0 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 21496 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15778 [1,0,0,0,0,0|2,0,1]=4 2 B10R1.13 CN(C)C1=CC=C(F)C=C1 102911 [1,0,0,0,0,0|2,0,0]=3 3 B10R1.113 CN(C)C1=CC(Cl)=NC=C1 101250 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.113 CN(C)C1=CC(F)=CC=C1 102890 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.113 CN(C)C1=CC(F)=NC=C1 101266 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.113 CN(C)C1=CC=CC(Cl)=N1 102381 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.113 CN(C)C1=CC=CC(F)=N1 102380 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.113 O=C(O)C1=CC(O)=CC=C1 18167 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.176 COC1=CC=C(Br)C(C)=C1 16780 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.176 COC1=CC=C(Cl)C(C)=C1 16021 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.176 NCC1=CC(O)=C(O)C=C1 20755 [1,0,0,0,0,0|2,0,0]=3 12 B12R1.23 CC1=C(Br)C=C(C(F)(F)F)C=C1 10031 [0,1,0,0,0,0|3,0,0]=4 13 B12R1.23 CC1=CC=C(C(F)(F)F)C=C1Cl 100200 [0,1,0,0,0,0|3,0,0]=4 14 B12R1.23 C[Si](C)(C)C1=CC=C(Cl)C(Cl)=C1 101959 [0,1,0,0,0,0|2,1,0]=4 15 B12R1.23 C[Si](C)(C)C1=CC=C(F)C(F)=C1 101961 [0,1,0,0,0,0|2,1,0]=4 16 B12R1.1005 CC1=C(O)C=C(C(=O)O)C=C1O 849 [0,1,0,0,0,0|2,0,1]=4 17 B10R1.194 CC1=C(C)C(C(C)C)=NN1 16762 [0,0,0,0,1,0|3,0,0]=4 18 B12R1.19 CC(=O)NC1=CC(Cl)=C(C)C=C1 17118 [0,0,0,0,0,1|2,0,1]=4 19 B9R1.1 FC1=CC=C(CBr)C=C1 102290 [2,0,0,0,0,0|2,0,0]=4 20 B9R1.2 NCC1=CC=CC(Cl)=C1 102537 [2,0,0,0,0,0|2,0,0]=4 21 B9R1.2 NCC1=CC=CC(N)=C1 102876 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.2 [NH3+]CC1=CC=CC(Cl)=C1 102479 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.2 [NH3+]CC1=CC=CC(O)=C1 102221 [2,0,0,0,0,0|1,0,0]=3 24 B11R1.3 BrCC1=CC=C(C(Br)Br)C=C1 12022 [1,1,0,0,0,0|2,0,0]=4 25 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 12242 [1,1,0,0,0,0|1,0,1]=4 26 B11R1.19 C[Si](C)(C)C1=CC=C(F)C=C1 101954 [1,1,0,0,0,0|1,1,0]=4 27 B11R1.22 CC1=CC=C(C(C)CBr)C=C1 102694 [1,1,0,0,0,0|0,0,0]=2 28 B11R1.22 FC(CBr)C1=CC=C(Cl)C=C1 100184 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.279 COC1=CC=C(C=O)C=C1O 15839 [1,1,0,0,0,0|1,0,1]=4 30 B11R1.280 COC1=CC(CN)=CC=C1O 15578 [1,1,0,0,0,0|2,0,0]=4 31 B13R1.3800 CC(C)C1=CC=C(Cl)C(=O)C(Cl)=C1 19621 [0,1,0,0,0,1|1,0,1]=4 32 B11R2.363 CC1=CC=C2C(=O)CC2=C1 16221 [1,0,0,1,0,0|1,0,1]=4 33 B11R2.190 COC1=CC=C2CCC2=C1 16570 [1,0,0,1,0,0|2,0,0]=4 34 B13R2.1590 COC1=C(C)C=C2C(=C1)CC2Cl 16594 [0,1,0,1,0,0|2,0,0]=4 35 B11R1.20 CC(C)CC1=CC=C(O)C=C1 17197 [1,0,0,0,0,1|1,0,0]=3 36 B13R1.511 CN(C)CCC1=CC=C(O)C(O)=C1 21330 [0,0,0,0,0,2|2,0,0]=4