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org.openscience.cdk.io.structure-with-radical.mol Maven / Gradle / Ivy

  Mrv0541 03281420122D          

  4  3  0  0  0  0            999 V2000
   -1.7900    4.4564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2025    3.7420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7900    3.0275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0275    3.7420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
M  RAD  1   1   2
M  END