diff --git "a/suzuki_dreher.csv" "b/suzuki_dreher.csv"
new file mode 100644--- /dev/null
+++ "b/suzuki_dreher.csv"
@@ -0,0 +1,5761 @@
+reactant_1_smiles,reactant_2_smiles,catalyst_smiles,ligand_smiles,reagent_1_smiles,solvent_1_smiles,rxn,yield
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.047641092184596195
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0412096203597114
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0210830716745609
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0267563431152105
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.558517248007788
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.479422368676178
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.523254982462699
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0424818416198782
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48561140726650104
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07771747709471401
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.427329765527711
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.550785260954863
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0303273678853182
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.623266043134165
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.733055406932652
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.123022393545058
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.720008032847844
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.261379482896069
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0454255057271249
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178334601652192
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.661567482939123
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09919387953604289
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.585147171501637
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.78151358455536
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0104773556690246
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.767222979653099
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.874742953227683
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6320272748042151
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.400559059542472
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.95568229157529
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7171205136278109
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.399796885856858
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7415141560574691
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.492451569795546
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0938703929805834
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.209446895988713
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9098810000897259
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.967609424689599
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.919298669617397
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.874932311504694
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.347271754713206
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9587597459659319
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.925255059883806
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.489937734631707
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7553780378673529
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0999382486028393
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.279360056540966
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.960522956516848
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.388778316787673
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.574149395882363
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.054938176425329395
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.968863406821135
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6720104299093179
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0645032151958811
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0681172692824835
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.601984165966287
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.707778455537634
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7015770909374279
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.346100805617181
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.345428487761742
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.796570581407781
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34879591683823
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44650777602804603
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.24479843427874598
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.192382473012842
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0140580220488972
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0680509238951124
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6668117832641759
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7379770635306361
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7562837369059701
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.440980301035265
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.524534202188087
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.878847493040702
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.511474832866481
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.573629519109205
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5011640603795761
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.222208420041598
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.053141049830774
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11926366521321301
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.927695400124084
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.877846242598397
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.892205501146468
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7360360445690981
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.733338474319106
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.972927783508637
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.68315418658157
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.673962945873497
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45584489242016196
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.240433571694587
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09879313318284909
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0745828675729199
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9467060883570391
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9488441829384141
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.918801535351221
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8043018473934169
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.412847585417364
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.978329449296663
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7045397941790441
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6866498733646069
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.609473840012232
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.555596087584328
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8108903891577209
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.59547952691366
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.376611857663036
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.264382139838733
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0137662012200758
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07449273182643411
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.491500974013581
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.801808959600576
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.672247896803707
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6071444564792831
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20574185429275602
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.849881268158938
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.626649492990998
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.403218965509842
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.305543683112688
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.157445634310627
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14104415596125
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.215208583335199
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8207458957875611
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7737750506075101
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.485045497988158
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39143080387714
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18950140999335102
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.140695732314952
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0838810446521811
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232348796643026
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.551599121311216
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.008035067602278791
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.714860589273228
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.778848124982425
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8173439942744071
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.93790441521871
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.869794015893373
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8569026526395269
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6653356410008119
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.813252940387323
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9260849807612109
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7161894346522379
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.897435135864189
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.882403317307475
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.854580015949466
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9114390992499279
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5468392277136931
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.905472946483825
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34003237093973804
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0102296018856456
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.688942947434202
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.824407782264567
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.92897086028179
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.696042882926731
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.893372501650704
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8809193009173061
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.855838032171892
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.922723911352374
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.486042918754773
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.906165000399185
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21407979727544402
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0122184090817358
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7134333778256131
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7415443702005621
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.829883888481488
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5254395652725851
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.637819400768771
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.623651842739079
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36201632298176795
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26264529125812297
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.266943881989596
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],,,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20824281400196298
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.563815376680642
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9660332443172329
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.837851628591261
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8756986549579879
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+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48621870257282196
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+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.771281633604583
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B(O)O,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B(O)O.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.775655651145343
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23197285220262798
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.662454444128696
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32294951891756496
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26795339642649
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.400786505833032
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12536499410996899
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10974820488392499
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.292598147809964
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37310085323578696
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.573866884073415
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9360689360944301
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.335312057497017
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48905393847933804
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.465915446149973
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43535580999175205
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.304370219792946
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45405656027018404
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7532619792603841
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.603323951344361
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.655683038126891
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07655613165955699
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13506741215635398
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.547532502589442
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.510969624505909
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8286910301681981
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.582135210324476
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35001833507256497
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.735144781527612
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5039253058316561
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7160044743147731
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.738427400196465
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0877430872991212
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+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.580748228983472
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36270461480124294
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.764886339893108
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.518673922580198
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.763815582154522
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.606261395282826
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0971585349581309
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.650863610187377
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.223016853415226
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.863474248411526
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39956425924601596
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.749876095218663
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48585054292393504
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42816124263151
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.389260899233888
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.312694417666723
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.403195272391227
+C1C2C(=NC=CC=2)C=CC=1OS(C(F)(F)F)(=O)=O.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=S(=O)(Oc1ccc2ncccc2c1)C(F)(F)F.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.460645713469855
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+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.869685852171353
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+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9394988029553081
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+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26265384135480596
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+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8422806283437729
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.68446213267915
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.648468788833468
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8612146288139969
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.737016952948523
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.678392299383743
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7270795788829391
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34329011030931605
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48367637664478896
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656954822014856
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9354786415934071
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.947130894737261
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9552727639976141
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8218784925881261
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+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8380406604589641
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+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.864020620342603
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8371445517063739
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.878139516657921
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7848369568961879
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.823457149952457
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.848291348184061
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.750570288082755
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6807521838313051
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8592432291006069
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.923311863723015
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,1.0
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8927423461524979
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,1.0
+C1=C(I)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Ic1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.86188448296281
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7081824881190321
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.817040225182311
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.611004479356087
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.780891978694366
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.89929632660548
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.742866091441001
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.706484578725807
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38594434804813504
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20335979781228
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21305373404707598
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.920646733485587
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.730683075724633
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.852614518045575
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.871234619226744
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.763932226467668
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7044982933587041
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.820774526988059
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6777147861224541
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.772100376940361
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.06741416138731669
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.536923691788303
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.829199179933664
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.74653263183873
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40374931202608005
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.482424359760645
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.08863254742591449
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0953495376035401
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9158251882984559
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7876937120492
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9156565618629109
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7223045818725911
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.558968187248135
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.959869565780276
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.872360128876829
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.61488521771366
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.792679734558002
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.138140833999435
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19772846952585202
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.069314202604836
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.9475901629156699
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.84054790163906
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8302491932065099
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.510468530903619
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.571382266652478
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8779111266177639
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.588998141073101
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.402356575343603
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46824025856413004
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.168990477442593
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0879331979589144
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0383397584421714
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.358635562025547
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.503057809270717
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.770157224798441
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44121565736509
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.388990395609926
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.352719551438374
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153532127786902
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0388993433542378
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0360888525222781
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.638600423016889
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.578342715185746
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.696042303984851
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.304947480541587
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35363742950322297
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7659890024629781
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.430043335882556
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.367830173819224
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.412965747708337
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195064395015793
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.10609253239583999
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0536038470460954
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.846337265031197
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6676846713934781
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.823323838216524
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.516797037521841
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.470931748804007
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.874938125845465
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.654910790551794
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.456337979757376
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.585788176507977
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.232200764942077
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20590769119239302
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0590316548586359
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.959562823315668
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.840743852094091
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.891623944753559
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.699316137913881
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.481599517628836
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.961897895055492
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8496072213244701
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.446890074493298
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.627744625468968
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.247735636010018
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153102254392046
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.542307156449755
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.291568163361999
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.647543840218683
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45039794518357296
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.435120520736486
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.134303280555806
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14234484694871902
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189442664281521
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7870692523977251
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7539382247574611
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6989466448873679
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6426614145509499
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.262645200113588
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.826188805431717
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33943443595108697
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.826188805431717
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153187557376871
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6854225022364829
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6424571647554851
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.528177029834646
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0904572769254407
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.428974736802609
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.315811337318611
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6846057174267279
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.561445045271822
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.470705668983345
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.645715496753202
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.583275366477236
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17872632788702
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.296203866812903
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0976601449382814
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0179404991984808
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.308047340497371
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.396326909475235
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7116621631175271
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.625901003557028
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5971108362865121
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6767959773682379
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.690477404859142
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.606183333793201
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.277396473154882
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.536436856390168
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11945796955848101
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.00527912468979002
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.336228773736327
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.448044602309298
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.779213130159205
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.637659041002719
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.698122924346663
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7158896789939421
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.588569154275866
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.515657854887724
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.258919720932694
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.584537356209573
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.09511864121036159
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0132221975332034
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29559721465017696
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.538966504380561
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.566968894834854
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.581758364883022
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144094099422302
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17110177326432002
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.105162253126458
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,CCN(CC)CC,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCN(CC)CC.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.038192236461342996
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.238159236468295
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.537176698377169
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0354059076082544
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.446338571272874
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17782460577228001
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.252179093318411
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.706705789591617
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28721040092551
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0456206774208026
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151192034239659
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.185113368883629
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0906666542323443
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30618049521742
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.771262037718349
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18223165974597
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.925289663983344
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.318491579295088
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0350718475053777
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233341547932659
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5857305324677999
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18110092225316302
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.114717514841347
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,CCN(CC)CC,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.15745215579989702
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.154224792783607
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604457773137239
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5175293724064151
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.07555981668350259
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.144106811209717
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11812347096108301
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.11199889148643001
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0627505425888356
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.132933729352841
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.600166409624427
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.655352270099713
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177416235342643
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1B4OC(C)(C)C(C)(C)O4,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1.Clc1ccc2ncccc2c1.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.16483857820639203
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.189611927112506
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177898057975307
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178124356775525
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.212559661994207
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.209957159459615
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19118278091526603
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.12925239901017702
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.121712675259246
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.177479626288931
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.13162837104025202
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.109904059371559
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.178705829394058
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.187165126061604
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163200246509561
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17766922659123702
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.164910394585762
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.233365464539622
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160683218788889
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.204948051760428
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.179807085872222
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.14821702539846998
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28529801166053004
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.37863930726740797
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246935860610764
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.160245688357878
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.175264808917886
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19016909525014
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.153649546161143
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,Brc1ccc2ncccc2c1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CCc1cccc(CC)c1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.254619907651635
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.310766415402017
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.74837727223048
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6667490708710759
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.510382743640328
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+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49825519937826895
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35627107312226897
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.139645623316443
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41011994285444797
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39954284239158605
+C1=C(Br)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,Brc1ccc2ncccc2c1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.731179926465945
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+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.434465161484757
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.246370699987248
+C1=C(Cl)C=CC2=NC=CC=C12.CCC1=CC(=CC=C1)CC,CC1=CC=C2C(C=NN2C3OCCCC3)=C1[B-](F)(F)F.[K+],CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CCc1cccc(CC)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1[B-](F)(F)F.Clc1ccc2ncccc2c1.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18508735042501
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.405405050475936
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5463149460319641
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46203952432738604
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.482657181725258
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.712281066041578
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.498039141874241
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.459467383597279
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6652065969902811
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298390870330192
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.548645895107187
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.495763451234986
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.8086456762328269
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.797125206708563
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.654437297038207
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.297244984135559
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7803892573592079
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35523516237654595
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6535530528608839
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.337879429839494
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.195069136112674
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.690598882971141
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.833610639865646
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.921947956172235
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21095199789337
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.188123347795281
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.163529086131536
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.199559208809091
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19704927055948201
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.402439303822655
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45856448024225005
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.527013539830445
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.305005829425026
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.275584273396117
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48687178882548304
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.293442456112348
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.332252857572933
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26632960661806204
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.280775871631717
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26674657272195
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.540798294610491
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.467466113247265
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.466488794236493
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30638662945371
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.151078423915307
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.429918986626171
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.242700050032468
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257059265500513
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21361571501051
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.194655623209512
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.155756885631068
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.490130472739151
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38170939192006104
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.434835476156268
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.159018074761319
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.295930085418043
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.570973494710886
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.1686914810048
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19720693014294
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17467242196738902
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.384732461473112
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.257441357934166
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22590527218498402
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18966079390314
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.158627568372741
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.301332294672132
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28492346941329
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21737650098077002
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.276627308063785
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.35759856974084203
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.302432375388826
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.412736260055726
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.237224478866646
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19462159963952
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.266172683508653
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44950884065936597
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41868383069824394
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.309365742941766
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.389859309997999
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.382013247681786
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.462116705140599
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19271096202789298
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34998917231395604
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.524719296011214
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.351034608282083
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40688623568391596
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.352168500434486
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.414185963376097
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.237681054107928
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.17978721061585598
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.656934908541084
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.604993448803632
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.266631486656218
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.36922268366495103
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21296669855522102
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.501770683856292
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=C([O-])O.OB(O)c1ccc2ncccc2c1.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42184108821245403
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30644780457424803
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.397255116428075
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21774296478233102
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.440041930084065
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.333251921704611
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.345062877645475
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.O=P([O-])([O-])[O-].OB(O)c1ccc2ncccc2c1.[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.191539986468249
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.19628391295120198
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.58216798698374
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.321187402290781
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.350234931987856
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.174603760288065
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40973441669109695
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39479527463434005
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.557469225143572
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.549519692840107
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.289365605632373
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.422789620293894
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6500453684252121
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+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.456345702377566
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.270443037945477
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.64133506684271
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.309714883438018
+C1C(B(O)O)=CC=C2N=CC=CC=12.Cl.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cl.O.O.OB(O)c1ccc2ncccc2c1.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.235972106658604
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.22310874112294002
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.241034426275582
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.241312940506273
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.597120039972868
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5799340271320019
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.576937055064357
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41632023504626803
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7384419996792719
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.602526159862109
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.596328103634999
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.495531461089131
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6778609894050921
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6858072372513879
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.338813881079206
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5093647823129119
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5916085894415599
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.645917821856057
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.558886751946386
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.507922188061246
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7235782020429611
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5551268194997551
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.569192968120574
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.556004216959361
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.621390799249698
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.512896388650289
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.32323249694379
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.54031851298399
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42843662294817103
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.716712204728133
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.508408513058598
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.263321784360547
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.54073033421256
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47915905351615
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44011224055112697
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.649166424296162
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.295105149839073
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.405958940198152
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.562854293302899
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.44726924348304103
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.38362566402660003
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.370395253033552
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.238315702046612
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.464826718525274
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41949946654543196
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5235494982735429
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.294904148967571
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45914608866747697
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.592066333688517
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49139300778538003
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.49528378413932006
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[OH-],CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40975333197929104
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.669766759933163
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.596888669969646
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.593600080452804
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.599363161720667
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6060937503757861
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.409634577585403
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.594490457613426
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.325901247268989
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.40991893051991296
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.269657211156278
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.30619521546614303
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21181979179941798
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29135276464551496
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.356453169996179
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.415918482266529
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[OH-].[Na+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.269356940353174
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.28274451454514
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.394799131708278
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.27913139696793
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.46413326962968704
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Na+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.280102716113553
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[OH-].[Na+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Na+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.288076256742924
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.42233109195929797
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.393401110032604
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33064998308048
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[OH-],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.26714775446079597
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.334095498405342
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47949316873298303
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.34321208683027005
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.472758398404752
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.319666445944624
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[K+].[OH-].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.305655218281944
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[OH-],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.29502820801422996
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.23692458366589603
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.519166647506828
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.43120739310055906
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Na+].OC([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=C([O-])O.[K+].[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298014983830232
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,CCN(CC)CC,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCN(CC)CC.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20721233537083802
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33830231608426997
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[F-].[Cs+],C1CCOC1.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.21605915104974202
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.281404463477474
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.45105822072013296
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.33794003853716603
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.411401855150197
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.336049054446635
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.345321027224
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Cs+].[F-].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41744936874703903
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39662357581969
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.385783331989582
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+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.25052854766698
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.589034115062089
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.479751857900665
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[Fe+2].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+[B-](C1=CC2=C(C=C1)N=CC=C2)(F)(F)F.[K+].O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.F[B-](F)(F)c1ccc2ncccc2c1.O.O.[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[OH-],CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[K+].[OH-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.757715038482424
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+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Li+].[O-]C(C)(C)C,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.41504841107864004
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.660488013796859
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.239678541848028
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.48697401478260405
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe].[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.228094878292688
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].[Li+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.449442579986169
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.226416658373551
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[Li+].[O-]C(C)(C)C,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)[O-].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Li+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.480854136483853
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.315251472071856
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.6167248308928039
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.398203665423228
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[Na+].OC([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.384336426217981
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.7794423317190871
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[Na+].OC([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.39307745223816803
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+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.465332439744952
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.762605498964281
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+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.803991080677073
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.413612704226996
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CO.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CO.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.225665449126186
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+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.314775204963594
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.20983093706741
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.389034633829692
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,,CC#N.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.18646652419381302
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.234325859045804
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+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
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+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[Na+].OC([O-])=O,CC#N.O,CC#N.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=C([O-])O.[Na+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.484118691779439
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+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,,C1CCOC1.O,C1CCOC1.CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.3578830188517
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+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-].[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.543226468847994
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[F-].[Cs+],CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.[Cs+].[F-]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.298355233115295
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C(C)(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C(C)(C)C)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],c3c(P(c1ccccc1)c2ccccc2)cccc3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+].c1ccc(P(c2ccccc2)c2ccccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.774676197869978
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.CN(C)c1ccc(P(C(C)(C)C)C(C)(C)C)cc1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.5598356678274979
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1(CCCCC1)P(C2CCCCC2)C3CCCCC3,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.51741545478348
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.633827338220575
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CCCCP(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.568377819658741
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],COc1cccc(c1c2ccccc2P(C3CCCCC3)C4CCCCC4)OC,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.697069616473282
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.[Fe],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH]1)C(C)(C)C.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.47211430881881694
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.[Fe+2],[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[K+].[K+].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.31443681011116
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],O6c1c(cccc1P(c2ccccc2)c3ccccc3)C(c7cccc(P(c4ccccc4)c5ccccc5)c67)(C)C,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.0
+B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CC=C3.O,CC1=CC=C2C(C=NN2C3OCCCC3)=C1Br,CC(=O)O~CC(=O)O~[Pd],,[K+].[K+].[K+].[O-]P([O-])([O-])=O,CN(C)C=O.O,CC(=O)O~CC(=O)O~[Pd].CC1(C)OB(c2ccc3ncccc3c2)OC1(C)C.CN(C)C=O.Cc1ccc2c(cnn2C2CCCCO2)c1Br.O.O.O=P([O-])([O-])[O-].[K+].[K+].[K+]>>Cc1ccc2c(cnn2C2CCCCO2)c1-c1ccc2ncccc2c1,0.541973760523868
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