COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.771   0.382   2.923  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.538  -0.480   2.648  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.181  -0.400   1.258  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.338   0.046   3.459  1.00  0.00           C  
HETATM    5  O   UNL     1      -2.856  -0.957   4.355  1.00  0.00           O  
HETATM    6  C   UNL     1      -2.270   0.373   2.388  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.937  -0.040   2.834  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.741  -0.483   1.185  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.255   0.079  -0.076  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.857   1.060  -0.807  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.153   1.317  -1.871  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.059   0.519  -1.891  1.00  0.00           C  
HETATM   13  C   UNL     1       0.027   0.353  -2.767  1.00  0.00           C  
HETATM   14  N   UNL     1       0.132   1.117  -3.916  1.00  0.00           N  
HETATM   15  N   UNL     1       0.951  -0.552  -2.465  1.00  0.00           N  
HETATM   16  C   UNL     1       0.859  -1.285  -1.371  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.139  -1.164  -0.522  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.108  -0.280  -0.737  1.00  0.00           C  
HETATM   19  C   UNL     1       1.272   0.930  -4.817  1.00  0.00           C  
HETATM   20  C   UNL     1       0.932  -0.125  -5.836  1.00  0.00           C  
HETATM   21  C   UNL     1       0.269  -1.262  -5.391  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.064  -2.269  -6.272  1.00  0.00           C  
HETATM   23  C   UNL     1       0.266  -2.149  -7.609  1.00  0.00           C  
HETATM   24  C   UNL     1       1.592   2.256  -5.506  1.00  0.00           C  
HETATM   25  C   UNL     1       1.259  -0.004  -7.167  1.00  0.00           C  
HETATM   26  C   UNL     1       0.925  -1.021  -8.053  1.00  0.00           C  
HETATM   27  C   UNL     1       2.637   1.994  -6.597  1.00  0.00           C  
HETATM   28  C   UNL     1       1.972   1.201  -7.720  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.126   0.845   3.446  1.00  0.00           C  
HETATM   30  O   UNL     1      -0.501   1.987   3.628  1.00  0.00           O  
HETATM   31  C   UNL     1       1.218   0.427   3.897  1.00  0.00           C  
HETATM   32  C   UNL     1       1.651  -0.881   3.684  1.00  0.00           C  
HETATM   33  C   UNL     1       2.910  -1.270   4.112  1.00  0.00           C  
HETATM   34  O   UNL     1       3.332  -2.546   3.910  1.00  0.00           O  
HETATM   35  C   UNL     1       4.652  -2.635   4.448  1.00  0.00           C  
HETATM   36  C   UNL     1       3.743  -0.357   4.743  1.00  0.00           C  
HETATM   37  C   UNL     1       2.059   1.342   4.531  1.00  0.00           C  
HETATM   38  C   UNL     1       3.318   0.946   4.952  1.00  0.00           C  
HETATM   39  O   UNL     1       4.138   1.836   5.569  1.00  0.00           O  
HETATM   40  C   UNL     1       5.347   1.139   5.878  1.00  0.00           C  
HETATM   41  O   UNL     1      -6.877  -0.113   2.167  1.00  0.00           O  
HETATM   42  H   UNL     1      -6.011   0.345   3.986  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.565   1.413   2.633  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.742  -1.515   2.920  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.615   0.946   4.009  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.561  -1.119   4.997  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.282   1.434   2.138  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.639  -0.951   2.689  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.410  -1.515   1.297  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.781   1.552  -0.542  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.548   1.775  -4.125  1.00  0.00           H  
HETATM   52  H   UNL     1       1.632  -2.010  -1.164  1.00  0.00           H  
HETATM   53  H   UNL     1       2.138   0.608  -4.240  1.00  0.00           H  
HETATM   54  H   UNL     1       0.011  -1.358  -4.346  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.582  -3.149  -5.919  1.00  0.00           H  
HETATM   56  H   UNL     1       0.009  -2.935  -8.304  1.00  0.00           H  
HETATM   57  H   UNL     1       0.686   2.664  -5.955  1.00  0.00           H  
HETATM   58  H   UNL     1       1.991   2.961  -4.777  1.00  0.00           H  
HETATM   59  H   UNL     1       1.182  -0.927  -9.097  1.00  0.00           H  
HETATM   60  H   UNL     1       3.007   2.942  -6.986  1.00  0.00           H  
HETATM   61  H   UNL     1       3.465   1.419  -6.182  1.00  0.00           H  
HETATM   62  H   UNL     1       1.253   1.839  -8.234  1.00  0.00           H  
HETATM   63  H   UNL     1       2.733   0.874  -8.429  1.00  0.00           H  
HETATM   64  H   UNL     1       1.003  -1.593   3.194  1.00  0.00           H  
HETATM   65  H   UNL     1       5.034  -3.646   4.307  1.00  0.00           H  
HETATM   66  H   UNL     1       5.302  -1.927   3.934  1.00  0.00           H  
HETATM   67  H   UNL     1       4.628  -2.400   5.512  1.00  0.00           H  
HETATM   68  H   UNL     1       4.725  -0.662   5.072  1.00  0.00           H  
HETATM   69  H   UNL     1       1.728   2.357   4.694  1.00  0.00           H  
HETATM   70  H   UNL     1       6.039   1.817   6.377  1.00  0.00           H  
HETATM   71  H   UNL     1       5.124   0.298   6.534  1.00  0.00           H  
HETATM   72  H   UNL     1       5.799   0.771   4.957  1.00  0.00           H  
HETATM   73  H   UNL     1      -7.632   0.457   2.369  1.00  0.00           H  
CONECT    1    2   41   42   43                                       
CONECT    2    1    3    4   44                                       
CONECT    3    2    8                                                 
CONECT    4    2    5    6   45                                       
CONECT    5    4   46                                                 
CONECT    6    4    7    8   47                                       
CONECT    7    6   29   48                                            
CONECT    8    3    6    9   49                                       
CONECT    9    8   10   18                                            
CONECT   10    9   11   11   50                                       
CONECT   11   10   10   12                                            
CONECT   12   11   13   13   18                                       
CONECT   13   12   12   14   15                                       
CONECT   14   13   19   51                                            
CONECT   15   13   16   16                                            
CONECT   16   15   15   17   52                                       
CONECT   17   16   18   18                                            
CONECT   18    9   12   17   17                                       
CONECT   19   14   20   24   53                                       
CONECT   20   19   21   25   25                                       
CONECT   21   20   22   22   54                                       
CONECT   22   21   21   23   55                                       
CONECT   23   22   26   26   56                                       
CONECT   24   19   27   57   58                                       
CONECT   25   20   20   26   28                                       
CONECT   26   23   23   25   59                                       
CONECT   27   24   28   60   61                                       
CONECT   28   25   27   62   63                                       
CONECT   29    7   30   30   31                                       
CONECT   30   29   29                                                 
CONECT   31   29   32   32   37                                       
CONECT   32   31   31   33   64                                       
CONECT   33   32   34   36   36                                       
CONECT   34   33   35                                                 
CONECT   35   34   65   66   67                                       
CONECT   36   33   33   38   68                                       
CONECT   37   31   38   38   69                                       
CONECT   38   36   37   37   39                                       
CONECT   39   38   40                                                 
CONECT   40   39   70   71   72                                       
CONECT   41    1   73                                                 
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    2                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50   10                                                      
CONECT   51   14                                                      
CONECT   52   16                                                      
CONECT   53   19                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   24                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   32                                                      
CONECT   65   35                                                      
CONECT   66   35                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
CONECT   70   40                                                      
CONECT   71   40                                                      
CONECT   72   40                                                      
CONECT   73   41                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
