COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.196  -0.341  -0.292  1.00  0.00           C  
HETATM    2  C   UNL     1       3.816  -1.315  -1.196  1.00  0.00           C  
HETATM    3  C   UNL     1       5.125  -2.929  -0.005  1.00  0.00           C  
HETATM    4  C   UNL     1       5.040  -0.660   0.755  1.00  0.00           C  
HETATM    5  C   UNL     1       4.883   2.018  -0.627  1.00  0.00           C  
HETATM    6  C   UNL     1       5.609   1.689  -1.933  1.00  0.00           C  
HETATM    7  C   UNL     1       4.381   3.463  -0.672  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.224   2.004  -0.402  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.965   0.786   0.223  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.869  -0.257   0.101  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.024  -0.088  -0.640  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.282   1.121  -1.259  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.382   2.165  -1.145  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.004  -1.225  -0.773  1.00  0.00           C  
HETATM   15  C   UNL     1       0.784   1.821   1.931  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.313   2.753   1.403  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.120   2.029   0.330  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.224   1.616  -0.833  1.00  0.00           C  
HETATM   19  C   UNL     1       0.873   0.675  -0.324  1.00  0.00           C  
HETATM   20  N   UNL     1       1.572   1.327   0.793  1.00  0.00           N  
HETATM   21  C   UNL     1       2.912   1.468   0.774  1.00  0.00           C  
HETATM   22  O   UNL     1       3.488   1.915   1.743  1.00  0.00           O  
HETATM   23  C   UNL     1       3.694   1.071  -0.452  1.00  0.00           C  
HETATM   24  C   UNL     1       4.280  -2.609  -1.053  1.00  0.00           C  
HETATM   25  C   UNL     1       5.506  -1.953   0.898  1.00  0.00           C  
HETATM   26 CL   UNL     1       5.708  -4.554   0.175  1.00  0.00          Cl  
HETATM   27  O   UNL     1      -2.193   2.860  -0.136  1.00  0.00           O  
HETATM   28  O   UNL     1      -1.772   0.878   0.881  1.00  0.00           O  
HETATM   29  C   UNL     1      -7.027  -1.152   0.363  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.007  -2.289   0.230  1.00  0.00           C  
HETATM   31  O   UNL     1      -9.000  -2.427   1.123  1.00  0.00           O  
HETATM   32  O   UNL     1      -7.899  -3.076  -0.680  1.00  0.00           O  
HETATM   33  H   UNL     1       3.156  -1.066  -2.014  1.00  0.00           H  
HETATM   34  H   UNL     1       5.336   0.102   1.461  1.00  0.00           H  
HETATM   35  H   UNL     1       5.569   1.898   0.211  1.00  0.00           H  
HETATM   36  H   UNL     1       6.456   2.364  -2.057  1.00  0.00           H  
HETATM   37  H   UNL     1       5.966   0.660  -1.900  1.00  0.00           H  
HETATM   38  H   UNL     1       4.922   1.809  -2.771  1.00  0.00           H  
HETATM   39  H   UNL     1       3.764   3.606  -1.560  1.00  0.00           H  
HETATM   40  H   UNL     1       3.789   3.671   0.219  1.00  0.00           H  
HETATM   41  H   UNL     1       5.233   4.142  -0.709  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.671  -1.202   0.584  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.186   1.249  -1.836  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.584   3.107  -1.633  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.520  -1.150  -1.730  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.470  -2.173  -0.721  1.00  0.00           H  
HETATM   47  H   UNL     1       1.433   2.371   2.613  1.00  0.00           H  
HETATM   48  H   UNL     1       0.332   0.980   2.455  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.973   3.038   2.223  1.00  0.00           H  
HETATM   50  H   UNL     1       0.142   3.645   0.975  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.821   1.104  -1.588  1.00  0.00           H  
HETATM   52  H   UNL     1       0.232   2.503  -1.273  1.00  0.00           H  
HETATM   53  H   UNL     1       0.424  -0.257   0.020  1.00  0.00           H  
HETATM   54  H   UNL     1       1.579   0.467  -1.128  1.00  0.00           H  
HETATM   55  H   UNL     1       3.050   1.131  -1.329  1.00  0.00           H  
HETATM   56  H   UNL     1       3.983  -3.371  -1.759  1.00  0.00           H  
HETATM   57  H   UNL     1       6.165  -2.202   1.717  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.511  -1.227   1.321  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.561  -0.204   0.311  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.604  -3.171   0.996  1.00  0.00           H  
CONECT    1   23    4    4    2                                       
CONECT    2    1   24   24   33                                       
CONECT    3   25   25   24   26                                       
CONECT    4    1    1   25   34                                       
CONECT    5    6   23    7   35                                       
CONECT    6    5   36   37   38                                       
CONECT    7    5   39   40   41                                       
CONECT    8    9    9   27   13                                       
CONECT    9   10   28    8    8                                       
CONECT   10   11   11    9   42                                       
CONECT   11   14   10   10   12                                       
CONECT   12   11   13   13   43                                       
CONECT   13   12   12    8   44                                       
CONECT   14   11   29   45   46                                       
CONECT   15   16   20   47   48                                       
CONECT   16   15   17   49   50                                       
CONECT   17   16   28   27   18                                       
CONECT   18   17   19   51   52                                       
CONECT   19   20   18   53   54                                       
CONECT   20   15   21   19                                            
CONECT   21   23   20   22   22                                       
CONECT   22   21   21                                                 
CONECT   23    5   21    1   55                                       
CONECT   24    2    2    3   56                                       
CONECT   25    4    3    3   57                                       
CONECT   26    3                                                      
CONECT   27   17    8                                                 
CONECT   28    9   17                                                 
CONECT   29   14   30   58   59                                       
CONECT   30   32   32   29   31                                       
CONECT   31   30   60                                                 
CONECT   32   30   30                                                 
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   31                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
