COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.156  -1.619  -2.751  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.118  -0.640  -1.712  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.391  -0.711  -0.900  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.364  -1.513  -1.255  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.522   0.161   0.328  1.00  0.00           C  
HETATM    6  O   UNL     1      -7.515   1.537  -0.057  1.00  0.00           O  
HETATM    7  C   UNL     1      -6.333  -0.120   1.256  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.929  -0.920  -0.784  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.060  -0.049   0.445  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.074   0.766   0.804  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.790   0.728   0.086  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.770   1.467   0.509  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.869   2.370   1.730  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.702   2.120   2.683  1.00  0.00           C  
HETATM   15  C   UNL     1       0.647   2.117   1.945  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.437   1.465  -0.178  1.00  0.00           C  
HETATM   17  C   UNL     1       0.591   1.030   0.897  1.00  0.00           C  
HETATM   18  C   UNL     1       0.116  -0.270   1.550  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.222   0.403  -1.258  1.00  0.00           C  
HETATM   20  C   UNL     1       1.326   0.262  -1.298  1.00  0.00           C  
HETATM   21  C   UNL     1       1.843   0.742   0.084  1.00  0.00           C  
HETATM   22  C   UNL     1       2.669  -0.360   0.752  1.00  0.00           C  
HETATM   23  C   UNL     1       3.201   0.146   2.095  1.00  0.00           C  
HETATM   24  C   UNL     1       3.843  -0.737  -0.153  1.00  0.00           C  
HETATM   25  C   UNL     1       4.591  -1.927   0.452  1.00  0.00           C  
HETATM   26  C   UNL     1       3.679  -3.155   0.457  1.00  0.00           C  
HETATM   27  C   UNL     1       4.385  -4.312   1.166  1.00  0.00           C  
HETATM   28  C   UNL     1       3.472  -5.540   1.172  1.00  0.00           C  
HETATM   29  C   UNL     1       4.794   0.454  -0.278  1.00  0.00           C  
HETATM   30  C   UNL     1       5.901   0.120  -1.280  1.00  0.00           C  
HETATM   31  C   UNL     1       6.853   1.311  -1.405  1.00  0.00           C  
HETATM   32  C   UNL     1       7.475   1.613  -0.040  1.00  0.00           C  
HETATM   33  C   UNL     1       7.960   0.977  -2.407  1.00  0.00           C  
HETATM   34  O   UNL     1       6.127   2.455  -1.860  1.00  0.00           O  
HETATM   35  H   UNL     1      -6.885  -1.501  -3.376  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.014   0.354  -2.149  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.270  -1.556  -0.668  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.260  -2.131  -2.134  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.453  -0.072   0.845  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.233   1.781  -0.657  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.304   0.628   2.049  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.436  -1.114   1.691  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.935  -1.970  -0.490  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.998  -0.687  -1.300  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.214   1.455   1.624  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.678   0.101  -0.786  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.853   3.412   1.408  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.806   2.170   2.250  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.690   2.902   3.443  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.842   1.156   3.171  1.00  0.00           H  
HETATM   51  H   UNL     1       0.809   3.084   1.467  1.00  0.00           H  
HETATM   52  H   UNL     1       1.454   1.913   2.649  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.200   2.458  -0.561  1.00  0.00           H  
HETATM   54  H   UNL     1       0.112  -1.068   0.808  1.00  0.00           H  
HETATM   55  H   UNL     1       0.790  -0.534   2.364  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.891  -0.133   1.942  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.689  -0.540  -0.971  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.603   0.747  -2.220  1.00  0.00           H  
HETATM   59  H   UNL     1       1.603  -0.778  -1.472  1.00  0.00           H  
HETATM   60  H   UNL     1       1.740   0.896  -2.082  1.00  0.00           H  
HETATM   61  H   UNL     1       2.439   1.648  -0.028  1.00  0.00           H  
HETATM   62  H   UNL     1       2.041  -1.235   0.917  1.00  0.00           H  
HETATM   63  H   UNL     1       3.748   1.076   1.941  1.00  0.00           H  
HETATM   64  H   UNL     1       2.367   0.322   2.773  1.00  0.00           H  
HETATM   65  H   UNL     1       3.869  -0.601   2.525  1.00  0.00           H  
HETATM   66  H   UNL     1       3.468  -1.008  -1.140  1.00  0.00           H  
HETATM   67  H   UNL     1       5.480  -2.137  -0.142  1.00  0.00           H  
HETATM   68  H   UNL     1       4.886  -1.689   1.474  1.00  0.00           H  
HETATM   69  H   UNL     1       2.753  -2.917   0.982  1.00  0.00           H  
HETATM   70  H   UNL     1       3.451  -3.442  -0.569  1.00  0.00           H  
HETATM   71  H   UNL     1       5.310  -4.549   0.642  1.00  0.00           H  
HETATM   72  H   UNL     1       4.613  -4.024   2.193  1.00  0.00           H  
HETATM   73  H   UNL     1       2.547  -5.303   1.696  1.00  0.00           H  
HETATM   74  H   UNL     1       3.244  -5.827   0.145  1.00  0.00           H  
HETATM   75  H   UNL     1       3.975  -6.365   1.677  1.00  0.00           H  
HETATM   76  H   UNL     1       4.241   1.326  -0.625  1.00  0.00           H  
HETATM   77  H   UNL     1       5.238   0.669   0.695  1.00  0.00           H  
HETATM   78  H   UNL     1       6.455  -0.752  -0.932  1.00  0.00           H  
HETATM   79  H   UNL     1       5.458  -0.095  -2.252  1.00  0.00           H  
HETATM   80  H   UNL     1       8.028   0.740   0.308  1.00  0.00           H  
HETATM   81  H   UNL     1       8.153   2.462  -0.129  1.00  0.00           H  
HETATM   82  H   UNL     1       6.686   1.851   0.674  1.00  0.00           H  
HETATM   83  H   UNL     1       7.517   0.763  -3.379  1.00  0.00           H  
HETATM   84  H   UNL     1       8.638   1.826  -2.496  1.00  0.00           H  
HETATM   85  H   UNL     1       8.513   0.105  -2.059  1.00  0.00           H  
HETATM   86  H   UNL     1       5.705   2.335  -2.722  1.00  0.00           H  
CONECT    1    2   35                                                 
CONECT    2    3    8    1   36                                       
CONECT    3    4    4    5    2                                       
CONECT    4    3    3   37   38                                       
CONECT    5    6    3    7   39                                       
CONECT    6    5   40                                                 
CONECT    7    5    9   41   42                                       
CONECT    8    2    9   43   44                                       
CONECT    9    7    8   10   10                                       
CONECT   10    9    9   11   45                                       
CONECT   11   10   12   12   46                                       
CONECT   12   11   11   13   16                                       
CONECT   13   12   14   47   48                                       
CONECT   14   13   15   49   50                                       
CONECT   15   14   17   51   52                                       
CONECT   16   12   17   19   53                                       
CONECT   17   18   16   15   21                                       
CONECT   18   17   54   55   56                                       
CONECT   19   16   20   57   58                                       
CONECT   20   19   21   59   60                                       
CONECT   21   17   22   20   61                                       
CONECT   22   23   21   24   62                                       
CONECT   23   22   63   64   65                                       
CONECT   24   22   25   29   66                                       
CONECT   25   26   24   67   68                                       
CONECT   26   27   25   69   70                                       
CONECT   27   28   26   71   72                                       
CONECT   28   27   73   74   75                                       
CONECT   29   24   30   76   77                                       
CONECT   30   29   31   78   79                                       
CONECT   31   30   32   33   34                                       
CONECT   32   31   80   81   82                                       
CONECT   33   31   83   84   85                                       
CONECT   34   31   86                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   23                                                      
CONECT   66   24                                                      
CONECT   67   25                                                      
CONECT   68   25                                                      
CONECT   69   26                                                      
CONECT   70   26                                                      
CONECT   71   27                                                      
CONECT   72   27                                                      
CONECT   73   28                                                      
CONECT   74   28                                                      
CONECT   75   28                                                      
CONECT   76   29                                                      
CONECT   77   29                                                      
CONECT   78   30                                                      
CONECT   79   30                                                      
CONECT   80   32                                                      
CONECT   81   32                                                      
CONECT   82   32                                                      
CONECT   83   33                                                      
CONECT   84   33                                                      
CONECT   85   33                                                      
CONECT   86   34                                                      
MASTER        0    0    0    0    0    0    0    0   86    0   86    0
END
