COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.287   0.181  -0.079  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.657   3.065   0.201  1.00  0.00           C  
HETATM    3  O   UNL     1       0.261   3.206   1.535  1.00  0.00           O  
HETATM    4  C   UNL     1      -0.209   2.745   0.523  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.260   3.517  -0.230  1.00  0.00           C  
HETATM    6  O   UNL     1      -1.090   3.310  -1.634  1.00  0.00           O  
HETATM    7  C   UNL     1      -2.567   2.251   1.491  1.00  0.00           C  
HETATM    8  O   UNL     1       0.198   1.547   0.077  1.00  0.00           O  
HETATM    9  C   UNL     1       0.875   0.687   1.026  1.00  0.00           C  
HETATM   10  C   UNL     1       2.172   0.120   0.457  1.00  0.00           C  
HETATM   11  C   UNL     1       2.330   0.513  -1.013  1.00  0.00           C  
HETATM   12  C   UNL     1       2.626   1.986  -1.122  1.00  0.00           C  
HETATM   13  C   UNL     1       3.063   2.705  -0.143  1.00  0.00           C  
HETATM   14  C   UNL     1       3.319   4.166  -0.406  1.00  0.00           C  
HETATM   15  C   UNL     1       3.339   2.188   1.233  1.00  0.00           C  
HETATM   16  C   UNL     1       3.365   0.659   1.243  1.00  0.00           C  
HETATM   17  O   UNL     1       3.381  -0.210  -1.651  1.00  0.00           O  
HETATM   18  C   UNL     1       3.363  -1.635  -1.504  1.00  0.00           C  
HETATM   19  C   UNL     1       1.926  -2.132  -1.803  1.00  0.00           C  
HETATM   20  C   UNL     1       2.147  -1.424   0.552  1.00  0.00           C  
HETATM   21  C   UNL     1       1.849  -1.952   1.957  1.00  0.00           C  
HETATM   22  C   UNL     1       3.495  -1.926   0.004  1.00  0.00           C  
HETATM   23  O   UNL     1       4.118  -3.098   0.495  1.00  0.00           O  
HETATM   24  C   UNL     1       4.800  -1.867   0.758  1.00  0.00           C  
HETATM   25  C   UNL     1       1.123  -1.895  -0.515  1.00  0.00           C  
HETATM   26  O   UNL     1       0.421  -3.092  -0.092  1.00  0.00           O  
HETATM   27  C   UNL     1      -0.914  -3.057  -0.279  1.00  0.00           C  
HETATM   28  O   UNL     1      -1.363  -2.137  -0.936  1.00  0.00           O  
HETATM   29  C   UNL     1      -1.827  -4.087   0.206  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.134  -3.800   0.423  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.618  -2.437   0.262  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.932  -2.123   0.262  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.290  -0.703   0.067  1.00  0.00           C  
HETATM   34  O   UNL     1      -6.451  -0.359   0.037  1.00  0.00           O  
HETATM   35  C   UNL     1      -4.583   1.559  -0.405  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.306   2.240  -0.906  1.00  0.00           C  
HETATM   37  H   UNL     1      -3.269   3.956   0.388  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.142   4.580  -0.005  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.230   3.594  -1.972  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.967   1.358   1.316  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.102   2.855   2.270  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.569   1.959   1.807  1.00  0.00           H  
HETATM   43  H   UNL     1       1.096   1.239   1.939  1.00  0.00           H  
HETATM   44  H   UNL     1       0.195  -0.131   1.275  1.00  0.00           H  
HETATM   45  H   UNL     1       1.393   0.321  -1.543  1.00  0.00           H  
HETATM   46  H   UNL     1       2.465   2.467  -2.076  1.00  0.00           H  
HETATM   47  H   UNL     1       3.080   4.396  -1.444  1.00  0.00           H  
HETATM   48  H   UNL     1       2.694   4.768   0.253  1.00  0.00           H  
HETATM   49  H   UNL     1       4.369   4.390  -0.216  1.00  0.00           H  
HETATM   50  H   UNL     1       4.313   2.558   1.563  1.00  0.00           H  
HETATM   51  H   UNL     1       2.572   2.543   1.915  1.00  0.00           H  
HETATM   52  H   UNL     1       3.327   0.312   2.274  1.00  0.00           H  
HETATM   53  H   UNL     1       4.292   0.321   0.778  1.00  0.00           H  
HETATM   54  H   UNL     1       4.122  -2.147  -2.100  1.00  0.00           H  
HETATM   55  H   UNL     1       1.496  -1.564  -2.628  1.00  0.00           H  
HETATM   56  H   UNL     1       1.940  -3.194  -2.048  1.00  0.00           H  
HETATM   57  H   UNL     1       0.872  -1.592   2.280  1.00  0.00           H  
HETATM   58  H   UNL     1       1.848  -3.042   1.943  1.00  0.00           H  
HETATM   59  H   UNL     1       2.614  -1.598   2.648  1.00  0.00           H  
HETATM   60  H   UNL     1       5.711  -1.659   0.193  1.00  0.00           H  
HETATM   61  H   UNL     1       4.795  -1.497   1.784  1.00  0.00           H  
HETATM   62  H   UNL     1       0.389  -1.096  -0.686  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.467  -5.088   0.396  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.809  -4.593   0.716  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.914  -1.616   0.163  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.690  -2.866   0.402  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.333   1.580  -1.204  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.985   2.080   0.460  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.565   2.893  -1.741  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.610   1.474  -1.253  1.00  0.00           H  
CONECT    1   33   35                                                 
CONECT    2    5   36    7   37                                       
CONECT    3    4    4                                                 
CONECT    4    8    3    3    5                                       
CONECT    5    4    6    2   38                                       
CONECT    6    5   39                                                 
CONECT    7    2   40   41   42                                       
CONECT    8    9    4                                                 
CONECT    9   10    8   43   44                                       
CONECT   10   16   11   20    9                                       
CONECT   11   17   12   10   45                                       
CONECT   12   13   13   11   46                                       
CONECT   13   14   12   12   15                                       
CONECT   14   13   47   48   49                                       
CONECT   15   13   16   50   51                                       
CONECT   16   15   10   52   53                                       
CONECT   17   18   11                                                 
CONECT   18   17   22   19   54                                       
CONECT   19   18   25   55   56                                       
CONECT   20   22   10   21   25                                       
CONECT   21   20   57   58   59                                       
CONECT   22   24   23   18   20                                       
CONECT   23   24   22                                                 
CONECT   24   23   22   60   61                                       
CONECT   25   19   20   26   62                                       
CONECT   26   25   27                                                 
CONECT   27   26   29   28   28                                       
CONECT   28   27   27                                                 
CONECT   29   27   30   30   63                                       
CONECT   30   29   29   31   64                                       
CONECT   31   30   32   32   65                                       
CONECT   32   31   31   33   66                                       
CONECT   33   32    1   34   34                                       
CONECT   34   33   33                                                 
CONECT   35   36    1   67   68                                       
CONECT   36    2   35   69   70                                       
CONECT   37    2                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   32                                                      
CONECT   67   35                                                      
CONECT   68   35                                                      
CONECT   69   36                                                      
CONECT   70   36                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
