COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.057   2.056   1.949  1.00  0.00           C  
HETATM    2  C   UNL     1       1.682   1.508   1.665  1.00  0.00           C  
HETATM    3  C   UNL     1       0.727   2.316   1.083  1.00  0.00           C  
HETATM    4  O   UNL     1       1.559  -7.344  -0.988  1.00  0.00           O  
HETATM    5  C   UNL     1       8.555   2.471  -1.116  1.00  0.00           C  
HETATM    6  C   UNL     1       5.355   2.379   1.023  1.00  0.00           C  
HETATM    7  C   UNL     1       3.959   1.824   0.735  1.00  0.00           C  
HETATM    8  C   UNL     1       6.257   2.147  -0.190  1.00  0.00           C  
HETATM    9  C   UNL     1       7.653   2.703   0.098  1.00  0.00           C  
HETATM   10  O   UNL     1      -6.709   1.325   1.424  1.00  0.00           O  
HETATM   11  C   UNL     1       9.981   2.913  -0.783  1.00  0.00           C  
HETATM   12  C   UNL     1       8.553   0.984  -1.476  1.00  0.00           C  
HETATM   13  O   UNL     1       8.067   3.230  -2.224  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.549   1.806   0.820  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.845   0.479   1.150  1.00  0.00           C  
HETATM   16  C   UNL     1       0.120  -0.315   1.732  1.00  0.00           C  
HETATM   17  C   UNL     1       1.382   0.195   1.983  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.197  -1.745   2.088  1.00  0.00           C  
HETATM   19  C   UNL     1       0.134  -2.652   0.902  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.188  -4.103   1.264  1.00  0.00           C  
HETATM   21  C   UNL     1       0.142  -5.011   0.078  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.180  -6.462   0.440  1.00  0.00           C  
HETATM   23  C   UNL     1       0.151  -7.369  -0.747  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.589  -6.872  -1.991  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.286  -8.801  -0.431  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.573   2.660   0.200  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.804   2.164  -0.052  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.789   2.986  -0.648  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.022   2.489  -0.901  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.105   3.336  -1.538  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.400   3.142  -0.743  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.778   1.660  -0.723  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.733   0.869   0.070  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.376   1.093  -0.575  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.543   0.083  -0.831  1.00  0.00           C  
HETATM   36  O   UNL     1      -8.451   3.892  -1.357  1.00  0.00           O  
HETATM   37  H   UNL     1       2.988   3.125   2.151  1.00  0.00           H  
HETATM   38  H   UNL     1       3.478   1.548   2.817  1.00  0.00           H  
HETATM   39  H   UNL     1       0.963   3.339   0.831  1.00  0.00           H  
HETATM   40  H   UNL     1       1.842  -7.898  -1.728  1.00  0.00           H  
HETATM   41  H   UNL     1       5.286   3.448   1.226  1.00  0.00           H  
HETATM   42  H   UNL     1       5.776   1.872   1.891  1.00  0.00           H  
HETATM   43  H   UNL     1       4.028   0.755   0.533  1.00  0.00           H  
HETATM   44  H   UNL     1       3.538   2.331  -0.133  1.00  0.00           H  
HETATM   45  H   UNL     1       6.326   1.079  -0.393  1.00  0.00           H  
HETATM   46  H   UNL     1       5.836   2.655  -1.058  1.00  0.00           H  
HETATM   47  H   UNL     1       8.074   2.195   0.966  1.00  0.00           H  
HETATM   48  H   UNL     1       7.584   3.772   0.300  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.068   0.865   1.983  1.00  0.00           H  
HETATM   50  H   UNL     1       9.983   3.972  -0.526  1.00  0.00           H  
HETATM   51  H   UNL     1      10.354   2.334   0.062  1.00  0.00           H  
HETATM   52  H   UNL     1      10.624   2.748  -1.648  1.00  0.00           H  
HETATM   53  H   UNL     1       9.195   0.819  -2.341  1.00  0.00           H  
HETATM   54  H   UNL     1       8.925   0.405  -0.631  1.00  0.00           H  
HETATM   55  H   UNL     1       7.536   0.669  -1.713  1.00  0.00           H  
HETATM   56  H   UNL     1       8.592   3.131  -3.030  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.828   0.078   0.951  1.00  0.00           H  
HETATM   58  H   UNL     1       2.136  -0.433   2.434  1.00  0.00           H  
HETATM   59  H   UNL     1       0.397  -2.044   2.952  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.257  -1.832   2.329  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.460  -2.352   0.038  1.00  0.00           H  
HETATM   62  H   UNL     1       1.194  -2.564   0.661  1.00  0.00           H  
HETATM   63  H   UNL     1       0.406  -4.403   2.127  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.248  -4.191   1.504  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.452  -4.711  -0.786  1.00  0.00           H  
HETATM   66  H   UNL     1       1.202  -4.923  -0.163  1.00  0.00           H  
HETATM   67  H   UNL     1       0.415  -6.761   1.303  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.239  -6.550   0.680  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.277  -5.852  -2.215  1.00  0.00           H  
HETATM   70  H   UNL     1      -0.353  -7.519  -2.836  1.00  0.00           H  
HETATM   71  H   UNL     1      -1.663  -6.892  -1.807  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.360  -8.821  -0.247  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.051  -9.448  -1.277  1.00  0.00           H  
HETATM   74  H   UNL     1       0.241  -9.155   0.455  1.00  0.00           H  
HETATM   75  H   UNL     1      -1.342   3.684  -0.053  1.00  0.00           H  
HETATM   76  H   UNL     1      -3.036   1.140   0.201  1.00  0.00           H  
HETATM   77  H   UNL     1      -3.557   4.010  -0.901  1.00  0.00           H  
HETATM   78  H   UNL     1      -5.812   4.386  -1.512  1.00  0.00           H  
HETATM   79  H   UNL     1      -6.257   3.023  -2.571  1.00  0.00           H  
HETATM   80  H   UNL     1      -7.255   3.492   0.279  1.00  0.00           H  
HETATM   81  H   UNL     1      -8.755   1.542  -0.254  1.00  0.00           H  
HETATM   82  H   UNL     1      -7.820   1.283  -1.745  1.00  0.00           H  
HETATM   83  H   UNL     1      -6.979  -0.192   0.044  1.00  0.00           H  
HETATM   84  H   UNL     1      -3.584   0.276  -1.288  1.00  0.00           H  
HETATM   85  H   UNL     1      -4.828  -0.929  -0.582  1.00  0.00           H  
HETATM   86  H   UNL     1      -8.282   4.843  -1.400  1.00  0.00           H  
CONECT    1    7    2   37   38                                       
CONECT    2    1    3   17   17                                       
CONECT    3   14   14    2   39                                       
CONECT    4   23   40                                                 
CONECT    5   12   11   13    9                                       
CONECT    6    8    7   41   42                                       
CONECT    7    6    1   43   44                                       
CONECT    8    9    6   45   46                                       
CONECT    9    5    8   47   48                                       
CONECT   10   33   49                                                 
CONECT   11    5   50   51   52                                       
CONECT   12    5   53   54   55                                       
CONECT   13    5   56                                                 
CONECT   14   26    3    3   15                                       
CONECT   15   14   16   16   57                                       
CONECT   16   15   15   17   18                                       
CONECT   17    2    2   16   58                                       
CONECT   18   19   16   59   60                                       
CONECT   19   20   18   61   62                                       
CONECT   20   21   19   63   64                                       
CONECT   21   20   22   65   66                                       
CONECT   22   21   23   67   68                                       
CONECT   23   25   22   24    4                                       
CONECT   24   23   69   70   71                                       
CONECT   25   23   72   73   74                                       
CONECT   26   27   27   14   75                                       
CONECT   27   28   26   26   76                                       
CONECT   28   29   29   27   77                                       
CONECT   29   30   34   28   28                                       
CONECT   30   29   31   78   79                                       
CONECT   31   30   32   36   80                                       
CONECT   32   31   33   81   82                                       
CONECT   33   34   32   10   83                                       
CONECT   34   35   35   29   33                                       
CONECT   35   34   34   84   85                                       
CONECT   36   31   86                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   12                                                      
CONECT   56   13                                                      
CONECT   57   15                                                      
CONECT   58   17                                                      
CONECT   59   18                                                      
CONECT   60   18                                                      
CONECT   61   19                                                      
CONECT   62   19                                                      
CONECT   63   20                                                      
CONECT   64   20                                                      
CONECT   65   21                                                      
CONECT   66   21                                                      
CONECT   67   22                                                      
CONECT   68   22                                                      
CONECT   69   24                                                      
CONECT   70   24                                                      
CONECT   71   24                                                      
CONECT   72   25                                                      
CONECT   73   25                                                      
CONECT   74   25                                                      
CONECT   75   26                                                      
CONECT   76   27                                                      
CONECT   77   28                                                      
CONECT   78   30                                                      
CONECT   79   30                                                      
CONECT   80   31                                                      
CONECT   81   32                                                      
CONECT   82   32                                                      
CONECT   83   33                                                      
CONECT   84   35                                                      
CONECT   85   35                                                      
CONECT   86   36                                                      
MASTER        0    0    0    0    0    0    0    0   86    0   86    0
END
