COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.153   0.235  -0.089  1.00  0.00           C  
HETATM    2  C   UNL     1       3.933  -1.026   0.289  1.00  0.00           C  
HETATM    3  C   UNL     1       5.291  -1.015  -0.414  1.00  0.00           C  
HETATM    4  C   UNL     1       6.080   0.222   0.019  1.00  0.00           C  
HETATM    5  C   UNL     1       5.300   1.482  -0.359  1.00  0.00           C  
HETATM    6  C   UNL     1       5.089   1.517  -1.874  1.00  0.00           C  
HETATM    7  C   UNL     1       3.942   1.472   0.345  1.00  0.00           C  
HETATM    8  O   UNL     1       4.129  -1.058   1.704  1.00  0.00           O  
HETATM    9  O   UNL     1       5.095  -0.984  -1.829  1.00  0.00           O  
HETATM   10  O   UNL     1       6.277   0.190   1.434  1.00  0.00           O  
HETATM   11  O   UNL     1       3.213   2.649  -0.009  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.863  -1.355  -0.633  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.903  -2.330   0.053  1.00  0.00           C  
HETATM   14  C   UNL     1       0.158  -1.535   0.821  1.00  0.00           C  
HETATM   15  C   UNL     1       0.879  -0.597  -0.151  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.149   0.312  -0.830  1.00  0.00           C  
HETATM   17  C   UNL     1       0.557   1.211  -1.847  1.00  0.00           C  
HETATM   18  N   UNL     1       1.848   0.224   0.587  1.00  0.00           N  
HETATM   19  O   UNL     1      -1.632  -3.156   0.963  1.00  0.00           O  
HETATM   20  O   UNL     1       1.101  -2.436   1.404  1.00  0.00           O  
HETATM   21  O   UNL     1      -1.124  -0.491  -1.499  1.00  0.00           O  
HETATM   22  C   UNL     1      -6.262   1.314   0.299  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.104   0.093  -0.610  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.899  -0.730  -0.143  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.654   0.162  -0.147  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.906   1.381   0.745  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.689   2.308   0.699  1.00  0.00           C  
HETATM   28  O   UNL     1      -7.285  -0.709  -0.541  1.00  0.00           O  
HETATM   29  O   UNL     1      -4.700  -1.832  -1.030  1.00  0.00           O  
HETATM   30  O   UNL     1      -2.537  -0.574   0.356  1.00  0.00           O  
HETATM   31  O   UNL     1      -5.058   2.084   0.274  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.888   3.399   1.599  1.00  0.00           O  
HETATM   33  H   UNL     1       3.003   0.259  -1.168  1.00  0.00           H  
HETATM   34  H   UNL     1       3.371  -1.908  -0.019  1.00  0.00           H  
HETATM   35  H   UNL     1       5.847  -1.913  -0.145  1.00  0.00           H  
HETATM   36  H   UNL     1       7.048   0.229  -0.482  1.00  0.00           H  
HETATM   37  H   UNL     1       5.862   2.364  -0.050  1.00  0.00           H  
HETATM   38  H   UNL     1       4.369   0.749  -2.158  1.00  0.00           H  
HETATM   39  H   UNL     1       4.711   2.496  -2.166  1.00  0.00           H  
HETATM   40  H   UNL     1       6.038   1.329  -2.377  1.00  0.00           H  
HETATM   41  H   UNL     1       4.092   1.447   1.424  1.00  0.00           H  
HETATM   42  H   UNL     1       4.618  -1.832   2.016  1.00  0.00           H  
HETATM   43  H   UNL     1       5.915  -0.975  -2.340  1.00  0.00           H  
HETATM   44  H   UNL     1       6.766  -0.584   1.746  1.00  0.00           H  
HETATM   45  H   UNL     1       3.655   3.474   0.237  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.595  -1.914  -1.216  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.419  -2.954  -0.698  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.322  -0.949   1.605  1.00  0.00           H  
HETATM   49  H   UNL     1       1.400  -1.185  -0.907  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.641   0.929  -0.078  1.00  0.00           H  
HETATM   51  H   UNL     1       1.062   0.593  -2.589  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.178   1.846  -2.342  1.00  0.00           H  
HETATM   53  H   UNL     1       1.288   1.835  -1.334  1.00  0.00           H  
HETATM   54  H   UNL     1       1.938  -0.092   1.541  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.325  -3.685   0.545  1.00  0.00           H  
HETATM   56  H   UNL     1       0.711  -3.065   2.027  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.092   1.926  -0.054  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.461   0.985   1.319  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.945   0.421  -1.637  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.079  -1.100   0.866  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.445   0.493  -1.165  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.074   1.053   1.770  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.798   1.752   0.992  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.562   2.690  -0.314  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.089  -0.250  -0.818  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.453  -2.436  -1.083  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.154   4.029   1.622  1.00  0.00           H  
CONECT    1    2    7   18   33                                       
CONECT    2    1    3    8   34                                       
CONECT    3    2    4    9   35                                       
CONECT    4    3    5   10   36                                       
CONECT    5    4    6    7   37                                       
CONECT    6    5   38   39   40                                       
CONECT    7    1    5   11   41                                       
CONECT    8    2   42                                                 
CONECT    9    3   43                                                 
CONECT   10    4   44                                                 
CONECT   11    7   45                                                 
CONECT   12   13   21   30   46                                       
CONECT   13   12   14   19   47                                       
CONECT   14   13   15   20   48                                       
CONECT   15   14   16   18   49                                       
CONECT   16   15   17   21   50                                       
CONECT   17   16   51   52   53                                       
CONECT   18    1   15   54                                            
CONECT   19   13   55                                                 
CONECT   20   14   56                                                 
CONECT   21   12   16                                                 
CONECT   22   23   31   57   58                                       
CONECT   23   22   24   28   59                                       
CONECT   24   23   25   29   60                                       
CONECT   25   24   26   30   61                                       
CONECT   26   25   27   31   62                                       
CONECT   27   26   32   63   64                                       
CONECT   28   23   65                                                 
CONECT   29   24   66                                                 
CONECT   30   12   25                                                 
CONECT   31   22   26                                                 
CONECT   32   27   67                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   27                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   32                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
