COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.671   5.537   0.372  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.670   4.551   0.978  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.307   3.189   1.083  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.047   2.783   2.079  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.453   1.524   1.855  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.277   0.567   2.590  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.491  -0.652   2.059  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.955  -1.006   0.856  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.190  -0.161   0.140  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.730  -0.518  -0.932  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.918   1.130   0.623  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.201   2.212   0.157  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.460   2.286  -1.104  1.00  0.00           C  
HETATM   14  C   UNL     1       0.071   3.717  -1.330  1.00  0.00           C  
HETATM   15  C   UNL     1       1.482   3.649  -0.710  1.00  0.00           C  
HETATM   16  C   UNL     1       1.891   2.195  -0.813  1.00  0.00           C  
HETATM   17  C   UNL     1       0.773   1.409  -1.041  1.00  0.00           C  
HETATM   18  C   UNL     1       0.905   0.035  -1.171  1.00  0.00           C  
HETATM   19  C   UNL     1       2.146  -0.558  -1.075  1.00  0.00           C  
HETATM   20  C   UNL     1       3.274   0.228  -0.846  1.00  0.00           C  
HETATM   21  C   UNL     1       3.140   1.610  -0.718  1.00  0.00           C  
HETATM   22  C   UNL     1       4.611  -0.403  -0.744  1.00  0.00           C  
HETATM   23  C   UNL     1       5.678   0.090  -1.491  1.00  0.00           C  
HETATM   24  C   UNL     1       6.921  -0.501  -1.392  1.00  0.00           C  
HETATM   25  C   UNL     1       7.118  -1.585  -0.553  1.00  0.00           C  
HETATM   26  C   UNL     1       6.073  -2.087   0.195  1.00  0.00           C  
HETATM   27  C   UNL     1       4.812  -1.499   0.113  1.00  0.00           C  
HETATM   28  C   UNL     1       3.689  -2.033   0.912  1.00  0.00           C  
HETATM   29  N   UNL     1       3.737  -3.083   1.770  1.00  0.00           N  
HETATM   30  N   UNL     1       2.432  -3.200   2.282  1.00  0.00           N  
HETATM   31  N   UNL     1       1.729  -2.271   1.731  1.00  0.00           N  
HETATM   32  N   UNL     1       2.454  -1.576   0.930  1.00  0.00           N  
HETATM   33  C   UNL     1      -3.220  -2.345   0.327  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.470  -2.315  -0.515  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.702  -2.547   0.068  1.00  0.00           C  
HETATM   36  C   UNL     1      -6.848  -2.519  -0.704  1.00  0.00           C  
HETATM   37  C   UNL     1      -6.763  -2.258  -2.059  1.00  0.00           C  
HETATM   38  C   UNL     1      -5.531  -2.025  -2.642  1.00  0.00           C  
HETATM   39  C   UNL     1      -4.385  -2.049  -1.869  1.00  0.00           C  
HETATM   40  H   UNL     1      -1.238   6.537   0.367  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.903   5.236  -0.650  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.584   5.540   0.966  1.00  0.00           H  
HETATM   43  H   UNL     1       0.213   4.492   0.342  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.379   4.893   1.971  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.708   0.834   3.544  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.099  -1.365   2.598  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.097   1.983  -1.935  1.00  0.00           H  
HETATM   48  H   UNL     1       0.125   3.946  -2.395  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.550   4.447  -0.810  1.00  0.00           H  
HETATM   50  H   UNL     1       2.173   4.277  -1.273  1.00  0.00           H  
HETATM   51  H   UNL     1       1.452   3.963   0.333  1.00  0.00           H  
HETATM   52  H   UNL     1       0.031  -0.574  -1.348  1.00  0.00           H  
HETATM   53  H   UNL     1       2.243  -1.629  -1.177  1.00  0.00           H  
HETATM   54  H   UNL     1       4.012   2.222  -0.540  1.00  0.00           H  
HETATM   55  H   UNL     1       5.532   0.935  -2.148  1.00  0.00           H  
HETATM   56  H   UNL     1       7.746  -0.115  -1.974  1.00  0.00           H  
HETATM   57  H   UNL     1       8.094  -2.042  -0.487  1.00  0.00           H  
HETATM   58  H   UNL     1       6.233  -2.932   0.847  1.00  0.00           H  
HETATM   59  H   UNL     1       4.505  -3.634   1.984  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.378  -2.668  -0.285  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.356  -3.043   1.154  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.769  -2.751   1.126  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.811  -2.702  -0.249  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.658  -2.237  -2.662  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.464  -1.821  -3.700  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.423  -1.862  -2.323  1.00  0.00           H  
CONECT    1    2   40   41   42                                       
CONECT    2    1    3   43   44                                       
CONECT    3    2   12    4    4                                       
CONECT    4    3    3    5                                            
CONECT    5    4   11   11    6                                       
CONECT    6    5    7    7   45                                       
CONECT    7    6    6    8   46                                       
CONECT    8    9    7   33                                            
CONECT    9   11   10   10    8                                       
CONECT   10    9    9                                                 
CONECT   11   12    5    5    9                                       
CONECT   12   13    3   11                                            
CONECT   13   17   14   12   47                                       
CONECT   14   15   13   48   49                                       
CONECT   15   16   14   50   51                                       
CONECT   16   21   17   17   15                                       
CONECT   17   16   16   18   13                                       
CONECT   18   19   19   17   52                                       
CONECT   19   20   18   18   53                                       
CONECT   20   22   21   21   19                                       
CONECT   21   20   20   16   54                                       
CONECT   22   27   27   23   20                                       
CONECT   23   24   24   22   55                                       
CONECT   24   25   23   23   56                                       
CONECT   25   26   26   24   57                                       
CONECT   26   25   25   27   58                                       
CONECT   27   26   28   22   22                                       
CONECT   28   27   29   32   32                                       
CONECT   29   28   30   59                                            
CONECT   30   29   31   31                                            
CONECT   31   30   30   32                                            
CONECT   32   28   28   31                                            
CONECT   33    8   34   60   61                                       
CONECT   34   33   39   39   35                                       
CONECT   35   34   36   36   62                                       
CONECT   36   35   35   37   63                                       
CONECT   37   38   38   36   64                                       
CONECT   38   39   37   37   65                                       
CONECT   39   34   34   38   66                                       
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    2                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   21                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   29                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
CONECT   62   35                                                      
CONECT   63   36                                                      
CONECT   64   37                                                      
CONECT   65   38                                                      
CONECT   66   39                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
