Upload demo_input.csv
Browse files- demo_input.csv +10 -0
demo_input.csv
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input,REACTANT
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CCN(CC)CCNC(=S)NC1CCCc2cc(C)cnc21,CCN(CC)CCN=C=S.Cc1cnc2c(c1)CCCC2N
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NC(=O)CCCNC(=O)c1ccc2[nH]nc(-c3ccc(F)cc3)c2c1,COC(=O)CCCNC(=O)c1ccc2c(c1)c(-c1ccc(F)cc1)nn2C(C)=O.N
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Cc1occc(=O)c1O,COC1C=CC(=O)C(C)O1.ClCl.[Na+].[OH-]
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CC/C=C(C)/C=C/COC(C)=O,CC(=O)OC(C)=O.CC/C=C(C)/C=C/CO
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Cc1nc(NC(=O)C2C(C)(C)C2(C)C)sc1Cl,CC1(C)C(C(=O)Cl)C1(C)C.CC1(N)NC=C(Cl)S1.CCN(CC)CC
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Cn1ncnc1COc1nn2c(-c3cc(F)ccc3F)nncc2c1C(C)(C)C,Cc1ccc(S(=O)(=O)Oc2nn3c(-c4cc(F)ccc4F)nncc3c2C(C)(C)C)cc1.Cn1ncnc1CO.[H-].[Na+]
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COCCOc1cc2ncnc(Oc3cccc(NC(=O)Nc4cccc(C(C)(C)C#N)c4)c3)c2cc1OC,C1CCOC1.CC(C)(C#N)c1cccc(NC(=O)Oc2ccccc2)c1.CN(C)c1ccncc1.COCCOc1cc2ncnc(Oc3cccc(N)c3)c2cc1OC
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CC(C)(C)OC(=O)N1CCCC2(C1)C(=O)N(CC(F)(F)F)CC2c1ccccc1,C1CCOC1.CC(C)(C)OC(=O)N1CCCC2(C1)C(=O)NCC2c1ccccc1.O=S(=O)(OCC(F)(F)F)C(Cl)(Cl)Cl.[H-].[Na+]
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COc1cc2c(cc1C)OCCC2c1c[nH]c(S(=O)(=O)N(C)C)n1,COc1cc2c(cc1C)OCCC2(O)c1c[nH]c(S(=O)(=O)N(C)C)n1
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