COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.992  -0.948   2.521  1.00  0.00           C  
HETATM    2  N   UNL     1       3.492  -1.608   1.374  1.00  0.00           N  
HETATM    3  C   UNL     1       4.542  -1.503   0.374  1.00  0.00           C  
HETATM    4  C   UNL     1       5.294  -0.246   0.864  1.00  0.00           C  
HETATM    5  N   UNL     1       5.036  -0.194   2.333  1.00  0.00           N  
HETATM    6  C   UNL     1       5.380  -2.768   0.248  1.00  0.00           C  
HETATM    7  C   UNL     1       6.022  -3.052  -0.953  1.00  0.00           C  
HETATM    8  C   UNL     1       6.791  -4.210  -1.069  1.00  0.00           C  
HETATM    9  C   UNL     1       6.913  -5.078   0.017  1.00  0.00           C  
HETATM   10  C   UNL     1       6.266  -4.788   1.218  1.00  0.00           C  
HETATM   11  C   UNL     1       5.497  -3.629   1.334  1.00  0.00           C  
HETATM   12 CL   UNL     1       7.860  -6.508  -0.126  1.00  0.00          Cl  
HETATM   13  C   UNL     1       7.741  -0.674   1.282  1.00  0.00           C  
HETATM   14  C   UNL     1       9.082  -0.574   0.910  1.00  0.00           C  
HETATM   15  C   UNL     1       9.430   0.061  -0.282  1.00  0.00           C  
HETATM   16  C   UNL     1       8.437   0.597  -1.102  1.00  0.00           C  
HETATM   17  C   UNL     1       7.096   0.498  -0.731  1.00  0.00           C  
HETATM   18  C   UNL     1       6.747  -0.138   0.462  1.00  0.00           C  
HETATM   19 CL   UNL     1      11.084   0.185  -0.740  1.00  0.00          Cl  
HETATM   20  C   UNL     1       3.266  -2.376   5.939  1.00  0.00           C  
HETATM   21  C   UNL     1       3.834  -2.199   4.677  1.00  0.00           C  
HETATM   22  C   UNL     1       3.407  -1.153   3.854  1.00  0.00           C  
HETATM   23  C   UNL     1       2.407  -0.285   4.303  1.00  0.00           C  
HETATM   24  C   UNL     1       1.839  -0.462   5.565  1.00  0.00           C  
HETATM   25  C   UNL     1       2.269  -1.507   6.383  1.00  0.00           C  
HETATM   26  O   UNL     1       4.807  -3.057   4.262  1.00  0.00           O  
HETATM   27  C   UNL     1       5.637  -3.632   5.269  1.00  0.00           C  
HETATM   28  C   UNL     1       5.474  -5.144   5.251  1.00  0.00           C  
HETATM   29  C   UNL     1       7.080  -3.215   5.027  1.00  0.00           C  
HETATM   30  O   UNL     1       1.715  -1.680   7.614  1.00  0.00           O  
HETATM   31  C   UNL     1       2.200  -2.768   8.398  1.00  0.00           C  
HETATM   32  C   UNL     1       2.347  -2.408   1.149  1.00  0.00           C  
HETATM   33  O   UNL     1       2.344  -3.306   0.300  1.00  0.00           O  
HETATM   34  N   UNL     1       1.240  -2.136   1.967  1.00  0.00           N  
HETATM   35  C   UNL     1       0.019  -2.929   1.836  1.00  0.00           C  
HETATM   36  C   UNL     1      -1.148  -2.051   1.392  1.00  0.00           C  
HETATM   37  N   UNL     1      -1.321  -0.915   2.302  1.00  0.00           N  
HETATM   38  C   UNL     1      -0.097  -0.113   2.378  1.00  0.00           C  
HETATM   39  C   UNL     1       1.099  -0.956   2.827  1.00  0.00           C  
HETATM   40  H   UNL     1       4.087  -1.332  -0.609  1.00  0.00           H  
HETATM   41  H   UNL     1       4.804   0.641   0.440  1.00  0.00           H  
HETATM   42  H   UNL     1       5.933  -2.382  -1.804  1.00  0.00           H  
HETATM   43  H   UNL     1       7.290  -4.424  -2.011  1.00  0.00           H  
HETATM   44  H   UNL     1       6.352  -5.455   2.072  1.00  0.00           H  
HETATM   45  H   UNL     1       4.997  -3.411   2.273  1.00  0.00           H  
HETATM   46  H   UNL     1       7.480  -1.170   2.212  1.00  0.00           H  
HETATM   47  H   UNL     1       9.845  -0.996   1.559  1.00  0.00           H  
HETATM   48  H   UNL     1       8.693   1.095  -2.034  1.00  0.00           H  
HETATM   49  H   UNL     1       6.330   0.918  -1.376  1.00  0.00           H  
HETATM   50  H   UNL     1       3.600  -3.190   6.577  1.00  0.00           H  
HETATM   51  H   UNL     1       2.065   0.533   3.675  1.00  0.00           H  
HETATM   52  H   UNL     1       1.063   0.218   5.905  1.00  0.00           H  
HETATM   53  H   UNL     1       5.301  -3.239   6.234  1.00  0.00           H  
HETATM   54  H   UNL     1       6.076  -5.618   6.032  1.00  0.00           H  
HETATM   55  H   UNL     1       4.424  -5.415   5.404  1.00  0.00           H  
HETATM   56  H   UNL     1       5.768  -5.561   4.281  1.00  0.00           H  
HETATM   57  H   UNL     1       7.744  -3.615   5.799  1.00  0.00           H  
HETATM   58  H   UNL     1       7.166  -2.123   5.023  1.00  0.00           H  
HETATM   59  H   UNL     1       7.431  -3.561   4.048  1.00  0.00           H  
HETATM   60  H   UNL     1       3.284  -2.682   8.511  1.00  0.00           H  
HETATM   61  H   UNL     1       1.949  -3.712   7.908  1.00  0.00           H  
HETATM   62  H   UNL     1       1.729  -2.735   9.383  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.187  -3.373   2.818  1.00  0.00           H  
HETATM   64  H   UNL     1       0.162  -3.752   1.129  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.982  -1.687   0.370  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.067  -2.645   1.382  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.088  -0.331   1.969  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.250   0.707   3.089  1.00  0.00           H  
HETATM   69  H   UNL     1       0.107   0.339   1.400  1.00  0.00           H  
HETATM   70  H   UNL     1       1.992  -0.328   2.795  1.00  0.00           H  
HETATM   71  H   UNL     1       0.958  -1.308   3.855  1.00  0.00           H  
CONECT    1    2    5    5   22                                       
CONECT    2    1    3   32                                            
CONECT    3    2    4    6   40                                       
CONECT    4    3    5   18   41                                       
CONECT    5    1    1    4                                            
CONECT    6    3    7   11   11                                       
CONECT    7    6    8    8   42                                       
CONECT    8    7    7    9   43                                       
CONECT    9    8   10   10   12                                       
CONECT   10    9    9   11   44                                       
CONECT   11    6    6   10   45                                       
CONECT   12    9                                                      
CONECT   13   14   18   18   46                                       
CONECT   14   13   15   15   47                                       
CONECT   15   14   14   16   19                                       
CONECT   16   15   17   17   48                                       
CONECT   17   16   16   18   49                                       
CONECT   18    4   13   13   17                                       
CONECT   19   15                                                      
CONECT   20   21   21   25   50                                       
CONECT   21   20   20   22   26                                       
CONECT   22    1   21   23   23                                       
CONECT   23   22   22   24   51                                       
CONECT   24   23   25   25   52                                       
CONECT   25   20   24   24   30                                       
CONECT   26   21   27                                                 
CONECT   27   26   28   29   53                                       
CONECT   28   27   54   55   56                                       
CONECT   29   27   57   58   59                                       
CONECT   30   25   31                                                 
CONECT   31   30   60   61   62                                       
CONECT   32    2   33   33   34                                       
CONECT   33   32   32                                                 
CONECT   34   32   35   39                                            
CONECT   35   34   36   63   64                                       
CONECT   36   35   37   65   66                                       
CONECT   37   36   38   67                                            
CONECT   38   37   39   68   69                                       
CONECT   39   34   38   70   71                                       
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   20                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   31                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   35                                                      
CONECT   64   35                                                      
CONECT   65   36                                                      
CONECT   66   36                                                      
CONECT   67   37                                                      
CONECT   68   38                                                      
CONECT   69   38                                                      
CONECT   70   39                                                      
CONECT   71   39                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
