COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.403   0.443   0.521  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.877   1.342  -0.136  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.247   1.405   0.424  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.569   2.485  -0.611  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.011   2.059   1.786  1.00  0.00           C  
HETATM    6  C   UNL     1       0.463   1.340  -0.569  1.00  0.00           C  
HETATM    7  C   UNL     1       0.518   2.667  -0.974  1.00  0.00           C  
HETATM    8  C   UNL     1       1.732   3.326  -1.025  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.501   0.759   1.301  1.00  0.00           C  
HETATM   10  C   UNL     1       2.895   2.667  -0.673  1.00  0.00           C  
HETATM   11  C   UNL     1       2.846   1.338  -0.266  1.00  0.00           C  
HETATM   12  C   UNL     1       1.629   0.674  -0.215  1.00  0.00           C  
HETATM   13  C1* UNL     1       3.957  -0.688   0.632  1.00  0.00           C  
HETATM   14  C2* UNL     1       5.095  -0.900   1.654  1.00  0.00           C  
HETATM   15  C3* UNL     1       5.542  -2.356   1.353  1.00  0.00           C  
HETATM   16  C4* UNL     1       5.321  -2.420  -0.179  1.00  0.00           C  
HETATM   17  C5* UNL     1       5.104  -3.868  -0.624  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.565  -0.119   1.396  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.539  -1.317   0.713  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.435  -1.642  -0.076  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.366  -0.749  -0.172  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.399  -2.924  -0.811  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.366  -4.226  -0.053  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.397  -2.928  -2.136  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.041   0.680   0.014  1.00  0.00           N  
HETATM   26  N   UNL     1       4.022   0.671   0.089  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.767   0.675  -0.512  1.00  0.00           N  
HETATM   28  O   UNL     1      -1.826   2.539   0.068  1.00  0.00           O  
HETATM   29  O4* UNL     1       4.139  -1.641  -0.421  1.00  0.00           O  
HETATM   30  O2* UNL     1       6.165   0.019   1.422  1.00  0.00           O  
HETATM   31  O3* UNL     1       6.918  -2.551   1.684  1.00  0.00           O  
HETATM   32  O5* UNL     1       5.018  -3.920  -2.050  1.00  0.00           O  
HETATM   33 CL   UNL     1       4.417   3.499  -0.738  1.00  0.00          Cl  
HETATM   34  H   UNL     1      -5.466   3.024  -0.307  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.733   3.181  -0.682  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.737   2.019  -1.582  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.782   1.290   2.524  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.176   2.755   1.716  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.909   2.598   2.091  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.388   3.184  -1.250  1.00  0.00           H  
HETATM   41  H   UNL     1       1.772   4.358  -1.340  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.526   1.696   1.839  1.00  0.00           H  
HETATM   43  H   UNL     1       1.588  -0.358   0.101  1.00  0.00           H  
HETATM   44  H1* UNL     1       2.993  -0.848   1.114  1.00  0.00           H  
HETATM   45  H2* UNL     1       4.722  -0.812   2.675  1.00  0.00           H  
HETATM   46  H3* UNL     1       4.909  -3.076   1.871  1.00  0.00           H  
HETATM   47  H4* UNL     1       6.174  -1.988  -0.703  1.00  0.00           H  
HETATM   48 H5*1 UNL     1       5.939  -4.481  -0.288  1.00  0.00           H  
HETATM   49 H5*2 UNL     1       4.178  -4.246  -0.191  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.419   0.134   2.007  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.370  -2.002   0.788  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.508  -0.996  -0.780  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.255  -4.306   0.572  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.342  -5.057  -0.758  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.476  -4.258   0.576  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.371  -3.865  -2.673  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.421  -1.995  -2.680  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.082  -0.275  -0.148  1.00  0.00           H  
HETATM   59  H   UNL     1       4.880   1.109  -0.023  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.822  -0.266  -0.744  1.00  0.00           H  
HETATM   61  H2* UNL     1       5.912   0.948   1.512  1.00  0.00           H  
HETATM   62  H3* UNL     1       7.122  -2.414   2.619  1.00  0.00           H  
HETATM   63  H5* UNL     1       4.880  -4.810  -2.403  1.00  0.00           H  
CONECT    1    3   21   21    9                                       
CONECT    2   25   27   28   28                                       
CONECT    3    5    1    4   25                                       
CONECT    4    3   34   35   36                                       
CONECT    5    3   37   38   39                                       
CONECT    6   27    7    7   12                                       
CONECT    7    6    6    8   40                                       
CONECT    8    7   10   10   41                                       
CONECT    9    1   18   18   42                                       
CONECT   10    8    8   11   33                                       
CONECT   11   12   12   10   26                                       
CONECT   12    6   11   11   43                                       
CONECT   13   26   14   29   44                                       
CONECT   14   30   13   15   45                                       
CONECT   15   14   31   16   46                                       
CONECT   16   15   29   17   47                                       
CONECT   17   16   32   48   49                                       
CONECT   18    9    9   19   50                                       
CONECT   19   20   20   18   51                                       
CONECT   20   21   22   19   19                                       
CONECT   21    1    1   20   52                                       
CONECT   22   23   20   24   24                                       
CONECT   23   22   53   54   55                                       
CONECT   24   22   22   56   57                                       
CONECT   25    3    2   58                                            
CONECT   26   11   13   59                                            
CONECT   27    2    6   60                                            
CONECT   28    2    2                                                 
CONECT   29   13   16                                                 
CONECT   30   14   61                                                 
CONECT   31   15   62                                                 
CONECT   32   17   63                                                 
CONECT   33   10                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   21                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   32                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
