COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       8.098   3.736  -0.523  1.00  0.00           N  
HETATM    2  C   UNL     1       7.308   2.702  -0.457  1.00  0.00           C  
HETATM    3  N   UNL     1       6.305   2.542  -1.383  1.00  0.00           N  
HETATM    4  N   UNL     1       7.478   1.770   0.540  1.00  0.00           N  
HETATM    5  C   UNL     1       6.671   0.548   0.546  1.00  0.00           C  
HETATM    6  C   UNL     1       6.870  -0.201  -0.773  1.00  0.00           C  
HETATM    7  C   UNL     1       8.320  -0.679  -0.874  1.00  0.00           C  
HETATM    8  C   UNL     1       8.518  -1.428  -2.194  1.00  0.00           C  
HETATM    9  C   UNL     1       7.579  -2.635  -2.242  1.00  0.00           C  
HETATM   10  C   UNL     1       6.129  -2.157  -2.140  1.00  0.00           C  
HETATM   11  C   UNL     1       5.930  -1.408  -0.821  1.00  0.00           C  
HETATM   12  C   UNL     1       5.216   0.908   0.705  1.00  0.00           C  
HETATM   13  O   UNL     1       4.837   2.030   0.445  1.00  0.00           O  
HETATM   14  N   UNL     1       4.336  -0.018   1.137  1.00  0.00           N  
HETATM   15  C   UNL     1       2.922   0.332   1.292  1.00  0.00           C  
HETATM   16  C   UNL     1       2.158  -0.870   1.784  1.00  0.00           C  
HETATM   17  O   UNL     1       2.738  -1.916   1.985  1.00  0.00           O  
HETATM   18  N   UNL     1       0.831  -0.783   1.999  1.00  0.00           N  
HETATM   19  C   UNL     1       0.072  -1.947   2.479  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.105  -2.192   1.531  1.00  0.00           C  
HETATM   21  C   UNL     1       0.116   0.479   1.766  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.064   0.204   0.820  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.932  -0.911   1.407  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.111  -1.159   0.502  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.123  -1.963  -0.583  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.405  -1.917  -1.145  1.00  0.00           N  
HETATM   27  C   UNL     1      -4.342  -0.620   0.636  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.143  -1.107  -0.416  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.568  -0.769  -0.657  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.020   0.536  -0.468  1.00  0.00           C  
HETATM   31 CL   UNL     1      -5.915   1.773   0.043  1.00  0.00          Cl  
HETATM   32  C   UNL     1      -7.461  -1.758  -1.066  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.785  -1.440  -1.288  1.00  0.00           C  
HETATM   34  C   UNL     1      -9.229  -0.142  -1.105  1.00  0.00           C  
HETATM   35  C   UNL     1      -8.348   0.844  -0.698  1.00  0.00           C  
HETATM   36 CL   UNL     1      -8.912   2.470  -0.470  1.00  0.00          Cl  
HETATM   37  H   UNL     1       8.850   3.813   0.085  1.00  0.00           H  
HETATM   38  H   UNL     1       6.149   3.227  -2.052  1.00  0.00           H  
HETATM   39  H   UNL     1       5.757   1.742  -1.371  1.00  0.00           H  
HETATM   40  H   UNL     1       8.133   1.923   1.240  1.00  0.00           H  
HETATM   41  H   UNL     1       6.981  -0.088   1.376  1.00  0.00           H  
HETATM   42  H   UNL     1       6.648   0.466  -1.606  1.00  0.00           H  
HETATM   43  H   UNL     1       8.989   0.181  -0.840  1.00  0.00           H  
HETATM   44  H   UNL     1       8.542  -1.345  -0.041  1.00  0.00           H  
HETATM   45  H   UNL     1       8.296  -0.761  -3.027  1.00  0.00           H  
HETATM   46  H   UNL     1       9.551  -1.768  -2.266  1.00  0.00           H  
HETATM   47  H   UNL     1       7.721  -3.168  -3.181  1.00  0.00           H  
HETATM   48  H   UNL     1       7.801  -3.301  -1.408  1.00  0.00           H  
HETATM   49  H   UNL     1       5.907  -1.490  -2.973  1.00  0.00           H  
HETATM   50  H   UNL     1       5.460  -3.016  -2.174  1.00  0.00           H  
HETATM   51  H   UNL     1       6.152  -2.074   0.013  1.00  0.00           H  
HETATM   52  H   UNL     1       4.897  -1.067  -0.748  1.00  0.00           H  
HETATM   53  H   UNL     1       4.640  -0.915   1.345  1.00  0.00           H  
HETATM   54  H   UNL     1       2.825   1.144   2.012  1.00  0.00           H  
HETATM   55  H   UNL     1       2.519   0.650   0.330  1.00  0.00           H  
HETATM   56  H   UNL     1       0.719  -2.824   2.493  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.302  -1.750   3.483  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.728  -2.478   0.549  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.731  -2.992   1.927  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.258   0.874   2.710  1.00  0.00           H  
HETATM   61  H   UNL     1       0.791   1.201   1.307  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.687  -0.104  -0.155  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.659   1.110   0.711  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.288  -0.612   2.393  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.374  -2.482  -0.916  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.656   0.067   1.408  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.117  -2.771  -1.211  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.477  -2.206  -1.606  1.00  0.00           H  
HETATM   69  H   UNL     1     -10.266   0.102  -1.280  1.00  0.00           H  
CONECT    1    2    2   37                                            
CONECT    2    1    1    3    4                                       
CONECT    3    2   38   39                                            
CONECT    4    2    5   40                                            
CONECT    5    4    6   12   41                                       
CONECT    6    5    7   11   42                                       
CONECT    7    6    8   43   44                                       
CONECT    8    7    9   45   46                                       
CONECT    9    8   10   47   48                                       
CONECT   10    9   11   49   50                                       
CONECT   11    6   10   51   52                                       
CONECT   12    5   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   53                                            
CONECT   15   14   16   54   55                                       
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   21                                            
CONECT   19   18   20   56   57                                       
CONECT   20   19   23   58   59                                       
CONECT   21   18   22   60   61                                       
CONECT   22   21   23   62   63                                       
CONECT   23   20   22   24   64                                       
CONECT   24   23   25   27   27                                       
CONECT   25   24   26   65                                            
CONECT   26   25   28   28                                            
CONECT   27   24   24   28   66                                       
CONECT   28   26   26   27   29                                       
CONECT   29   28   30   30   32                                       
CONECT   30   29   29   31   35                                       
CONECT   31   30                                                      
CONECT   32   29   33   33   67                                       
CONECT   33   32   32   34   68                                       
CONECT   34   33   35   35   69                                       
CONECT   35   30   34   34   36                                       
CONECT   36   35                                                      
CONECT   37    1                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   20                                                      
CONECT   60   21                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   22                                                      
CONECT   64   23                                                      
CONECT   65   25                                                      
CONECT   66   27                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
