COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.354   2.341  -5.680  1.00  0.00           C  
HETATM    2  C   UNL     1       0.993   1.385  -4.541  1.00  0.00           C  
HETATM    3  C   UNL     1       0.707  -0.101   0.289  1.00  0.00           C  
HETATM    4  C   UNL     1       1.318   1.141   0.339  1.00  0.00           C  
HETATM    5  C   UNL     1       1.555   1.849  -0.850  1.00  0.00           C  
HETATM    6  C   UNL     1       2.202   3.168  -0.810  1.00  0.00           C  
HETATM    7  C   UNL     1       2.950   1.443   1.971  1.00  0.00           C  
HETATM    8  C   UNL     1       3.342   1.889   3.225  1.00  0.00           C  
HETATM    9  C   UNL     1       4.628   1.654   3.670  1.00  0.00           C  
HETATM   10  C   UNL     1       3.850   0.759   1.168  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.331  -1.999  -0.964  1.00  0.00           C  
HETATM   12  C   UNL     1       0.701  -3.072  -0.729  1.00  0.00           C  
HETATM   13  C   UNL     1       2.076  -4.845  -1.564  1.00  0.00           C  
HETATM   14  C   UNL     1       1.215  -3.270   0.538  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.893  -3.496   1.354  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.003  -2.456   1.178  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.374  -1.066   1.048  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.402  -1.060  -0.134  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.597   0.949   1.717  1.00  0.00           C  
HETATM   20  C   UNL     1       2.586  -5.047  -0.296  1.00  0.00           C  
HETATM   21  C   UNL     1       2.158  -4.257   0.755  1.00  0.00           C  
HETATM   22  C   UNL     1       1.129  -3.861  -1.780  1.00  0.00           C  
HETATM   23  C   UNL     1       5.527   0.977   2.866  1.00  0.00           C  
HETATM   24  C   UNL     1       0.559   0.040  -2.102  1.00  0.00           C  
HETATM   25  C   UNL     1       0.332  -0.646  -0.925  1.00  0.00           C  
HETATM   26  C   UNL     1       1.169   1.286  -2.078  1.00  0.00           C  
HETATM   27  C   UNL     1       5.137   0.526   1.617  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.567   1.865   1.509  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.393   1.745   0.365  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.222  -0.178  -0.257  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.935  -3.419   0.163  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.766   3.000   2.480  1.00  0.00           C  
HETATM   33  N   UNL     1      -6.196   0.722  -0.489  1.00  0.00           N  
HETATM   34  N   UNL     1      -4.426  -0.072   0.822  1.00  0.00           N  
HETATM   35  N   UNL     1      -1.359  -2.071   0.083  1.00  0.00           N  
HETATM   36  N   UNL     1       1.396   1.975  -3.262  1.00  0.00           N  
HETATM   37  O   UNL     1      -7.274   2.559   0.156  1.00  0.00           O  
HETATM   38  O   UNL     1      -5.052  -1.093  -1.039  1.00  0.00           O  
HETATM   39  O   UNL     1       3.412   3.254  -0.879  1.00  0.00           O  
HETATM   40  O   UNL     1       1.453   4.283  -0.696  1.00  0.00           O  
HETATM   41  O   UNL     1       1.684   1.672   1.532  1.00  0.00           O  
HETATM   42 CL   UNL     1       6.267  -0.324   0.610  1.00  0.00          Cl  
HETATM   43  H   UNL     1       1.054   1.902  -6.632  1.00  0.00           H  
HETATM   44  H   UNL     1       0.835   3.289  -5.537  1.00  0.00           H  
HETATM   45  H   UNL     1       2.430   2.512  -5.683  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.084   1.214  -4.539  1.00  0.00           H  
HETATM   47  H   UNL     1       1.511   0.437  -4.684  1.00  0.00           H  
HETATM   48  H   UNL     1       0.529  -0.649   1.203  1.00  0.00           H  
HETATM   49  H   UNL     1       2.641   2.418   3.854  1.00  0.00           H  
HETATM   50  H   UNL     1       4.933   2.001   4.646  1.00  0.00           H  
HETATM   51  H   UNL     1       3.546   0.407   0.193  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.795  -2.148  -1.940  1.00  0.00           H  
HETATM   53  H   UNL     1       2.410  -5.462  -2.385  1.00  0.00           H  
HETATM   54  H   UNL     1       0.881  -2.653   1.360  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.346  -3.292   2.274  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.332  -4.493   1.404  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.575  -2.682   0.278  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.664  -2.479   2.045  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.834  -0.824   1.964  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.945  -1.288  -1.051  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.942  -0.076  -0.220  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.957   1.024   2.584  1.00  0.00           H  
HETATM   63  H   UNL     1       3.326  -5.815  -0.127  1.00  0.00           H  
HETATM   64  H   UNL     1       2.560  -4.412   1.745  1.00  0.00           H  
HETATM   65  H   UNL     1       0.724  -3.709  -2.770  1.00  0.00           H  
HETATM   66  H   UNL     1       6.532   0.795   3.215  1.00  0.00           H  
HETATM   67  H   UNL     1       0.262  -0.396  -3.045  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.136  -4.149   0.292  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.480  -3.636  -0.756  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.155   3.849   2.177  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.817   3.292   2.486  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.473   2.679   3.479  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.758   0.633  -1.275  1.00  0.00           H  
HETATM   74  H   UNL     1       1.822   2.846  -3.243  1.00  0.00           H  
HETATM   75  H   UNL     1       1.923   5.128  -0.674  1.00  0.00           H  
CONECT    1    2   43   44   45                                       
CONECT    2   36    1   46   47                                       
CONECT    3    4    4   25   48                                       
CONECT    4   41    3    3    5                                       
CONECT    5    4    6   26   26                                       
CONECT    6    5   39   39   40                                       
CONECT    7   10   10    8   41                                       
CONECT    8    9    9    7   49                                       
CONECT    9   23    8    8   50                                       
CONECT   10   27    7    7   51                                       
CONECT   11   12   35   25   52                                       
CONECT   12   14   14   22   11                                       
CONECT   13   20   22   22   53                                       
CONECT   14   21   12   12   54                                       
CONECT   15   16   31   55   56                                       
CONECT   16   17   15   57   58                                       
CONECT   17   34   18   16   59                                       
CONECT   18   17   35   60   61                                       
CONECT   19   28   28   34   62                                       
CONECT   20   21   21   13   63                                       
CONECT   21   20   20   14   64                                       
CONECT   22   13   13   12   65                                       
CONECT   23   27   27    9   66                                       
CONECT   24   25   25   26   67                                       
CONECT   25    3   11   24   24                                       
CONECT   26    5    5   24   36                                       
CONECT   27   42   23   23   10                                       
CONECT   28   29   32   19   19                                       
CONECT   29   37   37   33   28                                       
CONECT   30   33   38   38   34                                       
CONECT   31   35   15   68   69                                       
CONECT   32   28   70   71   72                                       
CONECT   33   29   30   73                                            
CONECT   34   30   19   17                                            
CONECT   35   18   11   31                                            
CONECT   36   26    2   74                                            
CONECT   37   29   29                                                 
CONECT   38   30   30                                                 
CONECT   39    6    6                                                 
CONECT   40    6   75                                                 
CONECT   41    7    4                                                 
CONECT   42   27                                                      
CONECT   43    1                                                      
CONECT   44    1                                                      
CONECT   45    1                                                      
CONECT   46    2                                                      
CONECT   47    2                                                      
CONECT   48    3                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   11                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   16                                                      
CONECT   59   17                                                      
CONECT   60   18                                                      
CONECT   61   18                                                      
CONECT   62   19                                                      
CONECT   63   20                                                      
CONECT   64   21                                                      
CONECT   65   22                                                      
CONECT   66   23                                                      
CONECT   67   24                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   32                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   33                                                      
CONECT   74   36                                                      
CONECT   75   40                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
