cxy0569
     RDKit          3D

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M  RAD  8   1   3   2   3   3   2   4   3   6   3   7   2   8   3   9   3
M  RAD  8  10   2  11   2  13   2  14   2  15   2  17   3  20   2  22   2
M  RAD  8  26   2  27   2  30   2  31   2  32   2  34   2  37   2  38   2
M  RAD  8  39   2  40   3  42   3  43   3  44   2  46   2  47   2  49   3
M  RAD  8  50   2  51   2  52   3  53   3  55   2  58   2  59   2  62   3
M  RAD  8  63   3  64   3  65   2  66   2  67   3  68   3  69   3  74   3
M  RAD  7  75   2  79   2  90   2  93   2  94   2  97   2  98   3
M  END
$$$$
