COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.232  -0.392   0.405  1.00  0.00           N  
HETATM    2  C   UNL     1      -8.377  -0.340  -1.243  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.680  -0.980  -0.219  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.216  -0.789  -0.094  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.514  -1.427   0.928  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.153  -1.250   1.045  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.013  -0.243   0.264  1.00  0.00           C  
HETATM    8  C   UNL     1       1.163  -2.016  -0.357  1.00  0.00           C  
HETATM    9  C   UNL     1       5.177  -1.442   0.016  1.00  0.00           C  
HETATM   10  C   UNL     1       7.594  -2.053  -0.147  1.00  0.00           C  
HETATM   11  N   UNL     1       2.451  -1.764  -0.212  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.152  -1.238  -0.115  1.00  0.00           C  
HETATM   13  C   UNL     1      -9.619  -1.955   0.569  1.00  0.00           C  
HETATM   14  C   UNL     1       9.305  -0.471  -0.810  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.231   1.899   1.142  1.00  0.00           O  
HETATM   16  C   UNL     1     -10.373  -1.344  -0.415  1.00  0.00           C  
HETATM   17  C   UNL     1       6.608  -0.956   0.259  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.476  -0.432   0.139  1.00  0.00           C  
HETATM   19  C   UNL     1       0.240  -1.028   0.016  1.00  0.00           C  
HETATM   20  C   UNL     1       2.874  -0.603   0.275  1.00  0.00           C  
HETATM   21  C   UNL     1     -10.297  -2.845   1.579  1.00  0.00           C  
HETATM   22  O   UNL     1      11.637  -1.069  -0.615  1.00  0.00           O  
HETATM   23  C   UNL     1      -9.744  -0.525  -1.344  1.00  0.00           C  
HETATM   24  C   UNL     1      10.720   0.021  -0.492  1.00  0.00           C  
HETATM   25  C   UNL     1      11.339  -2.172   0.244  1.00  0.00           C  
HETATM   26  C   UNL     1       9.931  -2.687  -0.066  1.00  0.00           C  
HETATM   27  C   UNL     1       0.728   0.194   0.529  1.00  0.00           C  
HETATM   28  C   UNL     1       0.383   2.447   1.436  1.00  0.00           C  
HETATM   29  C   UNL     1       0.608   3.430   0.286  1.00  0.00           C  
HETATM   30  C   UNL     1       1.156   4.746   0.840  1.00  0.00           C  
HETATM   31  C   UNL     1       1.381   5.729  -0.311  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.473   1.010   0.798  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.178   0.206  -0.885  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.539   0.024  -1.004  1.00  0.00           C  
HETATM   35  N   UNL     1       8.968  -1.587   0.086  1.00  0.00           N  
HETATM   36  N   UNL     1       2.041   0.359   0.640  1.00  0.00           N  
HETATM   37  N   UNL     1      -0.142   1.186   0.905  1.00  0.00           N  
HETATM   38  N   UNL     1       1.907   6.994   0.222  1.00  0.00           N  
HETATM   39  N   UNL     1      -8.318  -1.759   0.646  1.00  0.00           N  
HETATM   40 CL   UNL     1      -3.337   1.224  -2.013  1.00  0.00          Cl  
HETATM   41  H   UNL     1       4.561   0.449   0.759  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.857   0.294  -1.946  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.038  -2.059   1.630  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.610  -1.744   1.837  1.00  0.00           H  
HETATM   45  H   UNL     1       0.827  -2.963  -0.754  1.00  0.00           H  
HETATM   46  H   UNL     1       4.991  -2.337   0.609  1.00  0.00           H  
HETATM   47  H   UNL     1       5.047  -1.674  -1.041  1.00  0.00           H  
HETATM   48  H   UNL     1       7.408  -2.948   0.446  1.00  0.00           H  
HETATM   49  H   UNL     1       7.464  -2.284  -1.205  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.530  -2.171  -0.508  1.00  0.00           H  
HETATM   51  H   UNL     1       8.595   0.342  -0.662  1.00  0.00           H  
HETATM   52  H   UNL     1       9.261  -0.809  -1.845  1.00  0.00           H  
HETATM   53  H   UNL     1     -11.438  -1.511  -0.469  1.00  0.00           H  
HETATM   54  H   UNL     1       6.793  -0.062  -0.334  1.00  0.00           H  
HETATM   55  H   UNL     1       6.737  -0.725   1.316  1.00  0.00           H  
HETATM   56  H   UNL     1     -10.314  -3.869   1.207  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.749  -2.809   2.521  1.00  0.00           H  
HETATM   58  H   UNL     1     -11.318  -2.500   1.740  1.00  0.00           H  
HETATM   59  H   UNL     1     -10.311  -0.042  -2.126  1.00  0.00           H  
HETATM   60  H   UNL     1      10.996   0.810  -1.192  1.00  0.00           H  
HETATM   61  H   UNL     1      10.750   0.410   0.526  1.00  0.00           H  
HETATM   62  H   UNL     1      12.063  -2.970   0.077  1.00  0.00           H  
HETATM   63  H   UNL     1      11.387  -1.848   1.283  1.00  0.00           H  
HETATM   64  H   UNL     1       9.897  -3.061  -1.089  1.00  0.00           H  
HETATM   65  H   UNL     1       9.677  -3.491   0.625  1.00  0.00           H  
HETATM   66  H   UNL     1       1.328   2.261   1.946  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.333   2.870   2.141  1.00  0.00           H  
HETATM   68  H   UNL     1       1.324   3.006  -0.419  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.337   3.615  -0.224  1.00  0.00           H  
HETATM   70  H   UNL     1       0.440   5.170   1.544  1.00  0.00           H  
HETATM   71  H   UNL     1       2.101   4.561   1.350  1.00  0.00           H  
HETATM   72  H   UNL     1       2.097   5.306  -1.015  1.00  0.00           H  
HETATM   73  H   UNL     1       0.436   5.915  -0.821  1.00  0.00           H  
HETATM   74  H   UNL     1      -6.082   0.515  -1.798  1.00  0.00           H  
HETATM   75  H   UNL     1       2.065   7.660  -0.519  1.00  0.00           H  
HETATM   76  H   UNL     1       1.292   7.374   0.925  1.00  0.00           H  
CONECT    1   20    9   41                                            
CONECT    2   23   23    3   42                                       
CONECT    3    2    4   39   39                                       
CONECT    4    3    5    5   34                                       
CONECT    5    4    4    6   43                                       
CONECT    6    5   18   18   44                                       
CONECT    7   18   12   12   32                                       
CONECT    8   19   19   11   45                                       
CONECT    9    1   17   46   47                                       
CONECT   10   17   35   48   49                                       
CONECT   11    8   20   20                                            
CONECT   12    7    7   19   50                                       
CONECT   13   21   16   16   39                                       
CONECT   14   35   24   51   52                                       
CONECT   15   32   32                                                 
CONECT   16   13   13   23   53                                       
CONECT   17    9   10   54   55                                       
CONECT   18    6    6    7   33                                       
CONECT   19   12    8    8   27                                       
CONECT   20   11   11    1   36                                       
CONECT   21   13   56   57   58                                       
CONECT   22   24   25                                                 
CONECT   23   16    2    2   59                                       
CONECT   24   14   22   60   61                                       
CONECT   25   22   26   62   63                                       
CONECT   26   25   35   64   65                                       
CONECT   27   36   36   19   37                                       
CONECT   28   37   29   66   67                                       
CONECT   29   28   30   68   69                                       
CONECT   30   29   31   70   71                                       
CONECT   31   30   38   72   73                                       
CONECT   32   37    7   15   15                                       
CONECT   33   18   40   34   34                                       
CONECT   34   33   33    4   74                                       
CONECT   35   10   14   26                                            
CONECT   36   20   27   27                                            
CONECT   37   27   28   32                                            
CONECT   38   31   75   76                                            
CONECT   39    3    3   13                                            
CONECT   40   33                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   12                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   25                                                      
CONECT   64   26                                                      
CONECT   65   26                                                      
CONECT   66   28                                                      
CONECT   67   28                                                      
CONECT   68   29                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   31                                                      
CONECT   74   34                                                      
CONECT   75   38                                                      
CONECT   76   38                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
