0 B31R3.1950267943 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(Br)cc3F Amb18481001 [0,0,0,0,0,0|0,2,0]=2 1 B31R3.1950267943 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(Cl)cc3Cl Amb18480926 [0,0,0,0,0,0|0,0,0]=0 2 B31R3.1950267943 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(F)cc3Cl Amb17976364 [0,0,0,0,0,0|0,1,0]=1 3 B31R3.1950267943 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(F)cc3F Amb18481000 [0,0,0,0,0,0|0,2,0]=2 4 B30R3.659217927 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccccc3Br Amb17976377 [1,0,0,0,0,0|0,1,0]=2 5 B30R3.659217927 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccccc3Cl Amb18480934 [1,0,0,0,0,0|0,0,0]=1 6 B30R3.659217927 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccccc3F Amb18481002 [1,0,0,0,0,0|0,1,0]=2 7 B30R3.659217927 CCOC(=O)CCC=1C(=O)Oc2cc(ccc2C1C)OCc3ccccc3C Amb18480997 [1,0,0,0,0,0|1,0,0]=2 8 B30R3.2219470119 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(Br)cc3 Amb17976368 [1,0,0,0,0,0|0,1,0]=2 9 B30R3.2219470119 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(Cl)cc3 Amb18480998 [1,0,0,0,0,0|0,0,0]=1 10 B30R3.2219470119 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(F)cc3 Amb18480999 [1,0,0,0,0,0|0,1,0]=2 11 B30R3.2219470119 CCOC(=O)CCC=1C(=O)Oc2cc(ccc2C1C)OCc3ccc(C)cc3 Amb18480938 [1,0,0,0,0,0|1,0,0]=2 12 B32R3.4440398658 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccc(Br)cc3F)c2C)C1C Amb18481024 [0,1,0,0,0,0|0,2,0]=3 13 B32R3.4440398658 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccc(Cl)cc3Cl)c2C)C1C Amb17976370 [0,1,0,0,0,0|0,0,0]=1 14 B32R3.4440398658 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccc(F)cc3Cl)c2C)C1C Amb17976371 [0,1,0,0,0,0|0,1,0]=2 15 B32R3.4440398658 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccc(F)cc3F)c2C)C1C Amb17976383 [0,1,0,0,0,0|0,2,0]=3 16 B32R3.6635081594 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(Br)cc3F Amb18477996 [0,1,0,0,0,0|0,2,0]=3 17 B32R3.6635081594 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(Cl)cc3Cl Amb18478000 [0,1,0,0,0,0|0,0,0]=1 18 B32R3.6635081594 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(F)cc3Cl Amb18477992 [0,1,0,0,0,0|0,1,0]=2 19 B32R3.6635081594 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(F)cc3F Amb18477993 [0,1,0,0,0,0|0,2,0]=3 20 B29R3.1141343692 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccccc3 Amb18480937 [2,0,0,0,0,0|0,0,0]=2 21 B29R3.3091054941 CC=1c2ccc(cc2OC(=O)C1CCCCCC)OCc3ccc(Cl)cc3 Amb18482088 [2,0,0,0,0,0|1,0,1]=4 22 B29R3.3202579437 CC1=C(CCC(O)=O)C(=O)Oc2cc(ccc21)OCc3ccc(Br)cc3F Amb18481064 [2,0,0,0,0,0|0,2,0]=4 23 B29R3.3202579437 CC1=C(CCC(O)=O)C(=O)Oc2cc(ccc21)OCc3ccc(Cl)cc3Cl Amb17976400 [2,0,0,0,0,0|0,0,0]=2 24 B29R3.3202579437 CC1=C(CCC(O)=O)C(=O)Oc2cc(ccc21)OCc3ccc(F)cc3Cl Amb21914438 [2,0,0,0,0,0|0,1,0]=3 25 B29R3.3202579437 CC1=C(CCC(O)=O)C(=O)Oc2cc(ccc21)OCc3ccc(F)cc3F Amb18481063 [2,0,0,0,0,0|0,2,0]=4 26 B31R3.801802470 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccccc3OC Amb18476038 [1,1,0,0,0,0|1,0,0]=3 27 B31R3.1950276814 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccccc3Br)c2C)C1C Amb18481027 [1,1,0,0,0,0|0,1,0]=3 28 B31R3.1950276814 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccccc3C)c2C)C1C Amb17976385 [1,1,0,0,0,0|1,0,0]=3 29 B31R3.1950276814 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccccc3Cl)c2C)C1C Amb18481026 [1,1,0,0,0,0|0,0,0]=2 30 B31R3.1950276814 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccccc3F)c2C)C1C Amb18481025 [1,1,0,0,0,0|0,1,0]=3 31 B31R3.4816888697 CCOC(=O)CCC=1C(=O)Oc2cc(ccc2C1C)OCc3cc(C)ccc3C Amb18480939 [1,1,0,0,0,0|1,0,0]=3 32 B31R3.7583227703 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3c(Cl)cccc3Cl Amb18480933 [1,1,0,0,0,0|0,0,0]=2 33 B31R3.7583227703 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3c(F)cccc3Cl Amb18480932 [1,1,0,0,0,0|0,0,0]=2 34 B31R3.7583235636 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccccc3Br Amb17975629 [1,1,0,0,0,0|0,1,0]=3 35 B31R3.7583235636 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccccc3Cl Amb18478003 [1,1,0,0,0,0|0,0,0]=2 36 B31R3.7583235636 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccccc3F Amb18478009 [1,1,0,0,0,0|0,1,0]=3 37 B31R3.7583235636 CCOC(=O)CCC=1C(=O)Oc2cc(OCc3ccccc3C)c(Cl)cc2C1C Amb18478002 [1,1,0,0,0,0|1,0,0]=3 38 B31R3.1950267944 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(cc3)C=C Amb17976367 [1,1,0,0,0,0|1,0,0]=3 39 B31R3.1950267944 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(cc3)OC Amb18476035 [1,1,0,0,0,0|1,0,0]=3 40 B31R3.1950267950 CC=1c2ccc(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(Cl)c(Cl)c3 Amb17976363 [1,1,0,0,0,0|0,0,0]=2 41 B31R3.4816818950 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccc(Br)cc3)c2C)C1C Amb18480965 [1,1,0,0,0,0|0,1,0]=3 42 B31R3.4816818950 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccc(C)cc3)c2C)C1C Amb18480961 [1,1,0,0,0,0|1,0,0]=3 43 B31R3.4816818950 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccc(Cl)cc3)c2C)C1C Amb18481035 [1,1,0,0,0,0|0,0,0]=2 44 B31R3.4816818950 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OCc3ccc(F)cc3)c2C)C1C Amb18481034 [1,1,0,0,0,0|0,1,0]=3 45 B31R3.7309888294 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(Br)cc3 Amb18477997 [1,1,0,0,0,0|0,1,0]=3 46 B31R3.7309888294 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(Cl)cc3 Amb18478001 [1,1,0,0,0,0|0,0,0]=2 47 B31R3.7309888294 CC=1c2cc(Cl)c(cc2OC(=O)C1CCC(=O)OCC)OCc3ccc(F)cc3 Amb18478008 [1,1,0,0,0,0|0,1,0]=3 48 B31R3.7309888294 CCOC(=O)CCC=1C(=O)Oc2cc(OCc3ccc(C)cc3)c(Cl)cc2C1C Amb18478006 [1,1,0,0,0,0|1,0,0]=3 49 B33R3.1397970083 CCOC(=O)CCC=1C(=O)Oc2c(ccc(OC(=O)c3ccc(Cl)cc3Cl)c2C)C1C Amb18480488 [0,2,0,0,0,0|0,0,1]=3 50 B29R3.5396763709 CC=1c2ccc(cc2OC(=O)C1CC(=O)OC)OCc3ccc(Br)cc3F Amb18478565 [1,0,0,0,1,0|0,2,0]=4 51 B29R3.5396763709 CC=1c2ccc(cc2OC(=O)C1CC(=O)OC)OCc3ccc(Cl)cc3Cl Amb18478555 [1,0,0,0,1,0|0,0,0]=2 52 B29R3.5396763709 CC=1c2ccc(cc2OC(=O)C1CC(=O)OC)OCc3ccc(F)cc3Cl Amb18478600 [1,0,0,0,1,0|0,1,0]=3 53 B29R3.5396763709 CC=1c2ccc(cc2OC(=O)C1CC(=O)OC)OCc3ccc(F)cc3F Amb17975775 [1,0,0,0,1,0|0,2,0]=4 54 B31R3.801802475 CCOC(=O)CCC=1C(=O)Oc2cc(ccc2C1C)OCc3cc(C)cc(C)c3 Amb18481005 [0,0,0,0,1,1|2,0,0]=4