cxy0551
     RDKit          3D

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M  RAD  8   1   2   2   2   3   2   4   3   5   3   6   2   7   2   8   2
M  RAD  8   9   3  10   3  11   2  12   2  14   2  15   2  16   3  17   2
M  RAD  8  18   3  20   2  21   2  22   2  25   2  26   2  28   2  29   2
M  RAD  8  30   3  31   3  33   2  36   2  37   2  38   2  39   2  40   2
M  RAD  8  41   2  42   2  45   3  46   3  48   2  49   2  50   2  51   2
M  RAD  8  52   2  53   2  55   2  56   2  58   3  59   2  61   3  62   3
M  RAD  8  63   2  64   2  65   2  66   3  67   2  71   2  78   2  85   2
M  RAD  7  86   2  88   2  93   2  94   2  96   3  97   2  98   2
M  END
$$$$
