  -4.641  -1.509  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.178  -3.820  -0.957  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.347  -1.810  -1.676  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.875  -2.637  -2.261  1.00  0.00           H  
HETATM   67  H   UNL     1       0.294  -0.163  -1.171  1.00  0.00           H  
HETATM   68  H   UNL     1       3.632  -0.192   1.351  1.00  0.00           H  
HETATM   69  H   UNL     1       3.017  -1.267   0.072  1.00  0.00           H  
HETATM   70  H   UNL     1       5.483  -3.936   2.029  1.00  0.00           H  
HETATM   71  H   UNL     1       7.488   0.099  -1.967  1.00  0.00           H  
HETATM   72  H   UNL     1       9.759  -1.176  -2.093  1.00  0.00           H  
HETATM   73  H   UNL     1       9.599  -3.179  -0.524  1.00  0.00           H  
CONECT    1   16   15   41   42                                       
CONECT    2   23   27   24                                            
CONECT    3   30   17   15   43                                       
CONECT    4   10   10   17   44                                       
CONECT    5    7    7    6   45                                       
CONECT    6    5   22   22   46                                       
CONECT    7   21    5    5    8                                       
CONECT    8    7   20   23   23                                       
CONECT    9   28   28   19   20                                       
CONECT   10    4    4   18   47                                       
CONECT   11   18   18   29   19                                       
CONECT   12   13   48                                                 
CONECT   13   14   12   49   50                                       
CONECT   14   15   13   51   52                                       
CONECT   15    3    1   14                                            
CONECT   16   31    1   53   54                                       
CONECT   17    4    3   29   29                                       
CONECT   18   10   11   11   55                                       
CONECT   19   11    9   56                                            
CONECT   20    9    8   57                                            
CONECT   21    7                                                      
CONECT   22    6    6   23   58                                       
CONECT   23    8    8   22    2                                       
CONECT   24    2   25   59   60                                       
CONECT   25   24   26   61   62                                       
CONECT   26   27   25   63   64                                       
CONECT   27    2   26   65   66                                       
CONECT   28    9    9                                                 
CONECT   29   17   17   11   67                                       
CONECT   30   31    3   68   69                                       
CONECT   31   32   30   16                                            
CONECT   32   33   33   37   31                                       
CONECT   33   34   32   32                                            
CONECT   34   35   35   33   70                                       
CONECT   35   34   34   36                                            
CONECT   36   35   40   37   37                                       
CONECT   37   36   36   38   32                                       
CONECT   38   39   39   37   71                                       
CONECT   39   40   38   38   72                                       
CONECT   40   36   39   73                                            
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   22                                                      
CONECT   59   24                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   27                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   30                                                      
CONECT   70   34                                                      
CONECT   71   38                                                      
CONECT   72   39                                                      
CONECT   73   40                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
