COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.789  -1.945  -0.793  1.00  0.00           N  
HETATM    2  N   UNL     1      -1.415   4.295  -2.014  1.00  0.00           N  
HETATM    3  C   UNL     1       2.950  -1.773  -1.679  1.00  0.00           C  
HETATM    4  C   UNL     1       2.011  -2.535   0.536  1.00  0.00           C  
HETATM    5  C   UNL     1       3.148  -1.772   1.224  1.00  0.00           C  
HETATM    6  C   UNL     1       0.557  -1.568  -1.186  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.619  -1.754  -0.261  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.132  -2.012  -2.232  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.349  -1.999   0.416  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.956  -1.253   2.213  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.061  -1.409  -0.008  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.679   3.036  -1.698  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.598   5.048  -1.316  1.00  0.00           C  
HETATM   14  C   UNL     1       0.042   4.531  -0.178  1.00  0.00           C  
HETATM   15  C   UNL     1       1.515   4.750   1.690  1.00  0.00           C  
HETATM   16  C   UNL     1       0.414   2.650   1.327  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.877   0.625  -2.395  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.719   0.231  -1.258  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.394   1.102  -0.282  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.104   2.431  -0.600  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.214   3.186   0.195  1.00  0.00           C  
HETATM   22  C   UNL     1       1.263   3.429   2.055  1.00  0.00           C  
HETATM   23  C   UNL     1       0.923   5.303   0.596  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.888  -1.232  -0.938  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.899  -1.110   1.334  1.00  0.00           C  
HETATM   26 CL   UNL     1      -3.745  -0.876   3.894  1.00  0.00          Cl  
HETATM   27  C   UNL     1      -5.183  -1.698   1.752  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.286  -1.857  -0.471  1.00  0.00           C  
HETATM   29  O   UNL     1      -4.487  -2.169  -1.778  1.00  0.00           O  
HETATM   30  C   UNL     1      -3.544  -1.681  -2.734  1.00  0.00           C  
HETATM   31  O   UNL     1       0.393  -1.079  -2.283  1.00  0.00           O  
HETATM   32  C   UNL     1       4.050  -1.040  -0.904  1.00  0.00           C  
HETATM   33  N   UNL     1       4.326  -1.759   0.347  1.00  0.00           N  
HETATM   34  C   UNL     1       5.490  -1.188   1.037  1.00  0.00           C  
HETATM   35  C   UNL     1       6.746  -1.417   0.193  1.00  0.00           C  
HETATM   36  C   UNL     1       7.958  -0.822   0.911  1.00  0.00           C  
HETATM   37  O   UNL     1       9.131  -1.036   0.123  1.00  0.00           O  
HETATM   38  H   UNL     1       3.315  -2.749  -1.998  1.00  0.00           H  
HETATM   39  H   UNL     1       2.661  -1.184  -2.550  1.00  0.00           H  
HETATM   40  H   UNL     1       1.101  -2.450   1.131  1.00  0.00           H  
HETATM   41  H   UNL     1       2.286  -3.584   0.430  1.00  0.00           H  
HETATM   42  H   UNL     1       2.831  -0.748   1.423  1.00  0.00           H  
HETATM   43  H   UNL     1       3.399  -2.264   2.164  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.738  -2.813  -0.033  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.446  -1.201   0.662  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.398  -1.719  -2.982  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.053  -3.081  -2.038  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.306  -2.346   0.057  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.361   2.470  -2.314  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.417   6.069  -1.617  1.00  0.00           H  
HETATM   51  H   UNL     1       2.193   5.345   2.285  1.00  0.00           H  
HETATM   52  H   UNL     1       0.227   1.628   1.620  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.361   0.806   0.641  1.00  0.00           H  
HETATM   54  H   UNL     1       1.746   3.016   2.928  1.00  0.00           H  
HETATM   55  H   UNL     1       1.130   6.328   0.325  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.943  -0.763   1.695  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.010  -1.810   2.438  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.653  -0.602  -2.839  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.714  -2.164  -3.696  1.00  0.00           H  
HETATM   60  H   UNL     1       4.957  -1.001  -1.508  1.00  0.00           H  
HETATM   61  H   UNL     1       3.721  -0.026  -0.677  1.00  0.00           H  
HETATM   62  H   UNL     1       5.339  -0.118   1.181  1.00  0.00           H  
HETATM   63  H   UNL     1       5.611  -1.672   2.006  1.00  0.00           H  
HETATM   64  H   UNL     1       6.897  -2.487   0.049  1.00  0.00           H  
HETATM   65  H   UNL     1       6.625  -0.933  -0.777  1.00  0.00           H  
HETATM   66  H   UNL     1       7.807   0.248   1.055  1.00  0.00           H  
HETATM   67  H   UNL     1       8.079  -1.306   1.881  1.00  0.00           H  
HETATM   68  H   UNL     1       9.940  -0.683   0.519  1.00  0.00           H  
CONECT    1    4    6    3                                            
CONECT    2   13   12   12                                            
CONECT    3    1   32   38   39                                       
CONECT    4    1    5   40   41                                       
CONECT    5    4   33   42   43                                       
CONECT    6   31   31    1    7                                       
CONECT    7    6   24   44   45                                       
CONECT    8   24   30   46   47                                       
CONECT    9   28   28   27   48                                       
CONECT   10   25   26   27   27                                       
CONECT   11   24   25   25   28                                       
CONECT   12    2    2   20   49                                       
CONECT   13   14   14    2   50                                       
CONECT   14   23   13   13   21                                       
CONECT   15   23   23   22   51                                       
CONECT   16   22   22   21   52                                       
CONECT   17   18   18                                                 
CONECT   18   19   24   17   17                                       
CONECT   19   20   18   53                                            
CONECT   20   21   21   12   19                                       
CONECT   21   14   16   20   20                                       
CONECT   22   15   16   16   54                                       
CONECT   23   15   15   14   55                                       
CONECT   24    7   18    8   11                                       
CONECT   25   11   11   10   56                                       
CONECT   26   10                                                      
CONECT   27   10   10    9   57                                       
CONECT   28   11   29    9    9                                       
CONECT   29   30   28                                                 
CONECT   30    8   29   58   59                                       
CONECT   31    6    6                                                 
CONECT   32    3   33   60   61                                       
CONECT   33   34    5   32                                            
CONECT   34   35   33   62   63                                       
CONECT   35   36   34   64   65                                       
CONECT   36   37   35   66   67                                       
CONECT   37   36   68                                                 
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   19                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
CONECT   64   35                                                      
CONECT   65   35                                                      
CONECT   66   36                                                      
CONECT   67   36                                                      
CONECT   68   37                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
