WS0045
     RDKit          3D

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M  RAD  8   1   2   2   3   4   2   5   2   6   2   9   2  10   2  11   3
M  RAD  8  13   3  15   2  17   3  19   3  20   3  21   3  22   2  24   3
M  RAD  8  25   3  26   2  28   3  32   2  37   2  39   2  43   3  44   3
M  RAD  8  46   2  47   3  48   2  49   2  50   2  51   2  52   3  56   3
M  RAD  8  57   3  58   3  59   2  60   2  61   2  62   2  65   2  66   2
M  RAD  8  67   2  68   2  70   2  71   2  72   2  73   2  74   2  75   2
M  RAD  8  77   2  79   2  81   2  84   2  85   2  86   2  87   2  88   2
M  RAD  6  91   2  92   2  93   2  95   2  98   2  99   2
M  END
$$$$
