COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.148   4.916  -0.653  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.355   3.464  -0.080  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.150   2.411  -0.507  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.676   1.117  -0.449  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.392   0.865   0.042  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.592   1.926   0.472  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.072   3.221   0.405  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.995   3.932   1.320  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.884  -0.518   0.106  1.00  0.00           C  
HETATM   10  C   UNL     1       0.255  -2.297   0.613  1.00  0.00           C  
HETATM   11  C   UNL     1       0.897  -1.597   1.812  1.00  0.00           C  
HETATM   12  C   UNL     1       2.405  -1.870   1.810  1.00  0.00           C  
HETATM   13  O   UNL     1      -4.826   4.737  -0.140  1.00  0.00           O  
HETATM   14  O   UNL     1      -2.295   4.256   0.823  1.00  0.00           O  
HETATM   15  N   UNL     1      -1.695  -0.760   0.565  1.00  0.00           N  
HETATM   16  N   UNL     1      -1.192  -2.065   0.630  1.00  0.00           N  
HETATM   17  N   UNL     1       2.957  -1.468   0.510  1.00  0.00           N  
HETATM   18  C   UNL     1       2.352  -2.014  -0.714  1.00  0.00           C  
HETATM   19  C   UNL     1       0.845  -1.739  -0.684  1.00  0.00           C  
HETATM   20  C   UNL     1       3.998  -0.615   0.439  1.00  0.00           C  
HETATM   21  O   UNL     1       4.488  -0.172   1.456  1.00  0.00           O  
HETATM   22  C   UNL     1       4.553  -0.213  -0.902  1.00  0.00           C  
HETATM   23  N   UNL     1       5.671   0.714  -0.710  1.00  0.00           N  
HETATM   24  C   UNL     1       6.939   0.303  -0.580  1.00  0.00           C  
HETATM   25  O   UNL     1       7.309  -0.851  -0.605  1.00  0.00           O  
HETATM   26  C   UNL     1       7.836   1.508  -0.398  1.00  0.00           C  
HETATM   27  C   UNL     1       6.857   2.699  -0.446  1.00  0.00           C  
HETATM   28  C   UNL     1       5.510   2.042  -0.655  1.00  0.00           C  
HETATM   29  O   UNL     1       4.452   2.626  -0.752  1.00  0.00           O  
HETATM   30  C   UNL     1      -2.047  -3.112   0.707  1.00  0.00           C  
HETATM   31  O   UNL     1      -1.636  -4.246   0.835  1.00  0.00           O  
HETATM   32  C   UNL     1      -3.523  -2.827   0.631  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.319  -4.052   0.220  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.174  -4.331  -1.246  1.00  0.00           C  
HETATM   35  C   UNL     1      -3.706  -3.475  -2.096  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.226  -2.104  -1.737  1.00  0.00           C  
HETATM   37  C   UNL     1      -3.747  -1.676  -0.360  1.00  0.00           C  
HETATM   38  H   UNL     1      -6.857   4.370  -0.031  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.400   5.977  -0.646  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.195   4.538  -1.674  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.142   2.604  -0.887  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.297   0.299  -0.782  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.599   1.735   0.853  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.482   4.847   1.618  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.089   3.271   2.181  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.421   3.433   0.539  1.00  0.00           H  
HETATM   47  H   UNL     1       0.451  -3.368   0.670  1.00  0.00           H  
HETATM   48  H   UNL     1       0.722  -0.523   1.743  1.00  0.00           H  
HETATM   49  H   UNL     1       0.459  -1.978   2.734  1.00  0.00           H  
HETATM   50  H   UNL     1       2.881  -1.294   2.603  1.00  0.00           H  
HETATM   51  H   UNL     1       2.583  -2.934   1.970  1.00  0.00           H  
HETATM   52  H   UNL     1       2.794  -1.532  -1.586  1.00  0.00           H  
HETATM   53  H   UNL     1       2.526  -3.089  -0.759  1.00  0.00           H  
HETATM   54  H   UNL     1       0.370  -2.221  -1.538  1.00  0.00           H  
HETATM   55  H   UNL     1       0.671  -0.664  -0.729  1.00  0.00           H  
HETATM   56  H   UNL     1       4.903  -1.099  -1.432  1.00  0.00           H  
HETATM   57  H   UNL     1       3.773   0.275  -1.487  1.00  0.00           H  
HETATM   58  H   UNL     1       8.343   1.466   0.566  1.00  0.00           H  
HETATM   59  H   UNL     1       8.561   1.572  -1.209  1.00  0.00           H  
HETATM   60  H   UNL     1       6.877   3.250   0.495  1.00  0.00           H  
HETATM   61  H   UNL     1       7.095   3.358  -1.280  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.870  -2.514   1.615  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.963  -4.915   0.783  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.372  -3.887   0.449  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.477  -5.300  -1.613  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.658  -3.770  -3.134  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.136  -2.100  -1.723  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.576  -1.395  -2.487  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.799  -1.393  -0.392  1.00  0.00           H  
CONECT    1   13   38   39   40                                       
CONECT    2    7    7    3   13                                       
CONECT    3    4    4    2   41                                       
CONECT    4    5    3    3   42                                       
CONECT    5    9    6    6    4                                       
CONECT    6    5    5    7   43                                       
CONECT    7    6   14    2    2                                       
CONECT    8   14   44   45   46                                       
CONECT    9   15   15   37    5                                       
CONECT   10   11   19   16   47                                       
CONECT   11   12   10   48   49                                       
CONECT   12   17   11   50   51                                       
CONECT   13    2    1                                                 
CONECT   14    8    7                                                 
CONECT   15   16    9    9                                            
CONECT   16   10   30   15                                            
CONECT   17   12   20   18                                            
CONECT   18   17   19   52   53                                       
CONECT   19   18   10   54   55                                       
CONECT   20   21   21   17   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   56   57                                       
CONECT   23   28   22   24                                            
CONECT   24   23   26   25   25                                       
CONECT   25   24   24                                                 
CONECT   26   27   24   58   59                                       
CONECT   27   28   26   60   61                                       
CONECT   28   29   29   27   23                                       
CONECT   29   28   28                                                 
CONECT   30   31   31   16   32                                       
CONECT   31   30   30                                                 
CONECT   32   30   33   37   62                                       
CONECT   33   32   34   63   64                                       
CONECT   34   33   35   35   65                                       
CONECT   35   34   34   36   66                                       
CONECT   36   37   35   67   68                                       
CONECT   37   32    9   36   69                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    6                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   35                                                      
CONECT   67   36                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
