COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.901   0.688   0.472  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.175   0.158   0.575  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.560   2.110   0.561  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.405   0.929   0.786  1.00  0.00           C  
HETATM    5  C   UNL     1       0.961   2.267   0.611  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.883   0.652  -1.132  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.894   2.913  -0.542  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.915  -0.852  -0.853  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.127   0.016  -0.509  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.730   3.343  -1.437  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.789  -4.604   0.117  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.102  -1.196   0.449  1.00  0.00           C  
HETATM   13  C   UNL     1       3.431   1.057   0.009  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.747  -1.536   0.261  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.009  -0.337   0.278  1.00  0.00           C  
HETATM   16  N   UNL     1       1.313  -0.358   0.125  1.00  0.00           N  
HETATM   17  C   UNL     1       1.987  -1.479  -0.052  1.00  0.00           C  
HETATM   18  C   UNL     1       1.327  -2.723  -0.088  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.064  -2.755   0.075  1.00  0.00           C  
HETATM   20  N   UNL     1       3.363  -1.432  -0.205  1.00  0.00           N  
HETATM   21  N   UNL     1       1.736  -4.005  -0.250  1.00  0.00           N  
HETATM   22  C   UNL     1       0.706  -4.799  -0.204  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.428  -4.073   0.004  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.042   1.482  -0.265  1.00  0.00           N  
HETATM   25  O   UNL     1      -3.850   1.070   1.910  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.685   3.628   0.065  1.00  0.00           C  
HETATM   27  C   UNL     1       4.029  -0.201  -0.171  1.00  0.00           C  
HETATM   28  C   UNL     1       4.409   1.990  -0.019  1.00  0.00           C  
HETATM   29  N   UNL     1       5.584   1.352  -0.205  1.00  0.00           N  
HETATM   30  N   UNL     1       5.323  -0.021  -0.303  1.00  0.00           N  
HETATM   31  C   UNL     1       4.221   3.478   0.128  1.00  0.00           C  
HETATM   32  C   UNL     1       6.902   1.986  -0.298  1.00  0.00           C  
HETATM   33  H   UNL     1      -0.950   2.632  -0.313  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.998   2.533   1.464  1.00  0.00           H  
HETATM   35  H   UNL     1       1.360   1.677   1.436  1.00  0.00           H  
HETATM   36  H   UNL     1       1.394   1.917  -0.327  1.00  0.00           H  
HETATM   37  H   UNL     1       1.214   3.317   0.758  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.948   0.973  -2.171  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.824   3.476  -0.621  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.002  -1.521  -1.710  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.311  -1.224  -0.026  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.320   0.215   0.545  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.011  -0.082  -1.139  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.075   2.561  -1.821  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.895   4.188  -2.106  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.246  -4.648  -0.871  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.754  -5.606   0.546  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.380  -3.954   0.763  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.932  -1.886   0.487  1.00  0.00           H  
HETATM   50  H   UNL     1       2.376   1.245   0.143  1.00  0.00           H  
HETATM   51  H   UNL     1       3.865  -2.252  -0.336  1.00  0.00           H  
HETATM   52  H   UNL     1       0.746  -5.874  -0.305  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.820   4.661   0.385  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.000   3.034   0.670  1.00  0.00           H  
HETATM   55  H   UNL     1       4.289   3.750   1.181  1.00  0.00           H  
HETATM   56  H   UNL     1       4.996   3.999  -0.433  1.00  0.00           H  
HETATM   57  H   UNL     1       3.241   3.760  -0.258  1.00  0.00           H  
HETATM   58  H   UNL     1       7.342   2.056   0.697  1.00  0.00           H  
HETATM   59  H   UNL     1       7.548   1.387  -0.939  1.00  0.00           H  
HETATM   60  H   UNL     1       6.795   2.985  -0.719  1.00  0.00           H  
CONECT    1    2   15    3                                            
CONECT    2    4   12   12    1                                       
CONECT    3    1    5   33   34                                       
CONECT    4   24    2   25   25                                       
CONECT    5    3   35   36   37                                       
CONECT    6    8    9   24   38                                       
CONECT    7   26   10   24   39                                       
CONECT    8    6    9   40   41                                       
CONECT    9    8    6   42   43                                       
CONECT   10   26    7   44   45                                       
CONECT   11   23   46   47   48                                       
CONECT   12    2    2   14   49                                       
CONECT   13   27   28   28   50                                       
CONECT   14   12   19   19   15                                       
CONECT   15   14    1   16   16                                       
CONECT   16   15   15   17                                            
CONECT   17   18   18   16   20                                       
CONECT   18   19   21   17   17                                       
CONECT   19   23   14   14   18                                       
CONECT   20   17   27   51                                            
CONECT   21   22   22   18                                            
CONECT   22   23   21   21   52                                       
CONECT   23   11   19   22                                            
CONECT   24    7    6    4                                            
CONECT   25    4    4                                                 
CONECT   26    7   10   53   54                                       
CONECT   27   20   30   30   13                                       
CONECT   28   13   13   29   31                                       
CONECT   29   30   32   28                                            
CONECT   30   27   27   29                                            
CONECT   31   28   55   56   57                                       
CONECT   32   29   58   59   60                                       
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   20                                                      
CONECT   52   22                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   32                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
