COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.328  12.611  32.761  1.00  0.00           C  
HETATM    2  C   UNL     1       9.300  12.634  33.969  1.00  0.00           C  
HETATM    3  C   UNL     1       9.393  11.221  34.617  1.00  0.00           C  
HETATM    4  C   UNL     1      10.507  11.132  35.681  1.00  0.00           C  
HETATM    5  C   UNL     1      10.590   9.714  36.285  1.00  0.00           C  
HETATM    6  C   UNL     1       9.481   9.401  37.267  1.00  0.00           C  
HETATM    7  O   UNL     1       8.911  10.247  37.926  1.00  0.00           O  
HETATM    8  N   UNL     1       9.168   8.093  37.370  1.00  0.00           N  
HETATM    9  C   UNL     1       8.122   7.595  38.277  1.00  0.00           C  
HETATM   10  C   UNL     1       6.723   8.085  37.849  1.00  0.00           C  
HETATM   11  P   UNL     1       5.318   7.679  38.952  1.00  0.00           P  
HETATM   12 PD   UNL     1       5.829   5.863  40.310  1.00  0.00          Pd  
HETATM   13 CL   UNL     1       7.311   6.612  42.006  1.00  0.00          Cl  
HETATM   14  C   UNL     1       5.135   8.959  40.297  1.00  0.00           C  
HETATM   15  C   UNL     1       4.484   8.314  41.550  1.00  0.00           C  
HETATM   16  C   UNL     1       4.220  10.158  39.956  1.00  0.00           C  
HETATM   17  C   UNL     1       6.481   9.548  40.766  1.00  0.00           C  
HETATM   18  C   UNL     1       3.835   7.408  37.871  1.00  0.00           C  
HETATM   19  C   UNL     1       3.612   8.664  36.996  1.00  0.00           C  
HETATM   20  C   UNL     1       4.005   6.227  36.881  1.00  0.00           C  
HETATM   21  C   UNL     1       2.542   7.121  38.680  1.00  0.00           C  
HETATM   22  C   UNL     1       7.799  13.997  32.328  1.00  0.00           C  
HETATM   23  N   UNL     1       8.865  14.998  32.288  1.00  0.00           N  
HETATM   24  C   UNL     1       9.105  15.485  31.060  1.00  0.00           C  
HETATM   25  O   UNL     1       9.937  16.320  30.786  1.00  0.00           O  
HETATM   26  N   UNL     1       8.241  14.899  30.204  1.00  0.00           N  
HETATM   27  C   UNL     1       7.366  13.915  30.844  1.00  0.00           C  
HETATM   28  C   UNL     1       7.684  12.492  30.338  1.00  0.00           C  
HETATM   29  S   UNL     1       9.096  11.861  31.299  1.00  0.00           S  
HETATM   30  H   UNL     1       7.471  11.969  33.012  1.00  0.00           H  
HETATM   31  H   UNL     1      10.299  12.942  33.625  1.00  0.00           H  
HETATM   32  H   UNL     1       8.932  13.352  34.717  1.00  0.00           H  
HETATM   33  H   UNL     1       8.430  10.987  35.094  1.00  0.00           H  
HETATM   34  H   UNL     1       9.599  10.484  33.827  1.00  0.00           H  
HETATM   35  H   UNL     1      11.471  11.380  35.213  1.00  0.00           H  
HETATM   36  H   UNL     1      10.294  11.852  36.485  1.00  0.00           H  
HETATM   37  H   UNL     1      10.542   8.984  35.464  1.00  0.00           H  
HETATM   38  H   UNL     1      11.553   9.615  36.807  1.00  0.00           H  
HETATM   39  H   UNL     1       9.667   7.435  36.807  1.00  0.00           H  
HETATM   40  H   UNL     1       8.134   6.495  38.267  1.00  0.00           H  
HETATM   41  H   UNL     1       8.331   7.955  39.295  1.00  0.00           H  
HETATM   42  H   UNL     1       6.769   9.181  37.762  1.00  0.00           H  
HETATM   43  H   UNL     1       6.507   7.647  36.863  1.00  0.00           H  
HETATM   44  H   UNL     1       4.378   9.072  42.340  1.00  0.00           H  
HETATM   45  H   UNL     1       3.492   7.919  41.285  1.00  0.00           H  
HETATM   46  H   UNL     1       5.121   7.493  41.912  1.00  0.00           H  
HETATM   47  H   UNL     1       4.183  10.847  40.813  1.00  0.00           H  
HETATM   48  H   UNL     1       4.620  10.686  39.078  1.00  0.00           H  
HETATM   49  H   UNL     1       3.206   9.794  39.735  1.00  0.00           H  
HETATM   50  H   UNL     1       6.301  10.292  41.556  1.00  0.00           H  
HETATM   51  H   UNL     1       7.116   8.741  41.160  1.00  0.00           H  
HETATM   52  H   UNL     1       6.986  10.030  39.916  1.00  0.00           H  
HETATM   53  H   UNL     1       3.483   9.544  37.643  1.00  0.00           H  
HETATM   54  H   UNL     1       4.483   8.814  36.342  1.00  0.00           H  
HETATM   55  H   UNL     1       2.711   8.527  36.381  1.00  0.00           H  
HETATM   56  H   UNL     1       4.168   5.296  37.444  1.00  0.00           H  
HETATM   57  H   UNL     1       3.097   6.130  36.267  1.00  0.00           H  
HETATM   58  H   UNL     1       4.870   6.417  36.229  1.00  0.00           H  
HETATM   59  H   UNL     1       2.373   7.933  39.402  1.00  0.00           H  
HETATM   60  H   UNL     1       1.686   7.058  37.992  1.00  0.00           H  
HETATM   61  H   UNL     1       2.651   6.168  39.219  1.00  0.00           H  
HETATM   62  H   UNL     1       6.959  14.312  32.964  1.00  0.00           H  
HETATM   63  H   UNL     1       9.368  15.292  33.100  1.00  0.00           H  
HETATM   64  H   UNL     1       8.202  15.116  29.229  1.00  0.00           H  
HETATM   65  H   UNL     1       6.299  14.155  30.724  1.00  0.00           H  
HETATM   66  H   UNL     1       6.811  11.839  30.484  1.00  0.00           H  
HETATM   67  H   UNL     1       7.943  12.524  29.269  1.00  0.00           H  
HETATM   68  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   69  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   70  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   71  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   72  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   73  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   74  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   75  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   76  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   77  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   78  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   79  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   80  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   81  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   82  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   83  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   84  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
CONECT    1   29   22    2   30                                       
CONECT    2    1    3   31   32                                       
CONECT    3    2    4   33   34                                       
CONECT    4    3    5   35   36                                       
CONECT    5    4    6   37   38                                       
CONECT    6    5    8    7    7                                       
CONECT    7    6    6                                                 
CONECT    8    6    9   39                                            
CONECT    9    8   10   40   41                                       
CONECT   10    9   11   42   43                                       
CONECT   11   10   18   14   12                                       
CONECT   12   11   13   68   70                                       
CONECT   13   12                                                      
CONECT   14   11   16   17   15                                       
CONECT   15   14   44   45   46                                       
CONECT   16   14   47   48   49                                       
CONECT   17   14   50   51   52                                       
CONECT   18   20   19   21   11                                       
CONECT   19   18   53   54   55                                       
CONECT   20   18   56   57   58                                       
CONECT   21   18   59   60   61                                       
CONECT   22   27   23    1   62                                       
CONECT   23   24   22   63                                            
CONECT   24   26   25   25   23                                       
CONECT   25   24   24                                                 
CONECT   26   27   24   64                                            
CONECT   27   26   28   22   65                                       
CONECT   28   27   29   66   67                                       
CONECT   29   28    1                                                 
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   21                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   28                                                      
CONECT   68   69   12   77   78                                       
CONECT   69   68   70   70   79                                       
CONECT   70   69   69   71   12                                       
CONECT   71   70   72   72   73                                       
CONECT   72   71   71   74   80                                       
CONECT   73   71   76   76   81                                       
CONECT   74   72   75   75   82                                       
CONECT   75   74   74   76   83                                       
CONECT   76   73   73   75   84                                       
CONECT   77   68                                                      
CONECT   78   68                                                      
CONECT   79   69                                                      
CONECT   80   72                                                      
CONECT   81   73                                                      
CONECT   82   74                                                      
CONECT   83   75                                                      
CONECT   84   76                                                      
MASTER        0    0    0    0    0    0    0    0   84    0   84    0
END
