COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.648   0.604  13.828  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.708   1.264  12.450  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.398   0.224  11.371  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.458   0.885   9.993  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.148  -0.155   8.915  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.208   0.505   7.536  1.00  0.00           C  
HETATM    7  C   UNL     1       0.100  -0.534   6.458  1.00  0.00           C  
HETATM    8  C   UNL     1       0.040   0.126   5.079  1.00  0.00           C  
HETATM    9  C   UNL     1       0.350  -0.914   4.001  1.00  0.00           C  
HETATM   10  C   UNL     1       0.290  -0.253   2.622  1.00  0.00           C  
HETATM   11  C   UNL     1       0.600  -1.294   1.544  1.00  0.00           C  
HETATM   12  C   UNL     1       0.540  -0.633   0.165  1.00  0.00           C  
HETATM   13  C   UNL     1       0.849  -1.673  -0.912  1.00  0.00           C  
HETATM   14  C   UNL     1       0.790  -1.022  -2.270  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.375  -1.012  -2.924  1.00  0.00           O  
HETATM   16  C   UNL     1       1.913  -0.481  -2.773  1.00  0.00           C  
HETATM   17  C   UNL     1       3.197  -0.532  -1.986  1.00  0.00           C  
HETATM   18  C   UNL     1       1.882   0.137  -4.052  1.00  0.00           C  
HETATM   19  O   UNL     1       2.882   0.638  -4.540  1.00  0.00           O  
HETATM   20  C   UNL     1       0.594   0.150  -4.764  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.516  -0.446  -4.142  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.743  -0.448  -4.793  1.00  0.00           C  
HETATM   23  O   UNL     1      -2.827  -1.022  -4.203  1.00  0.00           O  
HETATM   24  C   UNL     1      -1.862   0.135  -6.048  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.065   0.131  -6.680  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.876   0.794  -7.932  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.763   0.725  -6.663  1.00  0.00           C  
HETATM   28  C   UNL     1       0.465   0.736  -6.029  1.00  0.00           C  
HETATM   29  O   UNL     1       1.538   1.311  -6.630  1.00  0.00           O  
HETATM   30  C   UNL     1       1.088   1.811  -7.890  1.00  0.00           C  
HETATM   31  H   UNL     1      -0.868   1.345  14.596  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.382  -0.200  13.878  1.00  0.00           H  
HETATM   33  H   UNL     1       0.349   0.196  13.993  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.705   1.672  12.285  1.00  0.00           H  
HETATM   35  H   UNL     1       0.025   2.069  12.400  1.00  0.00           H  
HETATM   36  H   UNL     1       0.599  -0.183  11.536  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.132  -0.579  11.421  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.456   1.292   9.828  1.00  0.00           H  
HETATM   39  H   UNL     1       0.275   1.689   9.943  1.00  0.00           H  
HETATM   40  H   UNL     1       0.848  -0.562   9.079  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.882  -0.959   8.964  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.206   0.913   7.372  1.00  0.00           H  
HETATM   43  H   UNL     1       0.525   1.310   7.486  1.00  0.00           H  
HETATM   44  H   UNL     1       1.098  -0.942   6.622  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.633  -1.339   6.507  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.956   0.533   4.915  1.00  0.00           H  
HETATM   47  H   UNL     1       0.774   0.930   5.029  1.00  0.00           H  
HETATM   48  H   UNL     1       1.348  -1.322   4.165  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.383  -1.718   4.051  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.707   0.154   2.458  1.00  0.00           H  
HETATM   51  H   UNL     1       1.024   0.550   2.573  1.00  0.00           H  
HETATM   52  H   UNL     1       1.597  -1.701   1.708  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.133  -2.098   1.594  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.457  -0.225   0.001  1.00  0.00           H  
HETATM   55  H   UNL     1       1.274   0.171   0.116  1.00  0.00           H  
HETATM   56  H   UNL     1       1.847  -2.081  -0.747  1.00  0.00           H  
HETATM   57  H   UNL     1       0.116  -2.477  -0.862  1.00  0.00           H  
HETATM   58  H   UNL     1       3.991  -0.046  -2.554  1.00  0.00           H  
HETATM   59  H   UNL     1       3.062  -0.016  -1.036  1.00  0.00           H  
HETATM   60  H   UNL     1       3.468  -1.571  -1.800  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.837  -1.949  -4.479  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.819   0.815  -8.478  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.536   1.814  -7.755  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.128   0.258  -8.517  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.870   1.175  -7.638  1.00  0.00           H  
HETATM   66  H   UNL     1       1.920   2.284  -8.412  1.00  0.00           H  
HETATM   67  H   UNL     1       0.703   0.987  -8.492  1.00  0.00           H  
HETATM   68  H   UNL     1       0.296   2.543  -7.729  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    2    4   36   37                                       
CONECT    4    3    5   38   39                                       
CONECT    5    4    6   40   41                                       
CONECT    6    5    7   42   43                                       
CONECT    7    6    8   44   45                                       
CONECT    8    7    9   46   47                                       
CONECT    9    8   10   48   49                                       
CONECT   10    9   11   50   51                                       
CONECT   11   10   12   52   53                                       
CONECT   12   11   13   54   55                                       
CONECT   13   12   14   56   57                                       
CONECT   14   13   15   16   16                                       
CONECT   15   14   21                                                 
CONECT   16   14   14   17   18                                       
CONECT   17   16   58   59   60                                       
CONECT   18   16   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   21   21   28                                       
CONECT   21   15   20   20   22                                       
CONECT   22   21   23   24   24                                       
CONECT   23   22   61                                                 
CONECT   24   22   22   25   27                                       
CONECT   25   24   26                                                 
CONECT   26   25   62   63   64                                       
CONECT   27   24   28   28   65                                       
CONECT   28   20   27   27   29                                       
CONECT   29   28   30                                                 
CONECT   30   29   66   67   68                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   10                                                      
CONECT   52   11                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   12                                                      
CONECT   56   13                                                      
CONECT   57   13                                                      
CONECT   58   17                                                      
CONECT   59   17                                                      
CONECT   60   17                                                      
CONECT   61   23                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   30                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
