COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.063  -0.277   0.713  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.955   2.655   0.667  1.00  0.00           C  
HETATM    3 CL   UNL     1      -5.850  -0.396   1.520  1.00  0.00          Cl  
HETATM    4  C   UNL     1      -4.078  -0.665   1.319  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.714  -0.580  -0.165  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.219  -0.683  -0.323  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.581  -2.004  -0.430  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.621  -2.894   0.648  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.021  -4.130   0.539  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.379  -4.492  -0.633  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.335  -3.617  -1.704  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.936  -2.379  -1.614  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.463   0.441  -0.365  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.113   1.770  -0.400  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.569   3.890   0.631  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.335   4.253  -0.462  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.491   3.382  -1.526  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.887   2.142  -1.500  1.00  0.00           C  
HETATM   19  C   UNL     1       0.013   0.339  -0.377  1.00  0.00           C  
HETATM   20  C   UNL     1       0.735   0.765  -1.493  1.00  0.00           C  
HETATM   21  C   UNL     1       2.109   0.659  -1.505  1.00  0.00           C  
HETATM   22  C   UNL     1       2.777   0.143  -0.401  1.00  0.00           C  
HETATM   23  C   UNL     1       0.687  -0.184   0.728  1.00  0.00           C  
HETATM   24  O   UNL     1       4.132   0.050  -0.412  1.00  0.00           O  
HETATM   25  C   UNL     1       4.755  -0.490   0.756  1.00  0.00           C  
HETATM   26  C   UNL     1       6.272  -0.516   0.559  1.00  0.00           C  
HETATM   27  N   UNL     1       6.771   0.859   0.415  1.00  0.00           N  
HETATM   28  C   UNL     1       6.738   1.568   1.701  1.00  0.00           C  
HETATM   29  C   UNL     1       8.123   0.870  -0.158  1.00  0.00           C  
HETATM   30  H   UNL     1       2.585  -0.682   1.567  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.357   2.372   1.521  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.530   0.098   1.871  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.815  -1.651   1.701  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.194  -1.396  -0.705  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.057   0.373  -0.569  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.121  -2.614   1.564  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.050  -4.819   1.371  1.00  0.00           H  
HETATM   38  H   UNL     1       0.090  -5.461  -0.712  1.00  0.00           H  
HETATM   39  H   UNL     1       0.167  -3.906  -2.615  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.905  -1.699  -2.452  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.451   4.574   1.458  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.814   5.221  -0.485  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.090   3.672  -2.376  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.009   1.463  -2.330  1.00  0.00           H  
HETATM   45  H   UNL     1       0.217   1.171  -2.350  1.00  0.00           H  
HETATM   46  H   UNL     1       2.669   0.989  -2.368  1.00  0.00           H  
HETATM   47  H   UNL     1       0.132  -0.516   1.593  1.00  0.00           H  
HETATM   48  H   UNL     1       4.511   0.131   1.617  1.00  0.00           H  
HETATM   49  H   UNL     1       4.393  -1.504   0.924  1.00  0.00           H  
HETATM   50  H   UNL     1       6.742  -0.985   1.423  1.00  0.00           H  
HETATM   51  H   UNL     1       6.512  -1.085  -0.339  1.00  0.00           H  
HETATM   52  H   UNL     1       7.112   2.582   1.566  1.00  0.00           H  
HETATM   53  H   UNL     1       5.712   1.605   2.070  1.00  0.00           H  
HETATM   54  H   UNL     1       7.364   1.042   2.422  1.00  0.00           H  
HETATM   55  H   UNL     1       8.091   0.474  -1.173  1.00  0.00           H  
HETATM   56  H   UNL     1       8.500   1.893  -0.179  1.00  0.00           H  
HETATM   57  H   UNL     1       8.782   0.253   0.453  1.00  0.00           H  
CONECT    1   22   23   23   30                                       
CONECT    2   15   15   14   31                                       
CONECT    3    4                                                      
CONECT    4    5    3   32   33                                       
CONECT    5    6    4   34   35                                       
CONECT    6   13   13    5    7                                       
CONECT    7    6    8    8   12                                       
CONECT    8    7    7    9   36                                       
CONECT    9    8   10   10   37                                       
CONECT   10    9    9   11   38                                       
CONECT   11   12   12   10   39                                       
CONECT   12    7   11   11   40                                       
CONECT   13   14   19    6    6                                       
CONECT   14   18   18    2   13                                       
CONECT   15   16    2    2   41                                       
CONECT   16   17   17   15   42                                       
CONECT   17   16   16   18   43                                       
CONECT   18   17   14   14   44                                       
CONECT   19   20   20   23   13                                       
CONECT   20   21   19   19   45                                       
CONECT   21   22   22   20   46                                       
CONECT   22   24   21   21    1                                       
CONECT   23    1    1   19   47                                       
CONECT   24   25   22                                                 
CONECT   25   26   24   48   49                                       
CONECT   26   27   25   50   51                                       
CONECT   27   28   29   26                                            
CONECT   28   27   52   53   54                                       
CONECT   29   27   55   56   57                                       
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
