COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.811   9.687  14.647  1.00  0.00           O  
HETATM    2  O   UNL     1      -3.300   6.716   9.038  1.00  0.00           O  
HETATM    3  O   UNL     1      -6.455  10.341   7.074  1.00  0.00           O  
HETATM    4  O   UNL     1      -8.674  11.712   7.323  1.00  0.00           O  
HETATM    5  O   UNL     1      -7.245  10.622  11.950  1.00  0.00           O  
HETATM    6  O   UNL     1      -4.554  10.673  12.205  1.00  0.00           O  
HETATM    7  O   UNL     1      -8.135  11.796   9.839  1.00  0.00           O  
HETATM    8  O   UNL     1      -6.247  12.695   7.929  1.00  0.00           O  
HETATM    9  V   UNL     1      -5.580   6.878  11.718  1.00  0.00           V  
HETATM   10  V   UNL     1      -7.412   8.125  13.986  1.00  0.00           V  
HETATM   11  V   UNL     1      -4.895   7.032   9.072  1.00  0.00           V  
HETATM   12  V   UNL     1      -5.794   9.785  11.439  1.00  0.00           V  
HETATM   13  V   UNL     1      -6.965  11.398   8.399  1.00  0.00           V  
HETATM   14  V   UNL     1      -9.850  11.796   8.695  1.00  0.00           V  
HETATM   15  V   UNL     1      -8.744   5.807  12.169  1.00  0.00           V  
HETATM   16  V   UNL     1      -8.882  11.241  11.400  1.00  0.00           V  
HETATM   17  V   UNL     1     -10.472   8.366  12.430  1.00  0.00           V  
HETATM   18  V   UNL     1      -6.233   6.049  16.697  1.00  0.00           V  
HETATM   19  O   UNL     1      -6.211   8.314  12.734  1.00  0.00           O  
HETATM   20  O   UNL     1      -4.966   8.345  10.475  1.00  0.00           O  
HETATM   21  O   UNL     1      -6.769   5.811  12.441  1.00  0.00           O  
HETATM   22  O   UNL     1      -5.509   5.809  10.212  1.00  0.00           O  
HETATM   23  O   UNL     1      -4.341   6.395  12.497  1.00  0.00           O  
HETATM   24  O   UNL     1      -6.960   7.252  15.458  1.00  0.00           O  
HETATM   25  O   UNL     1      -8.952   7.391  13.301  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.103   8.140   7.758  1.00  0.00           O  
HETATM   27  O   UNL     1      -6.005  10.604   9.681  1.00  0.00           O  
HETATM   28  O   UNL     1     -10.401  11.275  10.216  1.00  0.00           O  
HETATM   29  O   UNL     1     -10.439  13.324   8.596  1.00  0.00           O  
HETATM   30  O   UNL     1      -9.881  10.191  12.408  1.00  0.00           O  
HETATM   31  O   UNL     1      -9.206  12.659  12.291  1.00  0.00           O  
HETATM   32  O   UNL     1      -9.254   4.701  13.199  1.00  0.00           O  
HETATM   33  O   UNL     1     -11.546   8.323  13.569  1.00  0.00           O  
HETATM   34  O   UNL     1      -8.133   5.149  17.147  1.00  0.00           O  
HETATM   35  O   UNL     1      -5.716   4.659  14.985  1.00  0.00           O  
HETATM   36  O   UNL     1      -5.020   4.573  17.593  1.00  0.00           O  
HETATM   37  O   UNL     1      -6.178   7.085  18.266  1.00  0.00           O  
HETATM   38  O   UNL     1      -8.314   6.211   5.521  1.00  0.00           O  
HETATM   39  O   UNL     1      -8.345   4.966   7.780  1.00  0.00           O  
HETATM   40  O   UNL     1      -5.811   6.769   5.814  1.00  0.00           O  
HETATM   41  O   UNL     1      -5.809   5.509   8.043  1.00  0.00           O  
HETATM   42  O   UNL     1      -6.395   4.341   5.758  1.00  0.00           O  
HETATM   43  O   UNL     1      -7.252   6.960   2.797  1.00  0.00           O  
HETATM   44  O   UNL     1      -9.687   7.811   3.608  1.00  0.00           O  
HETATM   45  O   UNL     1      -7.391   8.952   4.954  1.00  0.00           O  
HETATM   46  O   UNL     1      -6.716   3.300   9.217  1.00  0.00           O  
HETATM   47  O   UNL     1      -8.140   5.103  10.497  1.00  0.00           O  
HETATM   48  O   UNL     1     -10.622   7.245   6.305  1.00  0.00           O  
HETATM   49  O   UNL     1     -10.604   6.005   8.574  1.00  0.00           O  
HETATM   50  O   UNL     1     -10.673   4.554   6.050  1.00  0.00           O  
HETATM   51  O   UNL     1     -10.341   6.455  11.181  1.00  0.00           O  
HETATM   52  O   UNL     1     -11.712   8.674  10.932  1.00  0.00           O  
HETATM   53  O   UNL     1     -11.796   8.135   8.416  1.00  0.00           O  
HETATM   54  O   UNL     1     -12.695   6.247  10.326  1.00  0.00           O  
HETATM   55  O   UNL     1     -11.275  10.401   8.039  1.00  0.00           O  
HETATM   56  O   UNL     1     -13.324  10.439   9.659  1.00  0.00           O  
HETATM   57  O   UNL     1     -10.191   9.881   5.847  1.00  0.00           O  
HETATM   58  O   UNL     1     -12.659   9.206   5.964  1.00  0.00           O  
HETATM   59  O   UNL     1      -4.701   9.254   5.056  1.00  0.00           O  
HETATM   60  O   UNL     1      -8.323  11.546   4.686  1.00  0.00           O  
HETATM   61  O   UNL     1      -5.149   8.133   1.108  1.00  0.00           O  
HETATM   62  O   UNL     1      -4.659   5.716   3.270  1.00  0.00           O  
HETATM   63  O   UNL     1      -4.573   5.020   0.662  1.00  0.00           O  
HETATM   64  O   UNL     1      -7.085   6.178  -0.011  1.00  0.00           O  
HETATM   65  V   UNL     1      -6.878   5.580   6.537  1.00  0.00           V  
HETATM   66  V   UNL     1      -6.049   6.233   1.558  1.00  0.00           V  
HETATM   67  V   UNL     1      -8.125   7.412   4.269  1.00  0.00           V  
HETATM   68  V   UNL     1      -7.032   4.895   9.183  1.00  0.00           V  
HETATM   69  V   UNL     1      -9.785   5.794   6.816  1.00  0.00           V  
HETATM   70  V   UNL     1     -11.398   6.965   9.856  1.00  0.00           V  
HETATM   71  V   UNL     1     -11.796   9.850   9.560  1.00  0.00           V  
HETATM   72  V   UNL     1      -5.807   8.744   6.086  1.00  0.00           V  
HETATM   73  V   UNL     1     -11.241   8.882   6.855  1.00  0.00           V  
HETATM   74  V   UNL     1      -8.366  10.472   5.825  1.00  0.00           V  
CONECT    1   10                                                      
CONECT    2   11                                                      
CONECT    3   13   72   74                                            
CONECT    4   13   14   74                                            
CONECT    5   12   16                                                 
CONECT    6   12                                                      
CONECT    7   13   14   16                                            
CONECT    8   13                                                      
CONECT    9   19   20   21   22                                       
CONECT    9   23                                                      
CONECT   10    1   19   24   25                                       
CONECT   11    2   20   22   26                                       
CONECT   11   41                                                      
CONECT   12    5    6   19   20                                       
CONECT   12   27                                                      
CONECT   13    3    4    7    8                                       
CONECT   13   27                                                      
CONECT   14    4    7   28   29                                       
CONECT   14   55                                                      
CONECT   15   21   25   32   47                                       
CONECT   15   51                                                      
CONECT   16    5    7   28   30                                       
CONECT   16   31                                                      
CONECT   17   25   30   33   51                                       
CONECT   17   52                                                      
CONECT   18   24   34   35   36                                       
CONECT   18   37                                                      
CONECT   19    9   10   12                                            
CONECT   20    9   11   12                                            
CONECT   21    9   15                                                 
CONECT   22    9   11   68                                            
CONECT   23    9                                                      
CONECT   24   10   18                                                 
CONECT   25   10   15   17                                            
CONECT   26   11   72                                                 
CONECT   27   12   13                                                 
CONECT   28   14   16   71                                            
CONECT   29   14                                                      
CONECT   30   16   17                                                 
CONECT   31   16                                                      
CONECT   32   15                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   65   67   69                                            
CONECT   39   65   68   69                                            
CONECT   40   65   72                                                 
CONECT   41   11   65   68                                            
CONECT   42   65                                                      
CONECT   43   66   67                                                 
CONECT   44   67                                                      
CONECT   45   67   72   74                                            
CONECT   46   68                                                      
CONECT   47   15   68                                                 
CONECT   48   69   73                                                 
CONECT   49   69   70                                                 
CONECT   50   69                                                      
CONECT   51   15   17   70                                            
CONECT   52   17   70   71                                            
CONECT   53   70   71   73                                            
CONECT   54   70                                                      
CONECT   55   14   71   73                                            
CONECT   56   71                                                      
CONECT   57   73   74                                                 
CONECT   58   73                                                      
CONECT   59   72                                                      
CONECT   60   74                                                      
CONECT   61   66                                                      
CONECT   62   66                                                      
CONECT   63   66                                                      
CONECT   64   66                                                      
CONECT   65   38   39   40   41                                       
CONECT   65   42                                                      
CONECT   66   43   61   62   63                                       
CONECT   66   64                                                      
CONECT   67   38   43   44   45                                       
CONECT   68   22   39   41   46                                       
CONECT   68   47                                                      
CONECT   69   38   39   48   49                                       
CONECT   69   50                                                      
CONECT   70   49   51   52   53                                       
CONECT   70   54                                                      
CONECT   71   28   52   53   55                                       
CONECT   71   56                                                      
CONECT   72    3   26   40   45                                       
CONECT   72   59                                                      
CONECT   73   48   53   55   57                                       
CONECT   73   58                                                      
CONECT   74    3    4   45   57                                       
CONECT   74   60                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
