0 B12R1.21 C=C(C)COC1=CC=C(N)C=C1 c02898 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 a07584 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.21 CC1=CC=C(OCC(N)=O)C=C1 a01171 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 a03426 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 a00282 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 c04998 [0,0,0,0,0,0|2,0,2]=4 6 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 a02584 [0,0,0,0,0,0|2,0,2]=4 7 B11R1.1 C=CCOC1=CC=C(N)C=C1 c01982 [1,0,0,0,0,0|3,0,0]=4 8 B13R1.3 CCC1=CC=C(OCC(=O)O)C=C1 a06344 [0,1,0,0,0,0|3,0,0]=4 9 B13R1.3 COC1=CC=C(OCC(=O)O)C=C1 a03726 [0,1,0,0,0,0|2,0,0]=3 10 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=C1 a00393 [0,1,0,0,0,0|1,0,2]=4 11 B13R1.14 CC1=CC=C(OCC(=O)NN)C=C1 m07269 [0,1,0,0,0,0|2,0,0]=3 12 B13R1.14 CNC(=O)CCC1=CC=C(N)C=C1 c07674 [0,1,0,0,0,0|1,0,0]=2 13 B13R1.14 CNC(=O)COC1=CC=C(C)C=C1 c02590 [0,1,0,0,0,0|2,0,0]=3 14 B13R1.14 CNC(=O)\C=C\C1=CC=C(N)C=C1 c07564 [0,1,0,0,0,0|1,0,2]=4 15 B13R1.14 NNC(=O)COC1=CC=C(Cl)C=C1 M05231 [0,1,0,0,0,0|2,0,0]=3 16 B13R1.133 CC(OC1=CC=C(Cl)C=C1)C(=O)O a09435 [0,1,0,0,0,0|3,0,0]=4 17 B13R1.133 CC(OC1=CC=C(F)C=C1)C(=O)O c02591 [0,1,0,0,0,0|3,0,0]=4 18 B13R1.133 CC(OC1=CC=C(F)C=C1)C(N)=O c04702 [0,1,0,0,0,0|2,0,0]=3 19 B13R1.133 CC1=CC=C(OC(C)C(=O)O)C=C1 a07582 [0,1,0,0,0,0|3,0,0]=4 20 B13R1.164 CC(=O)NCC1=C(Cl)C=C(Cl)C=C1 e00345 [0,1,0,0,0,0|3,0,0]=4 21 B13R1.164 CC1=C(OCC(=O)O)C=CC(Br)=C1 a00761 [0,1,0,0,0,0|3,0,0]=4 22 B13R1.164 CC1=C(OCC(N)=O)C=CC(Br)=C1 c00385 [0,1,0,0,0,0|2,0,0]=3 23 B13R1.164 CC1=CC=C(OCC(=O)O)C(Br)=C1 m09465 [0,1,0,0,0,0|3,0,0]=4 24 B13R1.164 CC1=CC=C(OCC(=O)O)C(C)=C1 a05533 [0,1,0,0,0,0|3,0,0]=4 25 B13R1.164 NC(=O)COC1=C(Br)C=C(Br)C=C1 a02952 [0,1,0,0,0,0|2,0,0]=3 26 B13R1.164 NC(=O)COC1=C(Cl)C=C(F)C=C1 c04863 [0,1,0,0,0,0|2,0,0]=3 27 B13R1.164 O=C(O)COC1=C(Cl)C=C(Br)C=C1 a03526 [0,1,0,0,0,0|3,0,0]=4 28 B13R1.164 O=C(O)COC1=CC=C(Br)C=C1Br m09889 [0,1,0,0,0,0|3,0,0]=4 29 B13R1.164 O=C(O)COC1=CC=C(Cl)C=C1Br a04151 [0,1,0,0,0,0|3,0,0]=4 30 B13R1.511 CC1=CC(OCC(=O)O)=CC=C1Br a00573 [0,1,0,0,0,0|3,0,0]=4 31 B13R1.511 CC1=CC(OCC(=O)O)=CC=C1Cl a04503 [0,1,0,0,0,0|3,0,0]=4 32 B13R1.511 CC1=CC(OCC(N)=O)=CC=C1Br c09434 [0,1,0,0,0,0|2,0,0]=3 33 B13R1.511 CC1=CC=C(OCC(=O)O)C=C1C a07813 [0,1,0,0,0,0|3,0,0]=4 34 B13R1.511 NC(=O)COC1=CC(Cl)=C(F)C=C1 c05464 [0,1,0,0,0,0|2,0,0]=3 35 B13R1.511 O=C(O)\C=C\C1=CC=C(O)C(O)=C1 c07223 [0,1,0,0,0,0|1,0,2]=4 36 B11R1.75 CC1=CC=C(CCC(=O)O)O1 a03814 [0,0,0,0,1,0|3,0,0]=4 37 B12R1.69 O=CNCC1=C(Cl)C=C(Cl)C=C1 c07585 [1,1,0,0,0,0|2,0,0]=4 38 B12R1.71 COC1=CC=C(CNC=O)C=C1 e00474 [1,1,0,0,0,0|1,0,0]=3 39 B12R1.71 CSC1=CC=C(CNC=O)C=C1 e00537 [1,1,0,0,0,0|1,1,0]=4 40 B12R1.27 COC(=O)NCC1=CC=CC=C1 c07841 [1,1,0,0,0,0|2,0,0]=4 41 B12R1.27 NNC(=O)COC1=CC=CC=C1 M01601 [1,1,0,0,0,0|1,0,0]=3 42 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 c03084 [1,1,0,0,0,0|2,0,0]=4 43 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O a08934 [1,1,0,0,0,0|2,0,0]=4 44 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O c08648 [1,1,0,0,0,0|1,0,0]=3 45 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 a05300 [1,1,0,0,0,0|2,0,0]=4 46 B12R1.125 CC(=O)NCC1=C(Cl)C=CC=C1 e00298 [1,1,0,0,0,0|2,0,0]=4 47 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 c02600 [1,1,0,0,0,0|2,0,0]=4 48 B12R1.125 CC1=C(OCC(N)=O)C=CC=C1 a01169 [1,1,0,0,0,0|1,0,0]=3 49 B12R1.125 NC(=O)COC1=C(Cl)C=CC=C1 c07702 [1,1,0,0,0,0|1,0,0]=3 50 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 c04893 [1,1,0,0,0,0|1,0,0]=3 51 B12R1.125 O=C(O)COC1=C(Cl)C=CC=C1 a08309 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.226 CC1=CC(OCC(=O)O)=CC=C1 c06612 [1,1,0,0,0,0|2,0,0]=4 53 B12R1.226 CC1=CC=CC(OCC(N)=O)=C1 a01170 [1,1,0,0,0,0|1,0,0]=3 54 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 a03958 [0,1,0,0,1,0|2,0,0]=4 55 B14R1.3 COC1=CC=C(OC(C)C(=O)O)C=C1 a09315 [0,2,0,0,0,0|2,0,0]=4 56 B14R1.5 CCC1=CC=C(OCC(=O)NN)C=C1 a02011 [0,2,0,0,0,0|2,0,0]=4 57 B14R1.5 COC1=CC=C(NCC(=O)NN)C=C1 m06924 [0,2,0,0,0,0|1,0,0]=3 58 B14R1.5 COC1=CC=C(OCC(=O)NN)C=C1 a03929 [0,2,0,0,0,0|1,0,0]=3 59 B14R1.103 CCC1=CC(Br)=C(OCC(N)=O)C=C1 e00339 [0,2,0,0,0,0|2,0,0]=4 60 B14R1.727 CC1=C(OCC(=O)NN)C=CC(Br)=C1 a03284 [0,2,0,0,0,0|2,0,0]=4 61 B14R1.727 CC1=C(OCC(=O)NN)C=CC(Cl)=C1 m07639 [0,2,0,0,0,0|2,0,0]=4 62 B14R1.727 CC1=CC(C)=C(NCC(=O)NN)C=C1 m06922 [0,2,0,0,0,0|2,0,0]=4 63 B14R1.727 CC1=CC=C(OCC(=O)NN)C(Br)=C1 m08923 [0,2,0,0,0,0|2,0,0]=4 64 B14R1.727 CC1=CC=C(OCC(=O)NN)C(C)=C1 a05534 [0,2,0,0,0,0|2,0,0]=4 65 B14R1.727 NNC(=O)COC1=C(Br)C=C(Cl)C=C1 a07247 [0,2,0,0,0,0|2,0,0]=4 66 B14R1.727 NNC(=O)COC1=C(Cl)C=C(Cl)C=C1 M05142 [0,2,0,0,0,0|2,0,0]=4 67 B14R1.727 NNC(=O)COC1=CC=C(Br)C=C1Br m09699 [0,2,0,0,0,0|2,0,0]=4 68 B14R1.833 CC1=C(Br)C=CC(OCC(=O)NN)=C1 m09464 [0,2,0,0,0,0|2,0,0]=4 69 B14R1.536 CCC(OC1=CC=C(C)C=C1)C(N)=O e00203 [0,2,0,0,0,0|2,0,0]=4 70 B14R1.686 CC1=CC=C(OC(C)C(N)=O)C=C1C c04170 [0,2,0,0,0,0|2,0,0]=4 71 B14R1.6049 CC(OC1=CC=C(Cl)C=C1Br)C(N)=O c02990 [0,2,0,0,0,0|2,0,0]=4 72 B14R1.3152 CC1=C(OCC(N)=O)C(Br)=CC(Br)=C1 a03040 [0,2,0,0,0,0|2,0,0]=4 73 B14R1.3152 NC(=O)COC1=C(Br)C=C(Cl)C=C1Cl c04570 [0,2,0,0,0,0|2,0,0]=4 74 B10R1.18 CC(=O)NC1=CC=CC=C1 a03944 [1,0,0,0,1,0|2,0,0]=4 75 B10R1.18 O=C(O)CC1=CC=CC=C1 e01172 [1,0,0,0,1,0|1,0,0]=3 76 B10R1.13 CC(N)C1=CC=C(O)C=C1 c07375 [0,0,0,0,2,0|1,0,1]=4