$RXN V3000

      Mrv2110  061120211351

M  V30 COUNTS 2 1 3
M  V30 BEGIN REACTANT
M  V30 BEGIN CTAB
M  V30 COUNTS 2 1 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C -9.8917 -0.5775 0 1
M  V30 2 O -11.4317 -0.5775 0 2
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 2 1 2
M  V30 END BOND
M  V30 END CTAB
M  V30 BEGIN CTAB
M  V30 COUNTS 1 0 0 0 0
M  V30 BEGIN ATOM
M  V30 1 N -6.5917 -0.5775 0 3
M  V30 END ATOM
M  V30 END CTAB
M  V30 END REACTANT
M  V30 BEGIN PRODUCT
M  V30 BEGIN CTAB
M  V30 COUNTS 3 2 0 0 0
M  V30 BEGIN ATOM
M  V30 1 N 8.7643 -0.1925 0 3
M  V30 2 C 10.098 -0.9625 0 1
M  V30 3 O 11.4317 -0.1925 0 2
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 8 1 2
M  V30 2 2 2 3
M  V30 END BOND
M  V30 END CTAB
M  V30 END PRODUCT
M  V30 BEGIN AGENT
M  V30 BEGIN CTAB
M  V30 COUNTS 1 0 0 0 0
M  V30 BEGIN ATOM
M  V30 1 O -2.5437 0.9625 0 0 HCOUNT=3
M  V30 END ATOM
M  V30 END CTAB
M  V30 BEGIN CTAB
M  V30 COUNTS 1 0 0 0 0
M  V30 BEGIN ATOM
M  V30 1 Na 0.9763 0.9625 0 0
M  V30 END ATOM
M  V30 END CTAB
M  V30 BEGIN CTAB
M  V30 COUNTS 1 0 0 0 0
M  V30 BEGIN ATOM
M  V30 1 Cl 4.7163 0.9625 0 0
M  V30 END ATOM
M  V30 END CTAB
M  V30 END AGENT
M  END
