COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.804   1.094  -1.909  1.00  0.00           N1+
HETATM    2  N   UNL     1      -1.203   2.870   1.281  1.00  0.00           N  
HETATM    3  C   UNL     1       0.794   5.560   2.117  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.423   3.421   2.279  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.241   1.448   0.998  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.818  -0.417  -2.143  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.434   1.569  -1.416  1.00  0.00           C  
HETATM    8  C   UNL     1       1.772  -1.075  -3.412  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.098   5.953   6.275  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.890  -2.245  -3.636  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.912   5.304   5.349  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.141   1.087   0.002  1.00  0.00           C  
HETATM   13  C   UNL     1       3.299   6.719   1.618  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.539   4.914   2.392  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.785   6.278   5.940  1.00  0.00           C  
HETATM   16  C   UNL     1       1.989  -2.498  -2.875  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.411   4.975   4.089  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.623   1.046   0.489  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.907   1.516  -0.935  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.453  -3.279  -2.602  1.00  0.00           C  
HETATM   21  C   UNL     1       0.908  -3.053  -1.949  1.00  0.00           C  
HETATM   22  C   UNL     1       1.494   6.205   3.142  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.787  -0.771  -3.217  1.00  0.00           C  
HETATM   24  C   UNL     1       1.360   5.510   0.835  1.00  0.00           C  
HETATM   25  C   UNL     1       0.616  -0.302  -2.783  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.284   5.954   4.676  1.00  0.00           C  
HETATM   27  C   UNL     1       2.606   6.088   0.587  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.089   5.293   3.742  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.080   1.765  -3.261  1.00  0.00           C  
HETATM   30  C   UNL     1       2.745   6.778   2.895  1.00  0.00           C  
HETATM   31  O   UNL     1       0.321   2.814   3.041  1.00  0.00           O  
HETATM   32  O   UNL     1       1.017   6.321   4.427  1.00  0.00           O  
HETATM   33 CL   UNL     1      -4.535   4.905   5.760  1.00  0.00          Cl  
HETATM   34 CL   UNL     1       3.289   6.016  -0.991  1.00  0.00          Cl  
HETATM   35  C   UNL     1      -3.417   1.292  -3.788  1.00  0.00           C  
HETATM   36  H   UNL     1      -1.778   3.490   0.718  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.045   0.953   1.956  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.585  -0.892  -1.186  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.832  -0.684  -2.452  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.440   2.664  -1.463  1.00  0.00           H  
HETATM   41  H   UNL     1       0.314   1.193  -2.123  1.00  0.00           H  
HETATM   42  H   UNL     1       2.698  -0.508  -3.250  1.00  0.00           H  
HETATM   43  H   UNL     1       1.644  -1.109  -4.501  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.490   6.207   7.255  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.314  -2.399  -4.556  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.930  -2.460  -3.915  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.020  -0.003  -0.010  1.00  0.00           H  
HETATM   48  H   UNL     1       0.820   1.502   0.330  1.00  0.00           H  
HETATM   49  H   UNL     1       4.269   7.165   1.422  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.248   5.254   1.626  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.158   6.787   6.668  1.00  0.00           H  
HETATM   52  H   UNL     1       2.937  -2.508  -2.321  1.00  0.00           H  
HETATM   53  H   UNL     1       2.137  -3.182  -3.720  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.058   4.465   3.381  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.402   1.435   1.156  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.705  -0.048   0.522  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.849   1.100  -1.310  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.966   2.611  -0.977  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.444  -4.260  -3.095  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.211  -3.350  -1.812  1.00  0.00           H  
HETATM   61  H   UNL     1       1.254  -4.013  -1.545  1.00  0.00           H  
HETATM   62  H   UNL     1       0.794  -2.403  -1.074  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.057  -0.185  -4.106  1.00  0.00           H  
HETATM   64  H   UNL     1       0.835   5.018   0.020  1.00  0.00           H  
HETATM   65  H   UNL     1       0.712  -0.311  -1.691  1.00  0.00           H  
HETATM   66  H   UNL     1       0.714   0.755  -3.065  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.071   2.845  -3.091  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.261   1.489  -3.931  1.00  0.00           H  
HETATM   69  H   UNL     1       3.290   7.276   3.692  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.630   1.761  -4.754  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.425   0.206  -3.930  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.228   1.551  -3.100  1.00  0.00           H  
CONECT    1    6    7   19   29                                       
CONECT    2    4    5   36                                            
CONECT    3   14   22   22   24                                       
CONECT    4    2   14   31   31                                       
CONECT    5    2   12   18   37                                       
CONECT    6    1   23   38   39                                       
CONECT    7    1   12   40   41                                       
CONECT    8   16   25   42   43                                       
CONECT    9   11   11   15   44                                       
CONECT   10   20   23   45   46                                       
CONECT   11    9    9   17   33                                       
CONECT   12    5    7   47   48                                       
CONECT   13   27   30   30   49                                       
CONECT   14    3    4   28   50                                       
CONECT   15    9   26   26   51                                       
CONECT   16    8   21   52   53                                       
CONECT   17   11   28   28   54                                       
CONECT   18    5   19   55   56                                       
CONECT   19    1   18   57   58                                       
CONECT   20   10   21   59   60                                       
CONECT   21   16   20   61   62                                       
CONECT   22    3    3   30   32                                       
CONECT   23    6   10   25   63                                       
CONECT   24    3   27   27   64                                       
CONECT   25    8   23   65   66                                       
CONECT   26   15   15   28   32                                       
CONECT   27   13   24   24   34                                       
CONECT   28   14   17   17   26                                       
CONECT   29    1   35   67   68                                       
CONECT   30   13   13   22   69                                       
CONECT   31    4    4                                                 
CONECT   32   22   26                                                 
CONECT   33   11                                                      
CONECT   34   27                                                      
CONECT   35   29   70   71   72                                       
CONECT   36    2                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   21                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   25                                                      
CONECT   67   29                                                      
CONECT   68   29                                                      
CONECT   69   30                                                      
CONECT   70   35                                                      
CONECT   71   35                                                      
CONECT   72   35                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
