COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.204   4.120   1.556  1.00  0.00           N  
HETATM    2  C   UNL     1       6.774   3.486   0.805  1.00  0.00           C  
HETATM    3  C   UNL     1       7.514   2.664  -0.167  1.00  0.00           C  
HETATM    4  C   UNL     1       8.497   3.381  -1.095  1.00  0.00           C  
HETATM    5  C   UNL     1       9.021   2.505   0.044  1.00  0.00           C  
HETATM    6  C   UNL     1       6.750   1.467  -0.736  1.00  0.00           C  
HETATM    7  O   UNL     1       5.887   0.931   0.269  1.00  0.00           O  
HETATM    8  C   UNL     1       5.123  -0.197  -0.162  1.00  0.00           C  
HETATM    9  C   UNL     1       4.858  -1.117   1.031  1.00  0.00           C  
HETATM   10  O   UNL     1       6.096  -1.441   1.665  1.00  0.00           O  
HETATM   11  C   UNL     1       4.177  -2.404   0.552  1.00  0.00           C  
HETATM   12  C   UNL     1       3.793   0.284  -0.752  1.00  0.00           C  
HETATM   13  O   UNL     1       3.079   1.042   0.225  1.00  0.00           O  
HETATM   14  C   UNL     1       2.980  -0.932  -1.151  1.00  0.00           C  
HETATM   15  C   UNL     1       2.372  -1.008  -2.334  1.00  0.00           C  
HETATM   16  C   UNL     1       2.895  -2.028  -0.164  1.00  0.00           C  
HETATM   17  C   UNL     1       1.733  -2.664   0.088  1.00  0.00           C  
HETATM   18  C   UNL     1       0.514  -2.273  -0.624  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.635  -2.901  -0.375  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.744  -4.027   0.642  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.904  -3.776   1.604  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.913  -2.544  -1.073  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.905  -1.263  -1.911  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.408  -0.869  -1.951  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.061  -1.514  -0.701  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.911  -2.161   0.056  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.261  -1.121   0.971  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.195  -3.406   0.855  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.732  -0.443   0.161  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.338  -1.096   1.406  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.838   0.242  -0.645  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.424   1.395   0.172  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.530   2.080  -0.634  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.117   3.233   0.182  1.00  0.00           C  
HETATM   35  O   UNL     1      -8.662   2.724   1.402  1.00  0.00           O  
HETATM   36  C   UNL     1      -7.015   4.246   0.500  1.00  0.00           C  
HETATM   37  C   UNL     1      -9.222   3.918  -0.624  1.00  0.00           C  
HETATM   38  H   UNL     1       8.599   3.000  -2.111  1.00  0.00           H  
HETATM   39  H   UNL     1       8.595   4.461  -0.986  1.00  0.00           H  
HETATM   40  H   UNL     1       9.465   3.009   0.903  1.00  0.00           H  
HETATM   41  H   UNL     1       9.468   1.547  -0.222  1.00  0.00           H  
HETATM   42  H   UNL     1       6.155   1.789  -1.591  1.00  0.00           H  
HETATM   43  H   UNL     1       7.458   0.701  -1.053  1.00  0.00           H  
HETATM   44  H   UNL     1       5.681  -0.743  -0.923  1.00  0.00           H  
HETATM   45  H   UNL     1       4.208  -0.608   1.743  1.00  0.00           H  
HETATM   46  H   UNL     1       6.005  -2.023   2.431  1.00  0.00           H  
HETATM   47  H   UNL     1       4.838  -2.935  -0.132  1.00  0.00           H  
HETATM   48  H   UNL     1       3.948  -3.037   1.409  1.00  0.00           H  
HETATM   49  H   UNL     1       3.984   0.902  -1.630  1.00  0.00           H  
HETATM   50  H   UNL     1       2.226   1.377  -0.083  1.00  0.00           H  
HETATM   51  H   UNL     1       2.452  -0.191  -3.036  1.00  0.00           H  
HETATM   52  H   UNL     1       1.799  -1.887  -2.591  1.00  0.00           H  
HETATM   53  H   UNL     1       1.700  -3.462   0.816  1.00  0.00           H  
HETATM   54  H   UNL     1       0.547  -1.475  -1.352  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.909  -4.969   0.119  1.00  0.00           H  
HETATM   56  H   UNL     1       0.185  -4.090   1.210  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.080  -4.678   2.191  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.638  -2.962   2.277  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.280  -3.386  -1.660  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.314  -0.487  -1.424  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.531  -1.462  -2.916  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.512   0.215  -1.910  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.873  -1.255  -2.858  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.789  -2.269  -1.001  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.120  -0.191   0.421  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.905  -0.941   1.831  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.294  -1.492   1.312  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.485  -4.220   0.191  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.994  -3.210   1.571  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.991   0.297   0.463  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.816  -0.332   2.020  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.079  -1.836   1.104  1.00  0.00           H  
HETATM   73  H   UNL     1      -4.550  -1.583   1.980  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.422   0.630  -1.575  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.622  -0.480  -0.871  1.00  0.00           H  
HETATM   76  H   UNL     1      -6.840   1.007   1.102  1.00  0.00           H  
HETATM   77  H   UNL     1      -5.639   2.116   0.398  1.00  0.00           H  
HETATM   78  H   UNL     1      -7.114   2.468  -1.564  1.00  0.00           H  
HETATM   79  H   UNL     1      -8.315   1.358  -0.860  1.00  0.00           H  
HETATM   80  H   UNL     1      -9.367   2.075   1.276  1.00  0.00           H  
HETATM   81  H   UNL     1      -6.599   4.634  -0.430  1.00  0.00           H  
HETATM   82  H   UNL     1      -7.433   5.067   1.082  1.00  0.00           H  
HETATM   83  H   UNL     1      -6.227   3.758   1.074  1.00  0.00           H  
HETATM   84  H   UNL     1      -8.807   4.306  -1.554  1.00  0.00           H  
HETATM   85  H   UNL     1     -10.007   3.196  -0.850  1.00  0.00           H  
HETATM   86  H   UNL     1      -9.641   4.739  -0.042  1.00  0.00           H  
CONECT    1    2    2    2                                            
CONECT    2    3    1    1    1                                       
CONECT    3    5    6    4    2                                       
CONECT    4    5    3   38   39                                       
CONECT    5    3    4   40   41                                       
CONECT    6    3    7   42   43                                       
CONECT    7    6    8                                                 
CONECT    8    9    7   12   44                                       
CONECT    9   11   10    8   45                                       
CONECT   10    9   46                                                 
CONECT   11    9   16   47   48                                       
CONECT   12    8   14   13   49                                       
CONECT   13   12   50                                                 
CONECT   14   16   15   15   12                                       
CONECT   15   14   14   51   52                                       
CONECT   16   11   17   17   14                                       
CONECT   17   16   16   18   53                                       
CONECT   18   17   19   19   54                                       
CONECT   19   20   18   18   22                                       
CONECT   20   21   19   55   56                                       
CONECT   21   20   28   57   58                                       
CONECT   22   26   19   23   59                                       
CONECT   23   22   24   60   61                                       
CONECT   24   25   23   62   63                                       
CONECT   25   26   29   24   64                                       
CONECT   26   28   27   22   25                                       
CONECT   27   26   65   66   67                                       
CONECT   28   21   26   68   69                                       
CONECT   29   31   25   30   70                                       
CONECT   30   29   71   72   73                                       
CONECT   31   32   29   74   75                                       
CONECT   32   33   31   76   77                                       
CONECT   33   34   32   78   79                                       
CONECT   34   37   36   33   35                                       
CONECT   35   34   80                                                 
CONECT   36   34   81   82   83                                       
CONECT   37   34   84   85   86                                       
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   24                                                      
CONECT   64   25                                                      
CONECT   65   27                                                      
CONECT   66   27                                                      
CONECT   67   27                                                      
CONECT   68   28                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   30                                                      
CONECT   73   30                                                      
CONECT   74   31                                                      
CONECT   75   31                                                      
CONECT   76   32                                                      
CONECT   77   32                                                      
CONECT   78   33                                                      
CONECT   79   33                                                      
CONECT   80   35                                                      
CONECT   81   36                                                      
CONECT   82   36                                                      
CONECT   83   36                                                      
CONECT   84   37                                                      
CONECT   85   37                                                      
CONECT   86   37                                                      
MASTER        0    0    0    0    0    0    0    0   86    0   86    0
END
