COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      15.323   1.975   0.191  1.00  0.00           C  
HETATM    2  C   UNL     1      14.288   0.850   0.266  1.00  0.00           C  
HETATM    3  C   UNL     1      12.884   1.437   0.107  1.00  0.00           C  
HETATM    4  C   UNL     1      11.850   0.312   0.183  1.00  0.00           C  
HETATM    5  C   UNL     1      10.446   0.898   0.024  1.00  0.00           C  
HETATM    6  C   UNL     1       9.411  -0.226   0.100  1.00  0.00           C  
HETATM    7  C   UNL     1       8.007   0.360  -0.060  1.00  0.00           C  
HETATM    8  C   UNL     1       6.973  -0.765   0.016  1.00  0.00           C  
HETATM    9  C   UNL     1       5.569  -0.178  -0.143  1.00  0.00           C  
HETATM   10  C   UNL     1       4.535  -1.303  -0.067  1.00  0.00           C  
HETATM   11  C   UNL     1       3.131  -0.716  -0.226  1.00  0.00           C  
HETATM   12  C   UNL     1       2.096  -1.841  -0.150  1.00  0.00           C  
HETATM   13  C   UNL     1       0.692  -1.255  -0.310  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.342  -2.380  -0.234  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.746  -1.793  -0.393  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.885  -1.239  -1.703  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.786  -2.897  -0.193  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.724  -3.372   1.153  1.00  0.00           O  
HETATM   19  C   UNL     1      -4.183  -2.339  -0.473  1.00  0.00           C  
HETATM   20  N   UNL     1      -5.168  -3.427  -0.400  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.524  -1.271   0.568  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.777  -0.669   0.239  1.00  0.00           O  
HETATM   23  C   UNL     1      -6.191   0.348   1.154  1.00  0.00           C  
HETATM   24  O   UNL     1      -5.344   1.491   1.010  1.00  0.00           O  
HETATM   25  C   UNL     1      -5.341   2.053  -0.304  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.384   3.246  -0.345  1.00  0.00           C  
HETATM   27  O   UNL     1      -3.047   2.792  -0.125  1.00  0.00           O  
HETATM   28  C   UNL     1      -6.754   2.520  -0.662  1.00  0.00           C  
HETATM   29  O   UNL     1      -7.163   3.545   0.246  1.00  0.00           O  
HETATM   30  C   UNL     1      -7.717   1.332  -0.559  1.00  0.00           C  
HETATM   31  O   UNL     1      -9.050   1.774  -0.820  1.00  0.00           O  
HETATM   32  C   UNL     1      -7.638   0.746   0.854  1.00  0.00           C  
HETATM   33  O   UNL     1      -8.478  -0.407   0.940  1.00  0.00           O  
HETATM   34  H   UNL     1      15.245   2.475  -0.775  1.00  0.00           H  
HETATM   35  H   UNL     1      15.137   2.694   0.988  1.00  0.00           H  
HETATM   36  H   UNL     1      16.323   1.557   0.304  1.00  0.00           H  
HETATM   37  H   UNL     1      14.474   0.131  -0.531  1.00  0.00           H  
HETATM   38  H   UNL     1      14.366   0.350   1.232  1.00  0.00           H  
HETATM   39  H   UNL     1      12.698   2.156   0.905  1.00  0.00           H  
HETATM   40  H   UNL     1      12.807   1.937  -0.858  1.00  0.00           H  
HETATM   41  H   UNL     1      12.036  -0.407  -0.615  1.00  0.00           H  
HETATM   42  H   UNL     1      11.927  -0.188   1.148  1.00  0.00           H  
HETATM   43  H   UNL     1      10.260   1.617   0.822  1.00  0.00           H  
HETATM   44  H   UNL     1      10.368   1.399  -0.942  1.00  0.00           H  
HETATM   45  H   UNL     1       9.597  -0.946  -0.698  1.00  0.00           H  
HETATM   46  H   UNL     1       9.489  -0.727   1.065  1.00  0.00           H  
HETATM   47  H   UNL     1       7.821   1.079   0.738  1.00  0.00           H  
HETATM   48  H   UNL     1       7.930   0.860  -1.025  1.00  0.00           H  
HETATM   49  H   UNL     1       7.159  -1.484  -0.781  1.00  0.00           H  
HETATM   50  H   UNL     1       7.050  -1.265   0.982  1.00  0.00           H  
HETATM   51  H   UNL     1       5.383   0.541   0.655  1.00  0.00           H  
HETATM   52  H   UNL     1       5.492   0.322  -1.108  1.00  0.00           H  
HETATM   53  H   UNL     1       4.721  -2.022  -0.865  1.00  0.00           H  
HETATM   54  H   UNL     1       4.612  -1.803   0.898  1.00  0.00           H  
HETATM   55  H   UNL     1       2.945   0.003   0.571  1.00  0.00           H  
HETATM   56  H   UNL     1       3.053  -0.216  -1.192  1.00  0.00           H  
HETATM   57  H   UNL     1       2.282  -2.560  -0.948  1.00  0.00           H  
HETATM   58  H   UNL     1       2.174  -2.342   0.815  1.00  0.00           H  
HETATM   59  H   UNL     1       0.506  -0.536   0.488  1.00  0.00           H  
HETATM   60  H   UNL     1       0.615  -0.754  -1.275  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.156  -3.099  -1.032  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.265  -2.880   0.732  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.900  -1.011   0.350  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.761  -1.880  -2.416  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.579  -3.720  -0.878  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.898  -2.692   1.818  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.204  -1.896  -1.469  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.017  -4.102  -1.135  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.152  -3.869   0.506  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.590  -1.733   1.553  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.745  -0.509   0.575  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.121  -0.030   2.174  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.014   1.300  -1.020  1.00  0.00           H  
HETATM   74  H   UNL     1      -4.447   3.729  -1.321  1.00  0.00           H  
HETATM   75  H   UNL     1      -4.658   3.960   0.432  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.385   3.497  -0.138  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.762   2.909  -1.679  1.00  0.00           H  
HETATM   78  H   UNL     1      -8.051   3.888   0.077  1.00  0.00           H  
HETATM   79  H   UNL     1      -7.435   0.570  -1.286  1.00  0.00           H  
HETATM   80  H   UNL     1      -9.715   1.074  -0.765  1.00  0.00           H  
HETATM   81  H   UNL     1      -7.968   1.493   1.577  1.00  0.00           H  
HETATM   82  H   UNL     1      -8.477  -0.830   1.810  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    1    3   37   38                                       
CONECT    3    2    4   39   40                                       
CONECT    4    3    5   41   42                                       
CONECT    5    4    6   43   44                                       
CONECT    6    5    7   45   46                                       
CONECT    7    6    8   47   48                                       
CONECT    8    7    9   49   50                                       
CONECT    9    8   10   51   52                                       
CONECT   10    9   11   53   54                                       
CONECT   11   10   12   55   56                                       
CONECT   12   11   13   57   58                                       
CONECT   13   12   14   59   60                                       
CONECT   14   13   15   61   62                                       
CONECT   15   16   14   17   63                                       
CONECT   16   15   64                                                 
CONECT   17   15   18   19   65                                       
CONECT   18   17   66                                                 
CONECT   19   17   20   21   67                                       
CONECT   20   19   68   69                                            
CONECT   21   19   22   70   71                                       
CONECT   22   21   23                                                 
CONECT   23   32   22   24   72                                       
CONECT   24   23   25                                                 
CONECT   25   28   24   26   73                                       
CONECT   26   25   27   74   75                                       
CONECT   27   26   76                                                 
CONECT   28   30   29   25   77                                       
CONECT   29   28   78                                                 
CONECT   30   31   32   28   79                                       
CONECT   31   30   80                                                 
CONECT   32   33   30   23   81                                       
CONECT   33   32   82                                                 
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53   10                                                      
CONECT   54   10                                                      
CONECT   55   11                                                      
CONECT   56   11                                                      
CONECT   57   12                                                      
CONECT   58   12                                                      
CONECT   59   13                                                      
CONECT   60   13                                                      
CONECT   61   14                                                      
CONECT   62   14                                                      
CONECT   63   15                                                      
CONECT   64   16                                                      
CONECT   65   17                                                      
CONECT   66   18                                                      
CONECT   67   19                                                      
CONECT   68   20                                                      
CONECT   69   20                                                      
CONECT   70   21                                                      
CONECT   71   21                                                      
CONECT   72   23                                                      
CONECT   73   25                                                      
CONECT   74   26                                                      
CONECT   75   26                                                      
CONECT   76   27                                                      
CONECT   77   28                                                      
CONECT   78   29                                                      
CONECT   79   30                                                      
CONECT   80   31                                                      
CONECT   81   32                                                      
CONECT   82   33                                                      
MASTER        0    0    0    0    0    0    0    0   82    0   82    0
END
