COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.064   2.108   0.273  1.00  0.00           C  
HETATM    2  N   UNL     1      -3.801  -0.236  -0.683  1.00  0.00           N  
HETATM    3  C   UNL     1      -5.023  -0.808  -0.321  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.338   1.212  -1.446  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.660   0.063  -1.022  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.170  -0.156  -1.073  1.00  0.00           C  
HETATM    7  C   UNL     1       4.019   0.606  -0.972  1.00  0.00           C  
HETATM    8  C   UNL     1       4.706   0.832   0.377  1.00  0.00           C  
HETATM    9  C   UNL     1       6.155   0.429   0.279  1.00  0.00           C  
HETATM   10  C   UNL     1       7.148   1.358   0.526  1.00  0.00           C  
HETATM   11  C   UNL     1       8.477   0.989   0.437  1.00  0.00           C  
HETATM   12  C   UNL     1       2.526   0.354   1.497  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.579  -0.816  -0.558  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.283  -2.716   0.056  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.409  -1.990   0.386  1.00  0.00           C  
HETATM   16  N   UNL     1      -6.041   1.365  -0.027  1.00  0.00           N  
HETATM   17  C   UNL     1      -6.116   0.014  -0.002  1.00  0.00           C  
HETATM   18  C   UNL     1       0.462   0.334   0.232  1.00  0.00           C  
HETATM   19  C   UNL     1       2.535   0.960  -0.850  1.00  0.00           C  
HETATM   20  C   UNL     1       8.813  -0.311   0.100  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.618   1.033  -1.246  1.00  0.00           N  
HETATM   22  C   UNL     1       7.818  -1.240  -0.147  1.00  0.00           C  
HETATM   23 CL   UNL     1      10.482  -0.774  -0.019  1.00  0.00          Cl  
HETATM   24  C   UNL     1       6.489  -0.871  -0.052  1.00  0.00           C  
HETATM   25  C   UNL     1       4.010  -0.017   1.444  1.00  0.00           C  
HETATM   26  N   UNL     1       1.914   0.120   0.182  1.00  0.00           N  
HETATM   27  N   UNL     1      -5.152  -2.121  -0.280  1.00  0.00           N  
HETATM   28  C   UNL     1      -7.336  -0.598   0.360  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.476   0.268   0.693  1.00  0.00           C  
HETATM   30  O   UNL     1      -9.554  -0.198   1.012  1.00  0.00           O  
HETATM   31  N   UNL     1      -8.275   1.607   0.631  1.00  0.00           N  
HETATM   32  H   UNL     1      -6.944   3.181   0.240  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.882   2.095  -1.869  1.00  0.00           H  
HETATM   34  H   UNL     1       0.036  -1.219  -1.200  1.00  0.00           H  
HETATM   35  H   UNL     1       0.250   0.399  -1.911  1.00  0.00           H  
HETATM   36  H   UNL     1       4.483   1.240  -1.728  1.00  0.00           H  
HETATM   37  H   UNL     1       4.122  -0.440  -1.263  1.00  0.00           H  
HETATM   38  H   UNL     1       4.638   1.886   0.649  1.00  0.00           H  
HETATM   39  H   UNL     1       6.886   2.372   0.789  1.00  0.00           H  
HETATM   40  H   UNL     1       9.254   1.714   0.629  1.00  0.00           H  
HETATM   41  H   UNL     1       2.024  -0.259   2.245  1.00  0.00           H  
HETATM   42  H   UNL     1       2.424   1.407   1.762  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.376  -1.799  -0.161  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.326  -3.795   0.074  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.327  -2.490   0.658  1.00  0.00           H  
HETATM   46  H   UNL     1       0.255   1.396   0.359  1.00  0.00           H  
HETATM   47  H   UNL     1       0.041  -0.221   1.070  1.00  0.00           H  
HETATM   48  H   UNL     1       2.434   2.009  -0.574  1.00  0.00           H  
HETATM   49  H   UNL     1       2.040   0.786  -1.805  1.00  0.00           H  
HETATM   50  H   UNL     1       8.079  -2.254  -0.410  1.00  0.00           H  
HETATM   51  H   UNL     1       5.712  -1.596  -0.244  1.00  0.00           H  
HETATM   52  H   UNL     1       4.112  -1.073   1.193  1.00  0.00           H  
HETATM   53  H   UNL     1       4.467   0.172   2.415  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.001   2.212   0.848  1.00  0.00           H  
CONECT    1   16   16   31   32                                       
CONECT    2   13   21    3                                            
CONECT    3    2   17   17   27                                       
CONECT    4    5   21   21   33                                       
CONECT    5    6    4   13   13                                       
CONECT    6   18    5   34   35                                       
CONECT    7    8   19   36   37                                       
CONECT    8    9   25    7   38                                       
CONECT    9   24   24   10    8                                       
CONECT   10   11   11    9   39                                       
CONECT   11   20   10   10   40                                       
CONECT   12   25   26   41   42                                       
CONECT   13    5    5    2   43                                       
CONECT   14   27   27   15   44                                       
CONECT   15   28   28   14   45                                       
CONECT   16    1    1   17                                            
CONECT   17   16    3    3   28                                       
CONECT   18   26    6   46   47                                       
CONECT   19    7   26   48   49                                       
CONECT   20   23   22   22   11                                       
CONECT   21    4    4    2                                            
CONECT   22   20   20   24   50                                       
CONECT   23   20                                                      
CONECT   24   22    9    9   51                                       
CONECT   25    8   12   52   53                                       
CONECT   26   12   19   18                                            
CONECT   27    3   14   14                                            
CONECT   28   17   29   15   15                                       
CONECT   29   31   28   30   30                                       
CONECT   30   29   29                                                 
CONECT   31    1   29   54                                            
CONECT   32    1                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
