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OpenChemIEData / r_group_resolution_data.json
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[
 {
 "file_name": "acs.joc.2c00176 example 1.png",
 "reaction_template": {
 "reactants": [
 "*C(=O)NN=CC(F)(F)F",
 "N#CN"
 ],
 "products": [
 "*C(=O)N1NC(C(F)(F)F)N=C1N"
 ]
 },
 "detailed_reactions": {
 "a": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)c1ccccc1",
 "N#CN"
 ],
 "products": [
 "NC1=NC(C(F)(F)F)NN1C(=O)c1ccccc1"
 ]
 },
 "b": {
 "reactants": [
 "Cc1ccccc1C(=O)NN=CC(F)(F)F",
 "N#CN"
 ],
 "products": [
 "Cc1ccccc1C(=O)N1NC(C(F)(F)F)N=C1N"
 ]
 },
 "c": {
 "reactants": [
 "Cc1cccc(C(=O)NN=CC(F)(F)F)c1",
 "N#CN"
 ],
 "products": [
 "Cc1cccc(C(=O)N2NC(C(F)(F)F)N=C2N)c1"
 ]
 },
 "d": {
 "reactants": [
 "Cc1ccc(C(=O)NN=CC(F)(F)F)cc1",
 "N#CN"
 ],
 "products": [
 "Cc1ccc(C(=O)N2NC(C(F)(F)F)N=C2N)cc1"
 ]
 },
 "e": {
 "reactants": [
 "COc1ccc(C(=O)NN=CC(F)(F)F)cc1",
 "N#CN"
 ],
 "products": [
 "COc1ccc(C(=O)N2NC(C(F)(F)F)N=C2N)cc1"
 ]
 },
 "f": {
 "reactants": [
 "Cc1cc(C)cc(C(=O)NN=CC(F)(F)F)c1",
 "N#CN"
 ],
 "products": [
 "Cc1cc(C)cc(C(=O)N2NC(C(F)(F)F)N=C2N)c1"
 ]
 },
 "g": {
 "reactants": [
 "COc1cc(OC)cc(C(=O)NN=CC(F)(F)F)c1",
 "N#CN"
 ],
 "products": [
 "COc1cc(OC)cc(C(=O)N2NC(C(F)(F)F)N=C2N)c1"
 ]
 },
 "h": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)c1ccc2c(c1)OCO2",
 "N#CN"
 ],
 "products": [
 "[H]N1C(C(F)(F)F)N=C(N)N1C(=O)c1ccc2c(c1)OCO2"
 ]
 },
 "i": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)c1ccc(F)cc1",
 "N#CN"
 ],
 "products": [
 "NC1=NC(C(F)(F)F)NN1C(=O)c1ccc(F)cc1"
 ]
 },
 "j": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)c1ccc(Cl)cc1",
 "N#CN"
 ],
 "products": [
 "NC1=NC(C(F)(F)F)NN1C(=O)c1ccc(Cl)cc1"
 ]
 },
 "k": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)c1ccc(Br)cc1",
 "N#CN"
 ],
 "products": [
 "NC1=NC(C(F)(F)F)NN1C(=O)c1ccc(Br)cc1"
 ]
 },
 "l": {
 "reactants": [
 "FC(F)(F)c1ccc(C(=O)NN=CC(F)(F)F)cc1",
 "N#CN"
 ],
 "products": [
 "*c1ccc(C(=O)N2NC(C(F)(F)F)N=C2N)cc1"
 ]
 },
 "m": {
 "reactants": [
 "[O-][N+](=O)c1ccc(C(=O)NN=CC(F)(F)F)cc1",
 "N#CN"
 ],
 "products": [
 "*c1ccc(C(=O)N2NC(C(F)(F)F)N=C2N)cc1"
 ]
 },
 "n": {
 "reactants": [
 "COC(=O)c1ccc(C(=O)NN=CC(F)(F)F)cc1",
 "N#CN"
 ],
 "products": [
 "*c1ccc(C(=O)N2NC(C(F)(F)F)N=C2N)cc1"
 ]
 },
 "o": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)c1ccc2ccccc2c1",
 "N#CN"
 ],
 "products": [
 "NC1=NC(C(F)(F)F)NN1C(=O)c1ccc2ccccc2c1"
 ]
 },
 "p": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)c1ccco1",
 "N#CN"
 ],
 "products": [
 "[H]N1C(C(F)(F)F)N=C(N)N1C(=O)c1ccco1"
 ]
 },
 "q": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)c1cccs1",
 "N#CN"
 ],
 "products": [
 "[H]N1C(C(F)(F)F)N=C(N)N1C(=O)c1cccs1"
 ]
 },
 "r": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)c1cc2sccc2s1",
 "N#CN"
 ],
 "products": [
 "[H]N1C(C(F)(F)F)N=C(N)N1C(=O)c1cc2sccc2s1"
 ]
 },
 "s": {
 "reactants": [
 "O=C(c1ncccc1)NN=CC(F)(F)F",
 "N#CN"
 ],
 "products": [
 "[H]N1C(C(F)(F)F)N=C(N)N1C(=O)c1ccccn1"
 ]
 },
 "t": {
 "reactants": [
 "O=C(Cc1ccccc1)NN=CC(F)(F)F",
 "N#CN"
 ],
 "products": [
 "NC1=NC(C(F)(F)F)NN1C(=O)Cc1ccccc1"
 ]
 },
 "u": {
 "reactants": [
 "CC(=O)NN=CC(F)(F)F",
 "N#CN"
 ],
 "products": [
 "CC(=O)N1NC(C(F)(F)F)N=C1N"
 ]
 },
 "v": {
 "reactants": [
 "O=C(C1CCCCC1)NN=CC(F)(F)F",
 "N#CN"
 ],
 "products": [
 "NC1=NC(C(F)(F)F)NN1C(=O)C1CCCCC1"
 ]
 },
 "w": {
 "reactants": [
 "O=C(C(C)C)NN=CC(F)(F)F",
 "N#CN"
 ],
 "products": [
 "CC(C)C(=O)N1NC(C(F)(F)F)N=C1N"
 ]
 },
 "x": {
 "reactants": [
 "O=C(NN=CC(F)(F)F)CCCCCCCCCCC",
 "N#CN"
 ],
 "products": [
 "CCCCCCCCCCCC(=O)N1NC(C(F)(F)F)N=C1N"
 ]
 }
 }
 },
 {
 "file_name": "acs.joc.2c00176 example 2.png",
 "reaction_template": {
 "reactants": [
 "*C(=O)N1NC(C(F)(F)F)N=C1N"
 ],
 "products": [
 "*C(=O)n1nc(C(F)(F)F)nc1N"
 ]
 },
 "detailed_reactions": {
 "a": {
 "reactants": [
 "NC1=NC(C(F)(F)F)NN1C(=O)c1ccccc1"
 ],
 "products": [
 "Nc1nc(C(F)(F)F)nn1C(=O)c1ccccc1"
 ]
 },
 "b": {
 "reactants": [
 "Cc1ccccc1C(=O)N1NC(C(F)(F)F)N=C1N"
 ],
 "products": [
 "Cc1ccccc1C(=O)n1nc(C(F)(F)F)nc1N"
 ]
 },
 "c": {
 "reactants": [
 "Cc1cccc(C(=O)N2NC(C(F)(F)F)N=C2N)c1"
 ],
 "products": [
 "Cc1cccc(C(=O)n2nc(C(F)(F)F)nc2N)c1"
 ]
 },
 "d": {
 "reactants": [
 "NC1=NC(C(F)(F)F)NN1C(=O)c1ccc(Cl)cc1"
 ],
 "products": [
 "Nc1nc(C(F)(F)F)nn1C(=O)c1ccc(Cl)cc1"
 ]
 },
 "e": {
 "reactants": [
 "NC1=NC(C(F)(F)F)NN1C(=O)c1ccc2ccccc2c1"
 ],
 "products": [
 "Nc1nc(C(F)(F)F)nn1C(=O)c1ccc2ccccc2c1"
 ]
 },
 "f": {
 "reactants": [
 "NC1=NC(C(F)(F)F)NN1C(=O)c1cccs1"
 ],
 "products": [
 "Nc1nc(C(F)(F)F)nn1C(=O)c1cccs1"
 ]
 },
 "g": {
 "reactants": [
 "NC1=NC(C(F)(F)F)NN1C(=O)C(C)C"
 ],
 "products": [
 "CC(C)C(=O)n1nc(C(F)(F)F)nc1N"
 ]
 },
 "h": {
 "reactants": [
 "CCCCCCCCCCCC(=O)N1NC(C(F)(F)F)N=C1N"
 ],
 "products": [
 "CCCCCCCCCCCC(=O)n1nc(C(F)(F)F)nc1N"
 ]
 }
 }
 },
 {
 "file_name": "acs.joc.3c00062 example 1.png",
 "reaction_template": {
 "reactants": [
 "[3*]C(=O)C=S(C)(C)=O",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "[3*]C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccccc1"
 ]
 },
 "detailed_reactions": {
 "aaa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccccc1"
 ]
 },
 "baa": {
 "reactants": [
 "Cc1ccccc1C(=O)C=S(C)(C)=O",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "Cc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccccc1"
 ]
 },
 "caa": {
 "reactants": [
 "Cc1cccc(C(=O)C=S(C)(C)=O)c1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "Cc1cccc(C(=O)[C@@H]2[C@@H](C(=O)c3ccccc3)N2c2ccccc2)c1"
 ]
 },
 "daa": {
 "reactants": [
 "Cc1ccc(C(=O)C=S(C)(C)=O)cc1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "Cc1ccc(C(=O)[C@@H]2[C@@H](C(=O)c3ccccc3)N2c2ccccc2)cc1"
 ]
 },
 "eaa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccc(OC)cc1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "COc1ccc(C(=O)[C@@H]2[C@@H](C(=O)c3ccccc3)N2c2ccccc2)cc1"
 ]
 },
 "faa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1F",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2F)N1c1ccccc1"
 ]
 },
 "gaa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1cccc(F)c1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2cccc(F)c2)N1c1ccccc1"
 ]
 },
 "haa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccc(F)cc1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccc(F)cc2)N1c1ccccc1"
 ]
 },
 "iaa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1cccc2ccccc12",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2cccc3ccccc23)N1c1ccccc1"
 ]
 },
 "jaa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccc2ccccc2c1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccc3ccccc3c2)N1c1ccccc1"
 ]
 },
 "kaa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1cccs1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2cccs2)N1c1ccccc1"
 ]
 },
 "laa": {
 "reactants": [
 "CC(C)C(=O)C=S(C)(C)=O",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "CC(C)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccccc1"
 ]
 },
 "maa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)C1CCCCC1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)C2CCCCC2)N1c1ccccc1"
 ]
 }
 }
 },
 {
 "file_name": "acs.joc.3c00062 example 2.png",
 "reaction_template": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "[4*]N=O",
 "C#Cc1ccccc1"
 ],
 "products": [
 "[4*]N1[C@H](C(=O)c2ccccc2)[C@H]1C(=O)c1ccccc1"
 ]
 },
 "detailed_reactions": {
 "aba": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "Cc1c(N=O)cccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "Cc1ccc(C(=O)[C@@H]2[C@@H](C(=O)c3ccccc3)N2c2ccccc2C)cc1"
 ]
 },
 "aca": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "Cc1cc(N=O)ccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "Cc1cccc(N2[C@H](C(=O)c3ccccc3)[C@H]2C(=O)c2ccccc2)c1"
 ]
 },
 "ada": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "Cc1ccc(N=O)cc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "Cc1ccc(N2[C@H](C(=O)c3ccccc3)[C@H]2C(=O)c2ccccc2)cc1"
 ]
 },
 "aea": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "COc1ccc(N=O)cc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "COc1ccc(N2[C@H](C(=O)c3ccccc3)[C@H]2C(=O)c2ccccc2)cc1"
 ]
 },
 "afa": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1Cl",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccccc1Cl"
 ]
 },
 "aga": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1cccc(Cl)c1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1cccc(Cl)c1"
 ]
 },
 "aha": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "Clc1ccc(N=O)cc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccc(Cl)cc1"
 ]
 },
 "aia": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "Fc1c(N=O)cccc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccccc1F"
 ]
 },
 "aja": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1cccc(F)c1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1cccc(F)c1"
 ]
 },
 "aka": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccc(F)cc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccc(F)cc1"
 ]
 },
 "ala": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "Cc1cc(C)cc(N=O)c1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "Cc1cc(C)cc(N2[C@H](C(=O)c3ccccc3)[C@H]2C(=O)c2ccccc2)c1"
 ]
 },
 "ama": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccncc1",
 "C#Cc1ccccc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccncc1"
 ]
 },
 "ana": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "CC(=O)OC(C)(C)N=O",
 "C#Cc1ccccc1"
 ],
 "products": [
 "CC(=O)OC(C)(C)N1[C@H](C(=O)c2ccccc2)[C@H]1C(=O)c1ccccc1"
 ]
 }
 }
 },
 {
 "file_name": "acs.joc.3c00062 example 3.png",
 "reaction_template": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#C[Rf]"
 ],
 "products": [
 "O=C([Rf])[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccccc1"
 ]
 },
 "detailed_reactions": {
 "aab": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1C"
 ],
 "products": [
 "Cc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N1c1ccccc1"
 ]
 },
 "aac": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1cccc(C)c1"
 ],
 "products": [
 "Cc1cccc(C(=O)[C@@H]2[C@@H](C(=O)c3ccccc3)N2c2ccccc2)c1"
 ]
 },
 "aad": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1ccc(C)cc1"
 ],
 "products": [
 "Cc1ccc(C(=O)[C@@H]2[C@@H](C(=O)c3ccccc3)N2c2ccccc2)cc1"
 ]
 },
 "aae": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1ccc(OC)cc1"
 ],
 "products": [
 "COc1ccc(C(=O)[C@@H]2[C@@H](C(=O)c3ccccc3)N2c2ccccc2)cc1"
 ]
 },
 "aaf": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1ccccc1F"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2F)N1c1ccccc1"
 ]
 },
 "aag": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1cccc(F)c1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2cccc(F)c2)N1c1ccccc1"
 ]
 },
 "aah": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1ccc(F)cc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccc(F)cc2)N1c1ccccc1"
 ]
 },
 "aai": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1ccc(Cl)cc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccc(Cl)cc2)N1c1ccccc1"
 ]
 },
 "aaj": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1ccc([N+](=O)[O-])cc1"
 ],
 "products": [
 "O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccc([N+](=O)[O-])cc2)N1c1ccccc1"
 ]
 },
 "aak": {
 "reactants": [
 "CS(C)(=O)=CC(=O)c1ccccc1",
 "O=Nc1ccccc1",
 "C#Cc1ccsc1"
 ],
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 "v": {
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 "w": {
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 "x": {
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 "y": {
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 "products": [
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 "z": {
 "reactants": [
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 "file_name": "ajoc.202200524 example 1.png",
 "reaction_template": {
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 "products": [
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 "h": {
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 "i": {
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 "j": {
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 "products": [
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 "k": {
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 "products": [
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 "l": {
 "reactants": [
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 "m": {
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 "n": {
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 "z": {
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 "file_name": "ajoc.202200438 example 2.png",
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 "products": [
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 "products": [
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 "ja": {
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 "products": [
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 "ka": {
 "reactants": [
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 "products": [
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 "la": {
 "reactants": [
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 "products": [
 "O=C(C1CCCCC1)[C@H]1[C@H](c2ccccc2)C(C(F)F)=NN1c1ccccc1"
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 "ma": {
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 "products": [
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 "na": {
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 "products": [
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 "oa": {
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 "products": [
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 "pa": {
 "reactants": [
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 "products": [
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 "qa": {
 "reactants": [
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 "products": [
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 "ra": {
 "reactants": [
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 "products": [
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 "reactants": [
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 "products": [
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 "products": [
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 "products": [
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 "reactants": [
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 "products": [
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 }
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 },
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 "file_name": "ajoc.202200438 example 3.png",
 "reaction_template": {
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 "products": [
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 "detailed_reactions": {
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 "reactants": [
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 "products": [
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 "b": {
 "reactants": [
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 "products": [
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 "products": [
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 },
 "d": {
 "reactants": [
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 "ha": {
 "reactants": [
 "c1c3ccccc3c2c([H])c(-c3nc4ccccc4[nH]3)c(=O)oc2c1",
 "COC(=O)C=C"
 ],
 "products": [
 "COC(=O)c1cc2c3c4ccccc4ccc3oc(=O)c2c2nc3ccccc3n12"
 ]
 },
 "hb": {
 "reactants": [
 "c1c3ccccc3c2c([H])c(-c3nc4ccccc4[nH]3)c(=O)oc2c1",
 "CCOC(=O)C=C"
 ],
 "products": [
 "CCOC(=O)c1cc2c3c4ccccc4ccc3oc(=O)c2c2nc3ccccc3n12"
 ]
 },
 "hc": {
 "reactants": [
 "c1c3ccccc3c2c([H])c(-c3nc4ccccc4[nH]3)c(=O)oc2c1",
 "CC(C)(C)OC(=O)C=C"
 ],
 "products": [
 "CC(C)(C)OC(=O)c1cc2c3c4ccccc4ccc3oc(=O)c2c2nc3ccccc3n12"
 ]
 }
 }
 }
]