cxypay0379
     RDKit          3D

 50 57  0  0  1  0  0  0  0  0999 V2000
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    5.4826    0.3482   -0.4536 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.9717    0.6837    0.4800 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0356   -0.0574   -4.0193 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0641    2.9131   -0.2975 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0179    0.0715    1.8686 O   0  0  0  0  0  1  0  0  0  0  0  0
  1 28  2  0
  1 30  1  0
  2  5  2  0
  2 27  1  0
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  3  6  1  0
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  4  5  1  0
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 10  8  1  0
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 37 11  1  0
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M  RAD  8   1   2   3   3   6   3   8   3   9   3  10   2  11   2  12   2
M  RAD  8  13   2  14   2  15   2  16   2  17   2  18   2  19   2  20   3
M  CHG  2  31  -1  43  -1
M  RAD  6  24   2  25   3  26   3  27   2  36   2  50   2
M  END
$$$$
