COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.050   5.376  -0.305  1.00  0.00           C  
HETATM    2  N   UNL     1      -5.534   4.044   0.041  1.00  0.00           N  
HETATM    3  C   UNL     1      -4.769   4.090   1.295  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.670   4.611   2.417  1.00  0.00           C  
HETATM    5  O   UNL     1      -6.187   5.893   2.051  1.00  0.00           O  
HETATM    6  C   UNL     1      -6.939   5.884   0.834  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.720   3.495  -1.052  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.001   2.234  -0.569  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.154   1.662  -1.707  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.465   0.454  -1.245  1.00  0.00           N  
HETATM   11  N   UNL     1      -1.200   0.408  -0.641  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.920  -0.851  -0.368  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.004  -1.632  -0.795  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.939  -0.803  -1.320  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.265  -1.256  -1.877  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.193  -2.761  -2.164  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.568  -3.442  -1.021  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.159  -3.131  -0.710  1.00  0.00           C  
HETATM   19  C   UNL     1       0.320  -1.353   0.274  1.00  0.00           C  
HETATM   20  C   UNL     1       0.265  -2.446   1.139  1.00  0.00           C  
HETATM   21  C   UNL     1       1.417  -2.916   1.739  1.00  0.00           C  
HETATM   22  C   UNL     1       2.631  -2.308   1.488  1.00  0.00           C  
HETATM   23  C   UNL     1       2.700  -1.212   0.622  1.00  0.00           C  
HETATM   24  C   UNL     1       1.538  -0.738   0.010  1.00  0.00           C  
HETATM   25  C   UNL     1       3.958  -0.580   0.360  1.00  0.00           C  
HETATM   26  C   UNL     1       4.990  -0.063   0.145  1.00  0.00           C  
HETATM   27  C   UNL     1       6.248   0.568  -0.117  1.00  0.00           C  
HETATM   28  C   UNL     1       6.317   1.664  -0.981  1.00  0.00           C  
HETATM   29  C   UNL     1       7.532   2.267  -1.229  1.00  0.00           C  
HETATM   30  C   UNL     1       8.682   1.790  -0.623  1.00  0.00           C  
HETATM   31  C   UNL     1       8.621   0.705   0.236  1.00  0.00           C  
HETATM   32  C   UNL     1       7.412   0.095   0.496  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.263  -4.329  -0.281  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.699  -4.633  -0.623  1.00  0.00           C  
HETATM   35  O   UNL     1      -6.214  -5.596   0.299  1.00  0.00           O  
HETATM   36  O   UNL     1      -3.733  -4.882   0.659  1.00  0.00           O  
HETATM   37 CL   UNL     1       4.074  -2.905   2.247  1.00  0.00          Cl  
HETATM   38 CL   UNL     1      10.208   2.555  -0.940  1.00  0.00          Cl  
HETATM   39  H   UNL     1      -5.216   6.063  -0.450  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.634   5.314  -1.223  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.418   3.089   1.545  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.914   4.756   1.176  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.496   3.917   2.573  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.092   4.701   3.337  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.277   6.895   0.608  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.801   5.227   0.943  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.365   3.245  -1.895  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.984   4.235  -1.365  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.357   2.483   0.274  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.737   1.493  -0.257  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.798   1.412  -2.550  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.418   2.402  -2.020  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.053  -1.061  -1.149  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.477  -0.717  -2.800  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.199  -3.152  -2.316  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.597  -2.932  -3.061  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.496  -3.614  -1.428  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.927  -3.472   0.299  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.681  -2.926   1.340  1.00  0.00           H  
HETATM   60  H   UNL     1       1.367  -3.762   2.409  1.00  0.00           H  
HETATM   61  H   UNL     1       1.584   0.108  -0.659  1.00  0.00           H  
HETATM   62  H   UNL     1       5.421   2.037  -1.455  1.00  0.00           H  
HETATM   63  H   UNL     1       7.587   3.114  -1.897  1.00  0.00           H  
HETATM   64  H   UNL     1       9.522   0.338   0.705  1.00  0.00           H  
HETATM   65  H   UNL     1       7.365  -0.751   1.166  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.289  -3.719  -0.561  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.755  -5.033  -1.635  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.136  -5.840   0.139  1.00  0.00           H  
CONECT    1    6    2   39   40                                       
CONECT    2    1    7    3                                            
CONECT    3    2    4   41   42                                       
CONECT    4    3    5   43   44                                       
CONECT    5    4    6                                                 
CONECT    6    1    5   45   46                                       
CONECT    7    2    8   47   48                                       
CONECT    8    7    9   49   50                                       
CONECT    9    8   10   51   52                                       
CONECT   10    9   11   14                                            
CONECT   11   10   12   12                                            
CONECT   12   11   11   19   13                                       
CONECT   13   12   18   14   14                                       
CONECT   14   10   13   13   15                                       
CONECT   15   14   16   53   54                                       
CONECT   16   15   17   55   56                                       
CONECT   17   16   18   33                                            
CONECT   18   13   17   57   58                                       
CONECT   19   12   24   24   20                                       
CONECT   20   19   21   21   59                                       
CONECT   21   20   20   22   60                                       
CONECT   22   21   37   23   23                                       
CONECT   23   22   22   25   24                                       
CONECT   24   19   19   23   61                                       
CONECT   25   23   26   26   26                                       
CONECT   26   25   25   25   27                                       
CONECT   27   26   32   32   28                                       
CONECT   28   27   29   29   62                                       
CONECT   29   28   28   30   63                                       
CONECT   30   29   38   31   31                                       
CONECT   31   30   30   32   64                                       
CONECT   32   27   27   31   65                                       
CONECT   33   17   36   36   34                                       
CONECT   34   33   35   66   67                                       
CONECT   35   34   68                                                 
CONECT   36   33   33                                                 
CONECT   37   22                                                      
CONECT   38   30                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   16                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   20                                                      
CONECT   60   21                                                      
CONECT   61   24                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   34                                                      
CONECT   67   34                                                      
CONECT   68   35                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
