COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.887  -0.239   0.880  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.739   3.849  -0.035  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.712   2.500   0.296  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.245   1.582  -0.616  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.230   2.119   1.661  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.797   0.698   2.010  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.634  -1.359   0.948  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.800  -3.545  -1.989  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.186  -3.326  -1.850  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.678  -0.247  -0.122  1.00  0.00           C  
HETATM   11  C   UNL     1       1.988  -0.888   0.246  1.00  0.00           C  
HETATM   12  C   UNL     1       1.263  -1.489  -0.773  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.068  -1.167  -0.955  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.664   0.506   3.013  1.00  0.00           C  
HETATM   15  C   UNL     1       5.433  -1.027   1.543  1.00  0.00           C  
HETATM   16  C   UNL     1       6.836   1.266  -1.094  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.831   2.013  -1.873  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.783  -2.221  -0.243  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.654  -2.741  -0.878  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.062  -3.838  -2.474  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.054  -2.520  -0.738  1.00  0.00           C  
HETATM   22  C   UNL     1       0.043   0.353   0.895  1.00  0.00           C  
HETATM   23  C   UNL     1       1.374   0.034   1.080  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.865   3.349  -2.208  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.104   0.166   3.407  1.00  0.00           C  
HETATM   26  C   UNL     1       3.981  -0.547   1.496  1.00  0.00           C  
HETATM   27  C   UNL     1       6.240   0.858   0.255  1.00  0.00           C  
HETATM   28  C   UNL     1       8.216   0.623  -1.253  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.317   4.278  -1.282  1.00  0.00           C  
HETATM   30  C   UNL     1       8.079  -0.898  -1.133  1.00  0.00           C  
HETATM   31  C   UNL     1       7.447  -1.243   0.217  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.128   0.108  -0.326  1.00  0.00           C  
HETATM   33  N   UNL     1       6.128  -0.605   0.319  1.00  0.00           N  
HETATM   34  O   UNL     1      -4.185  -1.660   1.989  1.00  0.00           O  
HETATM   35  O   UNL     1      -2.347   5.599  -1.597  1.00  0.00           O  
HETATM   36  O   UNL     1       3.297  -1.204   0.427  1.00  0.00           O  
HETATM   37  H   UNL     1      -3.092   4.570   0.687  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.834   2.811   2.404  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.319   2.176   1.662  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.926  -3.944  -2.484  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.168  -3.558  -2.234  1.00  0.00           H  
HETATM   42  H   UNL     1       1.739  -2.208  -1.424  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.633  -1.634  -1.748  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.979  -0.324   2.845  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.221   1.402   3.449  1.00  0.00           H  
HETATM   46  H   UNL     1       5.931  -0.594   2.411  1.00  0.00           H  
HETATM   47  H   UNL     1       5.455  -2.114   1.617  1.00  0.00           H  
HETATM   48  H   UNL     1       6.182   0.928  -1.898  1.00  0.00           H  
HETATM   49  H   UNL     1       6.933   2.351  -1.137  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.479   1.291  -2.595  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.668  -2.514  -0.500  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.171  -4.468  -3.345  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.931  -2.121  -0.251  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.436   1.071   1.544  1.00  0.00           H  
HETATM   55  H   UNL     1       1.936   0.503   1.874  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.541   3.671  -3.186  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.608   0.837   4.102  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.365  -0.888   3.498  1.00  0.00           H  
HETATM   59  H   UNL     1       3.490  -0.782   2.440  1.00  0.00           H  
HETATM   60  H   UNL     1       3.960   0.530   1.333  1.00  0.00           H  
HETATM   61  H   UNL     1       6.887   1.208   1.059  1.00  0.00           H  
HETATM   62  H   UNL     1       5.251   1.302   0.365  1.00  0.00           H  
HETATM   63  H   UNL     1       8.626   0.876  -2.231  1.00  0.00           H  
HETATM   64  H   UNL     1       8.882   0.992  -0.473  1.00  0.00           H  
HETATM   65  H   UNL     1       7.445  -1.270  -1.938  1.00  0.00           H  
HETATM   66  H   UNL     1       9.064  -1.359  -1.204  1.00  0.00           H  
HETATM   67  H   UNL     1       7.335  -2.325   0.299  1.00  0.00           H  
HETATM   68  H   UNL     1       8.089  -0.883   1.021  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.519  -0.458  -1.172  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.534   6.074  -1.379  1.00  0.00           H  
CONECT    1    7    6   32                                            
CONECT    2    3    3   29   37                                       
CONECT    3    5    2    2    4                                       
CONECT    4    3   32   17   17                                       
CONECT    5    6    3   38   39                                       
CONECT    6   25    1    5   14                                       
CONECT    7   18   34   34    1                                       
CONECT    8   20   20   19   40                                       
CONECT    9   20   21   21   41                                       
CONECT   10   32   22   22   13                                       
CONECT   11   23   23   12   36                                       
CONECT   12   13   13   11   42                                       
CONECT   13   10   12   12   43                                       
CONECT   14   25    6   44   45                                       
CONECT   15   26   33   46   47                                       
CONECT   16   27   28   48   49                                       
CONECT   17    4    4   24   50                                       
CONECT   18   19   19   21    7                                       
CONECT   19    8   18   18   51                                       
CONECT   20    8    8    9   52                                       
CONECT   21    9    9   18   53                                       
CONECT   22   10   10   23   54                                       
CONECT   23   22   11   11   55                                       
CONECT   24   29   29   17   56                                       
CONECT   25    6   14   57   58                                       
CONECT   26   36   15   59   60                                       
CONECT   27   33   16   61   62                                       
CONECT   28   30   16   63   64                                       
CONECT   29    2   35   24   24                                       
CONECT   30   31   28   65   66                                       
CONECT   31   33   30   67   68                                       
CONECT   32    1    4   10   69                                       
CONECT   33   15   31   27                                            
CONECT   34    7    7                                                 
CONECT   35   29   70                                                 
CONECT   36   11   26                                                 
CONECT   37    2                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   32                                                      
CONECT   70   35                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
