COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.418   3.374   0.428  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.273   4.403   1.340  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.522   4.215   2.485  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.913   2.997   2.724  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.055   1.961   1.814  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.811   2.151   0.661  1.00  0.00           C  
HETATM    7  O   UNL     1      -0.457   0.762   2.047  1.00  0.00           O  
HETATM    8  O   UNL     1      -1.953   1.138  -0.235  1.00  0.00           O  
HETATM    9  C   UNL     1       0.724   0.507   1.427  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.743   1.405  -1.396  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.787   0.157  -2.280  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.489  -0.918  -1.573  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.795  -1.764  -0.790  1.00  0.00           C  
HETATM   14  N   UNL     1      -3.414  -2.760  -0.129  1.00  0.00           N  
HETATM   15  C   UNL     1      -4.747  -2.925  -0.243  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.489  -2.043  -1.064  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.844  -1.048  -1.711  1.00  0.00           C  
HETATM   18  O   UNL     1      -1.592  -1.627  -0.678  1.00  0.00           O  
HETATM   19  O   UNL     1      -5.308  -3.827   0.354  1.00  0.00           O  
HETATM   20  C   UNL     1       1.293  -0.730   1.540  1.00  0.00           C  
HETATM   21  C   UNL     1       2.515  -0.995   0.899  1.00  0.00           C  
HETATM   22  C   UNL     1       3.141   0.029   0.142  1.00  0.00           C  
HETATM   23  C   UNL     1       2.527   1.289   0.047  1.00  0.00           C  
HETATM   24  C   UNL     1       1.341   1.513   0.675  1.00  0.00           C  
HETATM   25  C   UNL     1       0.613  -1.805   2.349  1.00  0.00           C  
HETATM   26  C   UNL     1       3.125  -2.255   0.996  1.00  0.00           C  
HETATM   27  C   UNL     1       4.364  -0.231  -0.502  1.00  0.00           C  
HETATM   28  C   UNL     1       3.177   2.388  -0.752  1.00  0.00           C  
HETATM   29  C   UNL     1       4.330  -2.479   0.350  1.00  0.00           C  
HETATM   30  C   UNL     1       4.941  -1.455  -0.398  1.00  0.00           C  
HETATM   31  C   UNL     1       4.959  -3.762   0.444  1.00  0.00           C  
HETATM   32  N   UNL     1       5.458  -4.780   0.519  1.00  0.00           N  
HETATM   33  C   UNL     1       2.783   2.250  -2.224  1.00  0.00           C  
HETATM   34  C   UNL     1       3.249   3.345  -3.186  1.00  0.00           C  
HETATM   35  C   UNL     1       3.899   1.960  -3.230  1.00  0.00           C  
HETATM   36  H   UNL     1      -3.009   3.522  -0.464  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.746   5.356   1.157  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.411   5.021   3.195  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.326   2.852   3.619  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.755   1.672  -1.093  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.301   2.230  -1.954  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.314   0.386  -3.207  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.771  -0.162  -2.510  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.899  -3.360   0.432  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.558  -2.160  -1.168  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.394  -0.363  -2.339  1.00  0.00           H  
HETATM   47  H   UNL     1       0.871   2.482   0.596  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.058  -2.374   1.706  1.00  0.00           H  
HETATM   49  H   UNL     1       1.365  -2.472   2.771  1.00  0.00           H  
HETATM   50  H   UNL     1       0.041  -1.346   3.156  1.00  0.00           H  
HETATM   51  H   UNL     1       2.660  -3.043   1.569  1.00  0.00           H  
HETATM   52  H   UNL     1       4.845   0.545  -1.080  1.00  0.00           H  
HETATM   53  H   UNL     1       2.845   3.356  -0.377  1.00  0.00           H  
HETATM   54  H   UNL     1       4.260   2.314  -0.658  1.00  0.00           H  
HETATM   55  H   UNL     1       5.880  -1.646  -0.896  1.00  0.00           H  
HETATM   56  H   UNL     1       1.808   1.799  -2.409  1.00  0.00           H  
HETATM   57  H   UNL     1       2.581   3.613  -4.005  1.00  0.00           H  
HETATM   58  H   UNL     1       3.836   4.164  -2.771  1.00  0.00           H  
HETATM   59  H   UNL     1       4.914   1.868  -2.843  1.00  0.00           H  
HETATM   60  H   UNL     1       3.658   1.318  -4.077  1.00  0.00           H  
CONECT    1    6    6    2   36                                       
CONECT    2    1    3    3   37                                       
CONECT    3    2    2    4   38                                       
CONECT    4    5    5    3   39                                       
CONECT    5    6    7    4    4                                       
CONECT    6    8    1    1    5                                       
CONECT    7    5    9                                                 
CONECT    8   10    6                                                 
CONECT    9    7   24   24   20                                       
CONECT   10   11    8   40   41                                       
CONECT   11   10   12   42   43                                       
CONECT   12   11   13   17                                            
CONECT   13   18   18   12   14                                       
CONECT   14   13   15   44                                            
CONECT   15   14   16   19   19                                       
CONECT   16   17   17   15   45                                       
CONECT   17   12   16   16   46                                       
CONECT   18   13   13                                                 
CONECT   19   15   15                                                 
CONECT   20    9   25   21   21                                       
CONECT   21   20   20   22   26                                       
CONECT   22   23   23   21   27                                       
CONECT   23   24   28   22   22                                       
CONECT   24    9    9   23   47                                       
CONECT   25   20   48   49   50                                       
CONECT   26   21   29   29   51                                       
CONECT   27   22   30   30   52                                       
CONECT   28   23   33   53   54                                       
CONECT   29   26   26   30   31                                       
CONECT   30   27   27   29   55                                       
CONECT   31   29   32   32   32                                       
CONECT   32   31   31   31                                            
CONECT   33   28   35   34   56                                       
CONECT   34   35   33   57   58                                       
CONECT   35   33   34   59   60                                       
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   30                                                      
CONECT   56   33                                                      
CONECT   57   34                                                      
CONECT   58   34                                                      
CONECT   59   35                                                      
CONECT   60   35                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
