COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.201  -2.684   2.040  1.00  0.00           C  
HETATM    2  O   UNL     1       4.495  -2.349   0.683  1.00  0.00           O  
HETATM    3  C   UNL     1       4.429  -1.038   0.345  1.00  0.00           C  
HETATM    4  C   UNL     1       3.226  -0.483  -0.111  1.00  0.00           C  
HETATM    5  C   UNL     1       2.030  -1.321  -0.231  1.00  0.00           C  
HETATM    6  O   UNL     1       2.081  -2.496   0.064  1.00  0.00           O  
HETATM    7  C   UNL     1       0.737  -0.722  -0.722  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.345  -1.803  -0.754  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.658  -1.196  -1.252  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.708  -2.300  -1.403  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.036  -1.679  -1.843  1.00  0.00           C  
HETATM   12  N   UNL     1      -4.473  -0.696  -0.843  1.00  0.00           N  
HETATM   13  C   UNL     1      -5.810  -0.180  -1.162  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.334   0.642   0.017  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.672   1.283  -0.362  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.196   2.104   0.818  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.393   1.190   2.029  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.056   0.550   2.408  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.532  -0.272   1.228  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.503   0.399  -0.715  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.159  -0.161  -0.241  1.00  0.00           C  
HETATM   22  C   UNL     1       3.168   0.881  -0.453  1.00  0.00           C  
HETATM   23  C   UNL     1       4.271   1.671  -0.346  1.00  0.00           C  
HETATM   24 CL   UNL     1       4.174   3.350  -0.774  1.00  0.00          Cl  
HETATM   25  C   UNL     1       5.482   1.139   0.107  1.00  0.00           C  
HETATM   26  N   UNL     1       6.727   1.681   0.313  1.00  0.00           N  
HETATM   27  C   UNL     1       7.585   0.720   0.774  1.00  0.00           C  
HETATM   28  C   UNL     1       6.942  -0.453   0.882  1.00  0.00           C  
HETATM   29  C   UNL     1       5.560  -0.222   0.454  1.00  0.00           C  
HETATM   30  H   UNL     1       4.290  -3.762   2.175  1.00  0.00           H  
HETATM   31  H   UNL     1       4.904  -2.176   2.700  1.00  0.00           H  
HETATM   32  H   UNL     1       3.185  -2.371   2.280  1.00  0.00           H  
HETATM   33  H   UNL     1       0.430   0.080  -0.051  1.00  0.00           H  
HETATM   34  H   UNL     1       0.880  -0.322  -1.726  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.038  -2.605  -1.425  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.488  -2.204   0.250  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.494  -0.715  -2.217  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.376  -3.018  -2.153  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.843  -2.807  -0.448  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.904  -1.183  -2.805  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.789  -2.461  -1.937  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.754   0.452  -2.049  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.486  -1.014  -1.352  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.615   1.423   0.264  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.531   1.934  -1.224  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.391   0.502  -0.609  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.476   2.885   1.065  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.148   2.561   0.548  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.766   1.776   2.869  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.112   0.410   1.781  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.336   1.331   2.655  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.196  -0.101   3.270  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.251  -1.052   0.981  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.579  -0.728   1.498  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.373   0.884  -1.682  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.869   1.126   0.010  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.285  -0.634   0.732  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.435   0.650  -0.162  1.00  0.00           H  
HETATM   59  H   UNL     1       2.239   1.305  -0.805  1.00  0.00           H  
HETATM   60  H   UNL     1       6.963   2.608   0.154  1.00  0.00           H  
HETATM   61  H   UNL     1       8.626   0.881   1.015  1.00  0.00           H  
HETATM   62  H   UNL     1       7.363  -1.389   1.219  1.00  0.00           H  
CONECT    1    2   30   31   32                                       
CONECT    2    3    1                                                 
CONECT    3    4    4   29    2                                       
CONECT    4   22    5    3    3                                       
CONECT    5    6    6    4    7                                       
CONECT    6    5    5                                                 
CONECT    7    5    8   33   34                                       
CONECT    8    7    9   35   36                                       
CONECT    9    8   21   10   37                                       
CONECT   10    9   11   38   39                                       
CONECT   11   10   12   40   41                                       
CONECT   12   20   11   13                                            
CONECT   13   12   14   42   43                                       
CONECT   14   19   13   15   44                                       
CONECT   15   14   16   45   46                                       
CONECT   16   17   15   47   48                                       
CONECT   17   18   16   49   50                                       
CONECT   18   19   17   51   52                                       
CONECT   19   18   14   53   54                                       
CONECT   20   21   12   55   56                                       
CONECT   21    9   20   57   58                                       
CONECT   22   23   23    4   59                                       
CONECT   23   24   22   22   25                                       
CONECT   24   23                                                      
CONECT   25   23   26   29   29                                       
CONECT   26   25   27   60                                            
CONECT   27   26   28   28   61                                       
CONECT   28   29   27   27   62                                       
CONECT   29   25   25    3   28                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
