COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -9.016   5.067   0.109  1.00  0.00           N  
HETATM    2  C   UNL     1      -9.158   4.027  -0.919  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.362   2.812  -0.519  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.956   1.819   0.240  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.231   0.704   0.609  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.900   0.580   0.217  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.307   1.583  -0.546  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.043   2.691  -0.915  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.116  -0.617   0.612  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.703  -1.627   1.378  1.00  0.00           C  
HETATM   11  N   UNL     1      -6.026  -2.694   1.738  1.00  0.00           N  
HETATM   12  C   UNL     1      -4.756  -2.868   1.394  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.849  -3.872   1.640  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.648  -3.579   1.061  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.725  -2.386   0.423  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.641  -1.711  -0.330  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.876  -1.236  -1.620  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.865  -0.607  -2.319  1.00  0.00           C  
HETATM   19  C   UNL     1       0.381  -0.446  -1.744  1.00  0.00           C  
HETATM   20  C   UNL     1       0.625  -0.917  -0.459  1.00  0.00           C  
HETATM   21  N   UNL     1       1.889  -0.752   0.119  1.00  0.00           N  
HETATM   22  C   UNL     1       2.991  -0.764  -0.657  1.00  0.00           C  
HETATM   23  O   UNL     1       2.883  -0.764  -1.868  1.00  0.00           O  
HETATM   24  N   UNL     1       4.214  -0.777  -0.090  1.00  0.00           N  
HETATM   25  C   UNL     1       5.356  -0.616  -0.884  1.00  0.00           C  
HETATM   26  C   UNL     1       5.366  -1.082  -2.190  1.00  0.00           C  
HETATM   27  C   UNL     1       6.495  -0.922  -2.973  1.00  0.00           C  
HETATM   28  C   UNL     1       7.615  -0.297  -2.457  1.00  0.00           C  
HETATM   29  C   UNL     1       7.612   0.171  -1.155  1.00  0.00           C  
HETATM   30  C   UNL     1       6.484   0.019  -0.366  1.00  0.00           C  
HETATM   31  O   UNL     1       6.478   0.482   0.911  1.00  0.00           O  
HETATM   32  C   UNL     1       7.545   1.212   1.330  1.00  0.00           C  
HETATM   33  C   UNL     1       7.660   2.546   0.969  1.00  0.00           C  
HETATM   34  C   UNL     1       8.746   3.286   1.396  1.00  0.00           C  
HETATM   35  C   UNL     1       9.719   2.696   2.182  1.00  0.00           C  
HETATM   36  C   UNL     1       9.607   1.366   2.544  1.00  0.00           C  
HETATM   37  C   UNL     1       8.520   0.624   2.125  1.00  0.00           C  
HETATM   38  C   UNL     1      -0.386  -1.545   0.252  1.00  0.00           C  
HETATM   39  C   UNL     1      -4.097  -1.893   0.622  1.00  0.00           C  
HETATM   40  C   UNL     1      -4.785  -0.751   0.219  1.00  0.00           C  
HETATM   41  H   UNL     1      -8.044   5.289   0.266  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.541   5.893  -0.137  1.00  0.00           H  
HETATM   43  H   UNL     1     -10.210   3.756  -1.019  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.789   4.406  -1.872  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.988   1.916   0.543  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.696  -0.071   1.202  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.276   1.492  -0.853  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.586   3.467  -1.511  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.735  -1.528   1.681  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.036  -4.674   2.153  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.768  -4.204   1.105  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.849  -1.360  -2.072  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.049  -0.240  -3.317  1.00  0.00           H  
HETATM   54  H   UNL     1       1.169   0.046  -2.296  1.00  0.00           H  
HETATM   55  H   UNL     1       1.971  -0.629   1.077  1.00  0.00           H  
HETATM   56  H   UNL     1       4.302  -0.898   0.869  1.00  0.00           H  
HETATM   57  H   UNL     1       4.493  -1.571  -2.596  1.00  0.00           H  
HETATM   58  H   UNL     1       6.502  -1.286  -3.989  1.00  0.00           H  
HETATM   59  H   UNL     1       8.494  -0.174  -3.071  1.00  0.00           H  
HETATM   60  H   UNL     1       8.489   0.658  -0.755  1.00  0.00           H  
HETATM   61  H   UNL     1       6.901   3.007   0.354  1.00  0.00           H  
HETATM   62  H   UNL     1       8.836   4.325   1.115  1.00  0.00           H  
HETATM   63  H   UNL     1      10.567   3.276   2.515  1.00  0.00           H  
HETATM   64  H   UNL     1      10.368   0.908   3.158  1.00  0.00           H  
HETATM   65  H   UNL     1       8.430  -0.413   2.412  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.200  -1.908   1.252  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.302   0.009  -0.377  1.00  0.00           H  
CONECT    1    2   41   42                                            
CONECT    2    1    3   43   44                                       
CONECT    3    2    4    4    8                                       
CONECT    4    3    3    5   45                                       
CONECT    5    4    6    6   46                                       
CONECT    6    5    5    7    9                                       
CONECT    7    6    8    8   47                                       
CONECT    8    3    7    7   48                                       
CONECT    9    6   10   10   40                                       
CONECT   10    9    9   11   49                                       
CONECT   11   10   12   12                                            
CONECT   12   11   11   13   39                                       
CONECT   13   12   14   50                                            
CONECT   14   13   15   15   51                                       
CONECT   15   14   14   16   39                                       
CONECT   16   15   17   17   38                                       
CONECT   17   16   16   18   52                                       
CONECT   18   17   19   19   53                                       
CONECT   19   18   18   20   54                                       
CONECT   20   19   21   38   38                                       
CONECT   21   20   22   55                                            
CONECT   22   21   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   56                                            
CONECT   25   24   26   26   30                                       
CONECT   26   25   25   27   57                                       
CONECT   27   26   28   28   58                                       
CONECT   28   27   27   29   59                                       
CONECT   29   28   30   30   60                                       
CONECT   30   25   29   29   31                                       
CONECT   31   30   32                                                 
CONECT   32   31   33   33   37                                       
CONECT   33   32   32   34   61                                       
CONECT   34   33   35   35   62                                       
CONECT   35   34   34   36   63                                       
CONECT   36   35   37   37   64                                       
CONECT   37   32   36   36   65                                       
CONECT   38   16   20   20   66                                       
CONECT   39   12   15   40   40                                       
CONECT   40    9   39   39   67                                       
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    2                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49   10                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   21                                                      
CONECT   56   24                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   33                                                      
CONECT   62   34                                                      
CONECT   63   35                                                      
CONECT   64   36                                                      
CONECT   65   37                                                      
CONECT   66   38                                                      
CONECT   67   40                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
