COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -6.537   0.344  -0.088  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.765  -0.518   0.915  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.352  -0.715   0.389  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.883  -1.926   0.322  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.507  -2.243  -0.186  1.00  0.00           C  
HETATM    6  C   UNL     1       7.694   1.860   0.307  1.00  0.00           C  
HETATM    7  C   UNL     1       7.859   0.364   0.222  1.00  0.00           C  
HETATM    8  C   UNL     1       9.184  -0.226  -0.188  1.00  0.00           C  
HETATM    9  C   UNL     1       6.852  -0.423   0.506  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.595  -1.031   0.034  1.00  0.00           C  
HETATM   11  C   UNL     1       5.496   0.166   0.801  1.00  0.00           C  
HETATM   12  C   UNL     1       4.463  -0.428  -0.160  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.254  -1.278  -0.631  1.00  0.00           C  
HETATM   14  C   UNL     1       0.590  -2.409  -0.032  1.00  0.00           C  
HETATM   15  C   UNL     1       3.086   0.170   0.139  1.00  0.00           C  
HETATM   16  C   UNL     1       3.105   1.669  -0.162  1.00  0.00           C  
HETATM   17  C   UNL     1       2.033  -0.513  -0.735  1.00  0.00           C  
HETATM   18  C   UNL     1       2.031  -2.041  -0.479  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.778   1.649  -0.329  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.425   1.347  -0.977  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.580   0.505  -0.017  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.310   1.339   1.237  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.237   0.182  -0.653  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.333   1.410  -0.598  1.00  0.00           C  
HETATM   25  C   UNL     1       0.067   1.112  -1.158  1.00  0.00           C  
HETATM   26  C   UNL     1       0.636  -0.038  -0.349  1.00  0.00           C  
HETATM   27  C   UNL     1       0.597   0.301   1.143  1.00  0.00           C  
HETATM   28  O   UNL     1      -7.834   0.637   0.437  1.00  0.00           O  
HETATM   29  H   UNL     1      -6.640  -0.197  -1.029  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.730  -0.016   1.881  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.255  -1.486   1.022  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.512  -2.741   0.648  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.108  -3.102   0.354  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.556  -2.473  -1.250  1.00  0.00           H  
HETATM   35  H   UNL     1       7.336   2.131   1.300  1.00  0.00           H  
HETATM   36  H   UNL     1       8.655   2.342   0.123  1.00  0.00           H  
HETATM   37  H   UNL     1       6.974   2.189  -0.442  1.00  0.00           H  
HETATM   38  H   UNL     1       9.798  -0.391   0.697  1.00  0.00           H  
HETATM   39  H   UNL     1       9.017  -1.175  -0.697  1.00  0.00           H  
HETATM   40  H   UNL     1       9.695   0.462  -0.862  1.00  0.00           H  
HETATM   41  H   UNL     1       6.992  -1.493   0.529  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.474  -0.840   1.100  1.00  0.00           H  
HETATM   43  H   UNL     1       5.214  -0.068   1.827  1.00  0.00           H  
HETATM   44  H   UNL     1       5.533   1.247   0.671  1.00  0.00           H  
HETATM   45  H   UNL     1       4.745  -0.194  -1.186  1.00  0.00           H  
HETATM   46  H   UNL     1       4.425  -1.509  -0.030  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.383  -1.416  -1.705  1.00  0.00           H  
HETATM   48  H   UNL     1       0.513  -2.413   1.055  1.00  0.00           H  
HETATM   49  H   UNL     1       0.292  -3.372  -0.445  1.00  0.00           H  
HETATM   50  H   UNL     1       2.843   0.013   1.190  1.00  0.00           H  
HETATM   51  H   UNL     1       3.386   1.827  -1.203  1.00  0.00           H  
HETATM   52  H   UNL     1       2.114   2.088   0.014  1.00  0.00           H  
HETATM   53  H   UNL     1       3.828   2.162   0.488  1.00  0.00           H  
HETATM   54  H   UNL     1       2.225  -0.306  -1.788  1.00  0.00           H  
HETATM   55  H   UNL     1       2.742  -2.289   0.309  1.00  0.00           H  
HETATM   56  H   UNL     1       2.286  -2.574  -1.395  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.361   2.291  -0.989  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.618   2.157   0.622  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.581   0.795  -1.904  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.908   2.282  -1.193  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.627   0.799   1.893  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.863   2.291   0.951  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.249   1.521   1.760  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.405  -0.065  -1.701  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.786   2.211  -1.182  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.238   1.735   0.438  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.006   0.827  -2.208  1.00  0.00           H  
HETATM   68  H   UNL     1       0.703   1.991  -1.055  1.00  0.00           H  
HETATM   69  H   UNL     1       1.008  -0.531   1.715  1.00  0.00           H  
HETATM   70  H   UNL     1       1.189   1.197   1.327  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.434   0.477   1.448  1.00  0.00           H  
HETATM   72  H   UNL     1      -8.373  -0.146   0.614  1.00  0.00           H  
CONECT    1    2   28   19   29                                       
CONECT    2    3    1   30   31                                       
CONECT    3    4    4    2   21                                       
CONECT    4    5    3    3   32                                       
CONECT    5    4   10   33   34                                       
CONECT    6    7   35   36   37                                       
CONECT    7    6    9    9    8                                       
CONECT    8    7   38   39   40                                       
CONECT    9    7    7   11   41                                       
CONECT   10    5   13   23   42                                       
CONECT   11    9   12   43   44                                       
CONECT   12   11   15   45   46                                       
CONECT   13   14   10   26   47                                       
CONECT   14   18   13   48   49                                       
CONECT   15   12   17   16   50                                       
CONECT   16   15   51   52   53                                       
CONECT   17   18   26   15   54                                       
CONECT   18   14   17   55   56                                       
CONECT   19    1   20   57   58                                       
CONECT   20   21   19   59   60                                       
CONECT   21    3   23   20   22                                       
CONECT   22   21   61   62   63                                       
CONECT   23   10   21   24   64                                       
CONECT   24   23   25   65   66                                       
CONECT   25   26   24   67   68                                       
CONECT   26   13   17   27   25                                       
CONECT   27   26   69   70   71                                       
CONECT   28    1   72                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   22                                                      
CONECT   62   22                                                      
CONECT   63   22                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   24                                                      
CONECT   67   25                                                      
CONECT   68   25                                                      
CONECT   69   27                                                      
CONECT   70   27                                                      
CONECT   71   27                                                      
CONECT   72   28                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
