COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.249   0.334   0.219  1.00  0.00           C  
HETATM    2  N   UNL     1       8.807   0.072   0.332  1.00  0.00           N  
HETATM    3  C   UNL     1       8.030   1.294   0.084  1.00  0.00           C  
HETATM    4  C   UNL     1       6.542   0.999   0.289  1.00  0.00           C  
HETATM    5  C   UNL     1       8.395  -1.005  -0.579  1.00  0.00           C  
HETATM    6  C   UNL     1       6.907  -1.300  -0.374  1.00  0.00           C  
HETATM    7  N   UNL     1       6.129  -0.078  -0.622  1.00  0.00           N  
HETATM    8  C   UNL     1       4.756  -0.327  -0.515  1.00  0.00           C  
HETATM    9  C   UNL     1       4.167  -1.313  -1.295  1.00  0.00           C  
HETATM   10  C   UNL     1       2.812  -1.559  -1.190  1.00  0.00           C  
HETATM   11  C   UNL     1       3.985   0.407   0.376  1.00  0.00           C  
HETATM   12  C   UNL     1       2.630   0.161   0.482  1.00  0.00           C  
HETATM   13  C   UNL     1       2.039  -0.821  -0.303  1.00  0.00           C  
HETATM   14  N   UNL     1       0.665  -1.070  -0.196  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.208  -0.031   0.083  1.00  0.00           C  
HETATM   16  N   UNL     1       0.261   1.207   0.146  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.543   2.227   0.410  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.888   1.991   0.620  1.00  0.00           C  
HETATM   19 CL   UNL     1      -2.976   3.299   0.968  1.00  0.00          Cl  
HETATM   20  C   UNL     1      -2.353   0.675   0.547  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.694   0.390   0.751  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.129  -0.939   0.798  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.231  -1.954   1.098  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.662  -3.266   1.144  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.987  -3.572   0.891  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.887  -2.566   0.591  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.464  -1.247   0.549  1.00  0.00           C  
HETATM   28  O   UNL     1      -6.349  -0.257   0.254  1.00  0.00           O  
HETATM   29  C   UNL     1      -6.386   0.169  -1.024  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.234   1.312  -1.393  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.271   1.733  -2.655  1.00  0.00           C  
HETATM   32  O   UNL     1      -5.720  -0.391  -1.872  1.00  0.00           O  
HETATM   33  N   UNL     1      -1.491  -0.299   0.274  1.00  0.00           N  
HETATM   34  H   UNL     1      10.485   0.631  -0.802  1.00  0.00           H  
HETATM   35  H   UNL     1      10.527   1.135   0.904  1.00  0.00           H  
HETATM   36  H   UNL     1      10.803  -0.570   0.473  1.00  0.00           H  
HETATM   37  H   UNL     1       8.344   2.073   0.779  1.00  0.00           H  
HETATM   38  H   UNL     1       8.196   1.630  -0.939  1.00  0.00           H  
HETATM   39  H   UNL     1       6.371   0.689   1.319  1.00  0.00           H  
HETATM   40  H   UNL     1       5.960   1.896   0.077  1.00  0.00           H  
HETATM   41  H   UNL     1       8.566  -0.695  -1.610  1.00  0.00           H  
HETATM   42  H   UNL     1       8.976  -1.902  -0.367  1.00  0.00           H  
HETATM   43  H   UNL     1       6.593  -2.079  -1.069  1.00  0.00           H  
HETATM   44  H   UNL     1       6.740  -1.636   0.649  1.00  0.00           H  
HETATM   45  H   UNL     1       4.767  -1.887  -1.985  1.00  0.00           H  
HETATM   46  H   UNL     1       2.353  -2.325  -1.797  1.00  0.00           H  
HETATM   47  H   UNL     1       4.444   1.170   0.986  1.00  0.00           H  
HETATM   48  H   UNL     1       2.030   0.732   1.175  1.00  0.00           H  
HETATM   49  H   UNL     1       0.325  -1.970  -0.316  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.151   3.232   0.459  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.332   1.113   0.862  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.196  -1.719   1.295  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.963  -4.055   1.377  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.319  -4.599   0.924  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.921  -2.808   0.394  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.826   1.810  -0.640  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.678   1.235  -3.408  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.894   2.572  -2.926  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    1    5    3                                            
CONECT    3    2    4   37   38                                       
CONECT    4    3    7   39   40                                       
CONECT    5    2    6   41   42                                       
CONECT    6    5    7   43   44                                       
CONECT    7    6    4    8                                            
CONECT    8    7    9    9   11                                       
CONECT    9    8    8   10   45                                       
CONECT   10    9   13   13   46                                       
CONECT   11    8   12   12   47                                       
CONECT   12   11   11   13   48                                       
CONECT   13   10   10   12   14                                       
CONECT   14   13   15   49                                            
CONECT   15   14   33   33   16                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   18   50                                       
CONECT   18   20   20   17   19                                       
CONECT   19   18                                                      
CONECT   20   33   21   18   18                                       
CONECT   21   22   20   51                                            
CONECT   22   27   27   23   21                                       
CONECT   23   24   24   22   52                                       
CONECT   24   25   23   23   53                                       
CONECT   25   26   26   24   54                                       
CONECT   26   25   25   27   55                                       
CONECT   27   26   28   22   22                                       
CONECT   28   29   27                                                 
CONECT   29   32   32   30   28                                       
CONECT   30   29   31   31   56                                       
CONECT   31   30   30   57   58                                       
CONECT   32   29   29                                                 
CONECT   33   15   15   20                                            
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   14                                                      
CONECT   50   17                                                      
CONECT   51   21                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
