COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.927  -0.019  -0.974  1.00  0.00           C  
HETATM    2  C   UNL     1      -8.717   2.913  -0.126  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.364   1.022   1.343  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.568   0.316   0.243  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.051  -1.338  -0.581  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.128  -3.425   0.449  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.799  -1.317   0.234  1.00  0.00           C  
HETATM    8  C   UNL     1       4.718   4.029  -0.646  1.00  0.00           C  
HETATM    9  C   UNL     1       4.652   2.956   0.442  1.00  0.00           C  
HETATM   10  C   UNL     1       4.716   3.621   1.819  1.00  0.00           C  
HETATM   11  C   UNL     1       3.361   2.189   0.314  1.00  0.00           C  
HETATM   12  C   UNL     1       2.154   2.850   0.417  1.00  0.00           C  
HETATM   13  C   UNL     1       0.966   2.156   0.301  1.00  0.00           C  
HETATM   14  C   UNL     1       0.978   0.776   0.077  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.296   0.036  -0.047  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.671   0.009  -0.160  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.740   0.657  -0.765  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.085   0.682  -1.637  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.920   2.207  -1.226  1.00  0.00           C  
HETATM   20  C   UNL     1     -10.358   1.136  -0.026  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.988  -1.986   0.022  1.00  0.00           C  
HETATM   22  C   UNL     1       2.191   0.101  -0.028  1.00  0.00           C  
HETATM   23  C   UNL     1       3.389   0.809   0.085  1.00  0.00           C  
HETATM   24  C   UNL     1       4.641   0.124  -0.027  1.00  0.00           C  
HETATM   25  C   UNL     1       5.668  -0.437  -0.120  1.00  0.00           C  
HETATM   26  C   UNL     1       6.921  -1.122  -0.233  1.00  0.00           C  
HETATM   27  C   UNL     1       7.108  -2.476  -0.457  1.00  0.00           C  
HETATM   28  C   UNL     1       9.079  -1.582  -0.308  1.00  0.00           C  
HETATM   29  C   UNL     1      10.453  -1.277  -0.258  1.00  0.00           C  
HETATM   30  C   UNL     1       9.953   0.948   0.094  1.00  0.00           C  
HETATM   31  C   UNL     1       8.624   0.707   0.058  1.00  0.00           C  
HETATM   32  F   UNL     1      -3.739  -4.263  -0.602  1.00  0.00           F  
HETATM   33  F   UNL     1      -3.313  -3.663   1.561  1.00  0.00           F  
HETATM   34  F   UNL     1      -5.461  -3.685   0.783  1.00  0.00           F  
HETATM   35  N   UNL     1      -1.469   0.691   0.054  1.00  0.00           N  
HETATM   36  N   UNL     1      -6.921   1.321  -0.612  1.00  0.00           N  
HETATM   37  N   UNL     1      -9.363   1.908   0.729  1.00  0.00           N  
HETATM   38  N   UNL     1       8.413  -2.714  -0.496  1.00  0.00           N  
HETATM   39  N   UNL     1      10.838  -0.040  -0.054  1.00  0.00           N  
HETATM   40  N   UNL     1       8.171  -0.564  -0.146  1.00  0.00           N  
HETATM   41  O   UNL     1      -0.285  -1.164  -0.242  1.00  0.00           O  
HETATM   42  H   UNL     1      -8.043   3.524   0.475  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.477   3.549  -0.579  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.867   0.279   1.961  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.686   1.611   1.962  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.807  -0.319   0.696  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.241  -0.295  -0.358  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.980  -1.864  -0.745  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.970  -1.823   0.704  1.00  0.00           H  
HETATM   50  H   UNL     1       3.876   4.713  -0.534  1.00  0.00           H  
HETATM   51  H   UNL     1       5.652   4.584  -0.554  1.00  0.00           H  
HETATM   52  H   UNL     1       4.672   3.556  -1.627  1.00  0.00           H  
HETATM   53  H   UNL     1       5.494   2.272   0.329  1.00  0.00           H  
HETATM   54  H   UNL     1       3.875   4.304   1.931  1.00  0.00           H  
HETATM   55  H   UNL     1       4.670   2.856   2.594  1.00  0.00           H  
HETATM   56  H   UNL     1       5.650   4.175   1.911  1.00  0.00           H  
HETATM   57  H   UNL     1       2.138   3.916   0.590  1.00  0.00           H  
HETATM   58  H   UNL     1       0.026   2.680   0.383  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.644   1.688  -1.072  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.707   1.440  -2.323  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.680  -0.045  -2.190  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.598   1.618  -1.844  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.417   2.950  -1.844  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.869   0.626  -0.856  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.821   0.399   0.631  1.00  0.00           H  
HETATM   66  H   UNL     1     -11.123   1.809  -0.413  1.00  0.00           H  
HETATM   67  H   UNL     1       2.205  -0.965  -0.200  1.00  0.00           H  
HETATM   68  H   UNL     1       6.327  -3.211  -0.579  1.00  0.00           H  
HETATM   69  H   UNL     1      11.187  -2.059  -0.387  1.00  0.00           H  
HETATM   70  H   UNL     1      10.306   1.955   0.261  1.00  0.00           H  
HETATM   71  H   UNL     1       7.923   1.520   0.181  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.480   1.635   0.276  1.00  0.00           H  
CONECT    1   18    5    5   17                                       
CONECT    2   19   37   42   43                                       
CONECT    3   37    4   44   45                                       
CONECT    4   36    3   46   47                                       
CONECT    5    1    1   21   48                                       
CONECT    6   34   21   32   33                                       
CONECT    7   21   21   16   49                                       
CONECT    8    9   50   51   52                                       
CONECT    9   10   11    8   53                                       
CONECT   10    9   54   55   56                                       
CONECT   11   12    9   23   23                                       
CONECT   12   13   13   11   57                                       
CONECT   13   12   12   14   58                                       
CONECT   14   13   15   22   22                                       
CONECT   15   35   14   41   41                                       
CONECT   16   17   17    7   35                                       
CONECT   17    1   16   16   59                                       
CONECT   18   36    1   60   61                                       
CONECT   19    2   36   62   63                                       
CONECT   20   37   64   65   66                                       
CONECT   21    5    6    7    7                                       
CONECT   22   14   14   23   67                                       
CONECT   23   11   11   22   24                                       
CONECT   24   23   25   25   25                                       
CONECT   25   24   24   24   26                                       
CONECT   26   25   27   27   40                                       
CONECT   27   26   26   38   68                                       
CONECT   28   40   38   38   29                                       
CONECT   29   28   39   39   69                                       
CONECT   30   31   31   39   70                                       
CONECT   31   40   30   30   71                                       
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35   16   15   72                                            
CONECT   36   19   18    4                                            
CONECT   37    2   20    3                                            
CONECT   38   27   28   28                                            
CONECT   39   30   29   29                                            
CONECT   40   26   31   28                                            
CONECT   41   15   15                                                 
CONECT   42    2                                                      
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    4                                                      
CONECT   48    5                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54   10                                                      
CONECT   55   10                                                      
CONECT   56   10                                                      
CONECT   57   12                                                      
CONECT   58   13                                                      
CONECT   59   17                                                      
CONECT   60   18                                                      
CONECT   61   18                                                      
CONECT   62   19                                                      
CONECT   63   19                                                      
CONECT   64   20                                                      
CONECT   65   20                                                      
CONECT   66   20                                                      
CONECT   67   22                                                      
CONECT   68   27                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   31                                                      
CONECT   72   35                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
