COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.286   0.289  -1.281  1.00  0.00           C  
HETATM    2  C   UNL     1       1.742   1.686  -0.496  1.00  0.00           C  
HETATM    3  C   UNL     1       5.801  -1.446   0.535  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.334   1.250  -0.717  1.00  0.00           C  
HETATM    5  C   UNL     1       0.705   2.555   0.221  1.00  0.00           C  
HETATM    6  C   UNL     1       5.856  -0.046  -0.080  1.00  0.00           C  
HETATM    7  O   UNL     1      -3.737   2.530  -0.495  1.00  0.00           O  
HETATM    8  O   UNL     1       1.281   3.105   1.407  1.00  0.00           O  
HETATM    9  O   UNL     1       7.031   0.629   0.373  1.00  0.00           O  
HETATM   10  C   UNL     1      -4.870   0.701   0.607  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.504   1.691   0.593  1.00  0.00           C  
HETATM   12  C   UNL     1       4.615   0.742   0.350  1.00  0.00           C  
HETATM   13  O   UNL     1      -5.849   1.599   1.133  1.00  0.00           O  
HETATM   14  O   UNL     1      -1.508   2.509   1.197  1.00  0.00           O  
HETATM   15  O   UNL     1       4.621   2.025  -0.279  1.00  0.00           O  
HETATM   16  C   UNL     1      -5.509  -0.669   0.369  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.066   1.044  -0.677  1.00  0.00           C  
HETATM   18  C   UNL     1       3.361  -0.030  -0.072  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.180   0.154  -0.324  1.00  0.00           N  
HETATM   20  O   UNL     1      -6.009  -1.182   1.605  1.00  0.00           O  
HETATM   21  O   UNL     1       2.198   0.660   0.388  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.460  -1.630  -0.195  1.00  0.00           C  
HETATM   23  C   UNL     1       0.040   0.234  -1.360  1.00  0.00           C  
HETATM   24  C   UNL     1       3.402  -1.431   0.543  1.00  0.00           C  
HETATM   25  O   UNL     1       1.146   1.090  -1.650  1.00  0.00           O  
HETATM   26  O   UNL     1       4.596  -2.098   0.127  1.00  0.00           O  
HETATM   27  C   UNL     1      -5.099  -2.999  -0.433  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.497  -0.366  -2.661  1.00  0.00           C  
HETATM   29  C   UNL     1       2.183  -2.229   0.077  1.00  0.00           C  
HETATM   30  O   UNL     1      -5.495  -3.564   0.819  1.00  0.00           O  
HETATM   31  O   UNL     1       2.172  -3.503   0.724  1.00  0.00           O  
HETATM   32  C   UNL     1      -3.924  -1.080  -1.519  1.00  0.00           C  
HETATM   33  O   UNL     1       6.927  -2.206   0.093  1.00  0.00           O  
HETATM   34  H   UNL     1      -2.904   0.681  -2.224  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.155   1.351  -1.427  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.495   0.327   0.619  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.745  -0.980  -2.229  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.178  -1.765  -1.921  1.00  0.00           H  
HETATM   39  H   UNL     1       2.586   2.305  -0.801  1.00  0.00           H  
HETATM   40  H   UNL     1       0.388   3.362  -0.439  1.00  0.00           H  
HETATM   41  H   UNL     1       5.820  -1.366   1.622  1.00  0.00           H  
HETATM   42  H   UNL     1       5.878  -0.126  -1.167  1.00  0.00           H  
HETATM   43  H   UNL     1       6.957  -3.106   0.445  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.345   3.191  -0.137  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.049   0.601   1.317  1.00  0.00           H  
HETATM   46  H   UNL     1       2.056   3.661   1.246  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.196   0.915   1.293  1.00  0.00           H  
HETATM   48  H   UNL     1       7.856   0.183   0.139  1.00  0.00           H  
HETATM   49  H   UNL     1       4.620   0.867   1.433  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.232   1.313   1.974  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.329  -0.569  -0.341  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.218   2.955   2.004  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.420   1.821  -1.355  1.00  0.00           H  
HETATM   54  H   UNL     1       5.392   2.567  -0.061  1.00  0.00           H  
HETATM   55  H   UNL     1       3.331  -0.109  -1.159  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.679  -0.623   2.021  1.00  0.00           H  
HETATM   57  H   UNL     1       0.365  -0.568  -0.696  1.00  0.00           H  
HETATM   58  H   UNL     1       3.391  -1.351   1.630  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.974  -2.886  -1.073  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.378  -3.658  -0.916  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.885   0.430  -3.295  1.00  0.00           H  
HETATM   62  H   UNL     1       0.309  -0.885  -3.181  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.296  -1.072  -2.433  1.00  0.00           H  
HETATM   64  H   UNL     1       1.274  -1.684   0.331  1.00  0.00           H  
HETATM   65  H   UNL     1       2.233  -2.371  -1.003  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.909  -4.435   0.745  1.00  0.00           H  
HETATM   67  H   UNL     1       1.425  -4.064   0.475  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.639  -1.730   0.515  1.00  0.00           H  
CONECT    1    4   19   32   34                                       
CONECT    2    5   21   25   39                                       
CONECT    3    6   26   33   41                                       
CONECT    4    1    7   10   35                                       
CONECT    5    2    8   11   40                                       
CONECT    6    3    9   12   42                                       
CONECT    7    4   44                                                 
CONECT    8    5   46                                                 
CONECT    9    6   48                                                 
CONECT   10    4   13   16   45                                       
CONECT   11    5   14   17   47                                       
CONECT   12    6   15   18   49                                       
CONECT   13   10   50                                                 
CONECT   14   11   52                                                 
CONECT   15   12   54                                                 
CONECT   16   10   20   22   51                                       
CONECT   17   11   19   23   53                                       
CONECT   18   12   21   24   55                                       
CONECT   19    1   17   36                                            
CONECT   20   16   56                                                 
CONECT   21    2   18                                                 
CONECT   22   16   27   32   68                                       
CONECT   23   17   25   28   57                                       
CONECT   24   18   26   29   58                                       
CONECT   25    2   23                                                 
CONECT   26    3   24                                                 
CONECT   27   22   30   59   60                                       
CONECT   28   23   61   62   63                                       
CONECT   29   24   31   64   65                                       
CONECT   30   27   66                                                 
CONECT   31   29   67                                                 
CONECT   32    1   22   37   38                                       
CONECT   33    3   43                                                 
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36   19                                                      
CONECT   37   32                                                      
CONECT   38   32                                                      
CONECT   39    2                                                      
CONECT   40    5                                                      
CONECT   41    3                                                      
CONECT   42    6                                                      
CONECT   43   33                                                      
CONECT   44    7                                                      
CONECT   45   10                                                      
CONECT   46    8                                                      
CONECT   47   11                                                      
CONECT   48    9                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   16                                                      
CONECT   52   14                                                      
CONECT   53   17                                                      
CONECT   54   15                                                      
CONECT   55   18                                                      
CONECT   56   20                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   29                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   22                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
