COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.160  -1.656   1.977  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.929  -2.776   1.722  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.932  -2.724   0.771  1.00  0.00           C  
HETATM    4 CL   UNL     1      -6.898  -4.130   0.450  1.00  0.00          Cl  
HETATM    5  C   UNL     1      -6.165  -1.551   0.075  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.394  -0.431   0.331  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.392  -0.484   1.282  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.554   0.736   1.562  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.382   0.735   0.683  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.462   1.762   0.757  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.537   2.783   1.574  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.468   3.596   1.379  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.031   4.802   1.950  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.761   5.416   2.955  1.00  0.00           N  
HETATM   15  N   UNL     1       1.100   5.340   1.504  1.00  0.00           N  
HETATM   16  C   UNL     1       1.802   4.762   0.548  1.00  0.00           C  
HETATM   17  N   UNL     1       1.430   3.631  -0.016  1.00  0.00           N  
HETATM   18  C   UNL     1       0.314   3.020   0.364  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.332   1.863  -0.006  1.00  0.00           N  
HETATM   20  C   UNL     1       0.109   0.914  -1.032  1.00  0.00           C  
HETATM   21  O   UNL     1       1.527   0.670  -0.915  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.072   1.524  -2.441  1.00  0.00           C  
HETATM   23  O   UNL     1      -1.281   1.052  -3.039  1.00  0.00           O  
HETATM   24  C   UNL     1       1.156   1.016  -3.229  1.00  0.00           C  
HETATM   25  O   UNL     1       0.744   0.216  -4.339  1.00  0.00           O  
HETATM   26  C   UNL     1       1.934   0.161  -2.204  1.00  0.00           C  
HETATM   27  C   UNL     1       3.441   0.339  -2.396  1.00  0.00           C  
HETATM   28  O   UNL     1       4.141  -0.492  -1.468  1.00  0.00           O  
HETATM   29  C   UNL     1       5.564  -0.401  -1.564  1.00  0.00           C  
HETATM   30  C   UNL     1       6.195  -1.314  -0.544  1.00  0.00           C  
HETATM   31  C   UNL     1       6.487  -2.624  -0.881  1.00  0.00           C  
HETATM   32  C   UNL     1       7.066  -3.465   0.047  1.00  0.00           C  
HETATM   33  C   UNL     1       7.357  -2.992   1.328  1.00  0.00           C  
HETATM   34  C   UNL     1       7.957  -3.859   2.296  1.00  0.00           C  
HETATM   35  N   UNL     1       8.434  -4.547   3.065  1.00  0.00           N  
HETATM   36  C   UNL     1       7.060  -1.668   1.661  1.00  0.00           C  
HETATM   37  C   UNL     1       6.486  -0.837   0.721  1.00  0.00           C  
HETATM   38 CL   UNL     1      -7.422  -1.484  -1.120  1.00  0.00          Cl  
HETATM   39  H   UNL     1      -3.380  -1.696   2.723  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.747  -3.691   2.265  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.575   0.485  -0.212  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.145   1.634   1.378  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.228   0.723   2.602  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.252   0.013   0.048  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.584   5.013   3.272  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.449   6.249   3.341  1.00  0.00           H  
HETATM   47  H   UNL     1       2.715   5.233   0.215  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.446  -0.020  -0.947  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.072   2.612  -2.389  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.444   1.403  -3.925  1.00  0.00           H  
HETATM   51  H   UNL     1       1.765   1.855  -3.569  1.00  0.00           H  
HETATM   52  H   UNL     1       0.200   0.689  -4.984  1.00  0.00           H  
HETATM   53  H   UNL     1       1.659  -0.890  -2.301  1.00  0.00           H  
HETATM   54  H   UNL     1       3.714   0.057  -3.413  1.00  0.00           H  
HETATM   55  H   UNL     1       3.709   1.381  -2.224  1.00  0.00           H  
HETATM   56  H   UNL     1       5.880  -0.698  -2.563  1.00  0.00           H  
HETATM   57  H   UNL     1       5.875   0.626  -1.374  1.00  0.00           H  
HETATM   58  H   UNL     1       6.262  -2.989  -1.872  1.00  0.00           H  
HETATM   59  H   UNL     1       7.292  -4.488  -0.216  1.00  0.00           H  
HETATM   60  H   UNL     1       7.282  -1.296   2.649  1.00  0.00           H  
HETATM   61  H   UNL     1       6.260   0.188   0.976  1.00  0.00           H  
CONECT    1    2    2    7   39                                       
CONECT    2    1    1    3   40                                       
CONECT    3    2    4    5    5                                       
CONECT    4    3                                                      
CONECT    5    3    3    6   38                                       
CONECT    6    5    7    7   41                                       
CONECT    7    1    6    6    8                                       
CONECT    8    7    9   42   43                                       
CONECT    9    8   10   44                                            
CONECT   10    9   11   11   19                                       
CONECT   11   10   10   12                                            
CONECT   12   11   13   13   18                                       
CONECT   13   12   12   14   15                                       
CONECT   14   13   45   46                                            
CONECT   15   13   16   16                                            
CONECT   16   15   15   17   47                                       
CONECT   17   16   18   18                                            
CONECT   18   12   17   17   19                                       
CONECT   19   10   18   20                                            
CONECT   20   19   21   22   48                                       
CONECT   21   20   26                                                 
CONECT   22   20   23   24   49                                       
CONECT   23   22   50                                                 
CONECT   24   22   25   26   51                                       
CONECT   25   24   52                                                 
CONECT   26   21   24   27   53                                       
CONECT   27   26   28   54   55                                       
CONECT   28   27   29                                                 
CONECT   29   28   30   56   57                                       
CONECT   30   29   31   31   37                                       
CONECT   31   30   30   32   58                                       
CONECT   32   31   33   33   59                                       
CONECT   33   32   32   34   36                                       
CONECT   34   33   35   35   35                                       
CONECT   35   34   34   34                                            
CONECT   36   33   37   37   60                                       
CONECT   37   30   36   36   61                                       
CONECT   38    5                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   16                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
CONECT   60   36                                                      
CONECT   61   37                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
