COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.477  -1.513   1.606  1.00  0.00           C  
HETATM    2  C   UNL     1       6.986  -1.819   0.190  1.00  0.00           C  
HETATM    3  N   UNL     1       5.950  -0.854  -0.187  1.00  0.00           N  
HETATM    4  C   UNL     1       6.293   0.340  -0.818  1.00  0.00           C  
HETATM    5  C   UNL     1       6.016   1.569  -0.225  1.00  0.00           C  
HETATM    6  N   UNL     1       5.471   1.658   1.054  1.00  0.00           N  
HETATM    7  C   UNL     1       5.999   2.716   1.919  1.00  0.00           C  
HETATM    8  C   UNL     1       4.526   0.886   1.570  1.00  0.00           C  
HETATM    9  O   UNL     1       4.162   1.137   2.702  1.00  0.00           O  
HETATM   10  C   UNL     1       3.881  -0.245   0.896  1.00  0.00           C  
HETATM   11  C   UNL     1       2.512  -0.477   1.069  1.00  0.00           C  
HETATM   12  C   UNL     1       1.950  -1.586   0.462  1.00  0.00           C  
HETATM   13  C   UNL     1       2.750  -2.428  -0.289  1.00  0.00           C  
HETATM   14  N   UNL     1       4.034  -2.179  -0.459  1.00  0.00           N  
HETATM   15  C   UNL     1       4.616  -1.120   0.075  1.00  0.00           C  
HETATM   16  C   UNL     1       6.317   2.736  -0.919  1.00  0.00           C  
HETATM   17  C   UNL     1       6.919   2.631  -2.165  1.00  0.00           C  
HETATM   18  C   UNL     1       7.198   1.380  -2.676  1.00  0.00           C  
HETATM   19  N   UNL     1       6.885   0.289  -2.005  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.814   2.367  -1.453  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.292   2.004  -1.301  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.415   0.849  -0.468  1.00  0.00           O  
HETATM   23  P   UNL     1      -6.834   0.186  -0.092  1.00  0.00           P  
HETATM   24  C   UNL     1      -6.557  -1.344   0.859  1.00  0.00           C  
HETATM   25  O   UNL     1      -5.795  -2.263   0.072  1.00  0.00           O  
HETATM   26  C   UNL     1      -4.469  -2.003  -0.068  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.910  -0.890   0.544  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.562  -0.627   0.400  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.768  -1.474  -0.353  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.322  -2.584  -0.963  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.670  -2.853  -0.818  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.297  -1.186  -0.508  1.00  0.00           C  
HETATM   33  C   UNL     1       0.479  -1.874   0.617  1.00  0.00           C  
HETATM   34  O   UNL     1      -7.692   1.221   0.794  1.00  0.00           O  
HETATM   35  C   UNL     1      -8.162   2.473   0.291  1.00  0.00           C  
HETATM   36  C   UNL     1      -8.938   3.204   1.388  1.00  0.00           C  
HETATM   37  O   UNL     1      -7.574  -0.132  -1.334  1.00  0.00           O  
HETATM   38  H   UNL     1       7.890  -0.505   1.637  1.00  0.00           H  
HETATM   39  H   UNL     1       6.642  -1.585   2.303  1.00  0.00           H  
HETATM   40  H   UNL     1       8.248  -2.231   1.886  1.00  0.00           H  
HETATM   41  H   UNL     1       7.820  -1.747  -0.508  1.00  0.00           H  
HETATM   42  H   UNL     1       6.573  -2.827   0.158  1.00  0.00           H  
HETATM   43  H   UNL     1       5.410   3.624   1.783  1.00  0.00           H  
HETATM   44  H   UNL     1       5.939   2.398   2.960  1.00  0.00           H  
HETATM   45  H   UNL     1       7.038   2.914   1.658  1.00  0.00           H  
HETATM   46  H   UNL     1       1.908   0.193   1.664  1.00  0.00           H  
HETATM   47  H   UNL     1       2.316  -3.308  -0.742  1.00  0.00           H  
HETATM   48  H   UNL     1       6.087   3.703  -0.497  1.00  0.00           H  
HETATM   49  H   UNL     1       7.165   3.519  -2.729  1.00  0.00           H  
HETATM   50  H   UNL     1       7.681   1.294  -3.638  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.388   2.579  -0.472  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.280   1.532  -1.908  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.720   3.247  -2.088  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.826   2.838  -0.846  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.717   1.791  -2.281  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.011  -1.110   1.773  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.517  -1.793   1.113  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.530  -0.228   1.132  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.126   0.239   0.876  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.701  -3.243  -1.551  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.101  -3.722  -1.292  1.00  0.00           H  
HETATM   62  H   UNL     1       0.047  -1.563  -1.471  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.130  -0.110  -0.458  1.00  0.00           H  
HETATM   64  H   UNL     1       0.312  -2.950   0.568  1.00  0.00           H  
HETATM   65  H   UNL     1       0.134  -1.497   1.580  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.313   3.081  -0.021  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.817   2.298  -0.563  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.787   2.596   1.700  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.283   3.379   2.241  1.00  0.00           H  
HETATM   70  H   UNL     1      -9.297   4.159   1.004  1.00  0.00           H  
CONECT    1    2   38   39   40                                       
CONECT    2    1    3   41   42                                       
CONECT    3   15    2    4                                            
CONECT    4    3   19   19    5                                       
CONECT    5    4    6   16   16                                       
CONECT    6    8    5    7                                            
CONECT    7    6   43   44   45                                       
CONECT    8   10    9    9    6                                       
CONECT    9    8    8                                                 
CONECT   10   15   15   11    8                                       
CONECT   11   12   12   10   46                                       
CONECT   12   33   13   11   11                                       
CONECT   13   14   14   12   47                                       
CONECT   14   13   13   15                                            
CONECT   15   14    3   10   10                                       
CONECT   16    5    5   17   48                                       
CONECT   17   18   18   16   49                                       
CONECT   18   19   17   17   50                                       
CONECT   19    4    4   18                                            
CONECT   20   21   51   52   53                                       
CONECT   21   20   22   54   55                                       
CONECT   22   21   23                                                 
CONECT   23   22   34   24   37                                       
CONECT   23   37                                                      
CONECT   24   25   23   56   57                                       
CONECT   25   26   24                                                 
CONECT   26   27   25   31   31                                       
CONECT   27   28   28   26   58                                       
CONECT   28   27   27   29   59                                       
CONECT   29   28   32   30   30                                       
CONECT   30   29   29   31   60                                       
CONECT   31   26   26   30   61                                       
CONECT   32   33   29   62   63                                       
CONECT   33   32   12   64   65                                       
CONECT   34   35   23                                                 
CONECT   35   34   36   66   67                                       
CONECT   36   35   68   69   70                                       
CONECT   37   23   23                                                 
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    2                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   32                                                      
CONECT   63   32                                                      
CONECT   64   33                                                      
CONECT   65   33                                                      
CONECT   66   35                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   36                                                      
CONECT   70   36                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
