0 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 102172 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 CC1=CC=C(B(O)O)C(F)=C1 101910 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.166 CC1=CC=C(C(=O)Cl)C(C)=C1 16799 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.166 CC1=CC=C(C(=O)O)C(C)=C1 15222 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 101178 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.166 O=C(O)C1=CC=C(Cl)C=C1O 101171 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15778 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.13 CN(C)C1=CC=C(F)C=C1 102911 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.25 CC1=CC=C(CCl)C(C)=C1 16098 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.25 O=CC1=C(O)C=C(O)C=C1 15667 [1,0,0,0,0,0|2,0,1]=4 10 B10R1.61 CN(C)C1=C(F)C=CC=C1 102910 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.61 O=C(O)C1=C(O)C=CC=C1 15776 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 20069 [1,0,0,0,0,0|3,0,0]=4 13 B12R1.126 CC(C)(O)C1=CC=C(Br)C=C1F 102028 [0,1,0,0,0,0|2,0,0]=3 14 B12R1.126 CC(C)(O)C1=CC=C(F)N=C1F 100262 [0,1,0,0,0,0|3,0,0]=4 15 B12R1.126 C[Si](C)(C)C1=C(F)C=C(I)C=C1 102025 [0,1,0,0,0,0|2,1,0]=4 16 B12R1.893 CC(=O)C1=CC=C(O)C(C)=C1O 899 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.1000 CN(C)C1=C(Cl)C=C(Br)C=C1Cl 101971 [0,1,0,0,0,0|3,0,0]=4 18 B12R2.3028 CC1=CC(C)=C2C(=C1)CC2Cl 16583 [0,0,0,1,0,0|2,0,0]=3 19 B12R2.3028 CC1=CC(C)=C2C(=O)CC2=C1 16223 [0,0,0,1,0,0|2,0,1]=4 20 B10R1.59 CC1=CC(C)=NN1C(C)C 16760 [0,0,0,0,1,0|3,0,0]=4 21 B10R1.194 CC1=C(C)C(C(C)C)=NN1 16762 [0,0,0,0,1,0|3,0,0]=4 22 B12R1.233 CC(=O)NC1=CC=C(C)C=C1C 17105 [0,0,0,0,0,1|2,0,1]=4 23 B12R1.233 CC(=O)NC1=CC=C(C)C=C1O 20859 [0,0,0,0,0,1|1,0,1]=3 24 B12R1.233 CC(=O)NC1=CC=C(Cl)C=C1O 20863 [0,0,0,0,0,1|2,0,1]=4 25 B9R1.1 FC1=CC=C(CBr)C=C1 102290 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.15 CC1=CC=CC=C1CCl 16097 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.15 NCC1=C(O)C=CC=C1 103068 [2,0,0,0,0,0|1,0,0]=3 28 B9R1.15 O=CC1=CC=CC=C1O 20957 [2,0,0,0,0,0|1,0,1]=4 29 B11R1.3 BrCC1=CC=C(C(Br)Br)C=C1 12022 [1,1,0,0,0,0|2,0,0]=4 30 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 12242 [1,1,0,0,0,0|1,0,1]=4 31 B11R1.19 C[Si](C)(C)C1=CC=C(F)C=C1 101954 [1,1,0,0,0,0|1,1,0]=4 32 B11R1.22 CC1=CC=C(C(C)CBr)C=C1 102694 [1,1,0,0,0,0|0,0,0]=2 33 B11R1.22 FC(CBr)C1=CC=C(Cl)C=C1 100184 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.81 CNCC1=CC=C(Cl)C=C1O 19425 [1,1,0,0,0,0|1,0,0]=3 35 B11R1.279 COC1=CC=C(C=O)C=C1O 15839 [1,1,0,0,0,0|1,0,1]=4 36 B11R1.87 CC(C)(O)C1=CC=CC=C1F 102035 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.87 C[Si](C)(C)C1=C(Cl)C=CC=C1 100918 [1,1,0,0,0,0|1,1,0]=4 38 B11R1.87 C[Si](C)(C)C1=C(F)C=CC=C1 100822 [1,1,0,0,0,0|1,1,0]=4 39 B13R1.3800 CC(C)C1=CC=C(Cl)C(=O)C(Cl)=C1 19621 [0,1,0,0,0,1|2,0,0]=4 40 B11R2.363 CC1=CC=C2C(=O)CC2=C1 16221 [1,0,0,1,0,0|1,0,1]=4 41 B11R2.610 CC1=CC(C)=C2CCC2=C1 16692 [1,0,0,1,0,0|1,0,0]=3 42 B11R2.1 CC1C=CC2=CC=CC=C21 16652 [1,0,0,1,0,0|1,0,1]=4 43 B11R2.59 CC1(C)CC2=CC=CC=C21 16581 [1,0,0,1,0,0|1,0,0]=3 44 B11R2.59 CC1(O)CC2=CC=CC=C21 16426 [1,0,0,1,0,0|2,0,0]=4 45 B11R2.468 OC1CC2=CC=CC(F)=C21 16158 [1,0,0,1,0,0|2,0,0]=4 46 B13R2.1944 COC1=C2C(=O)CC2=CC(C)=C1 16238 [0,1,0,1,0,0|1,0,1]=4 47 B13R2.4011 CC1=CC(C)=C2C(=C1)CC2(C)O 16161 [0,1,0,1,0,0|1,0,0]=3 48 B11R1.20 CC(C)CC1=CC=C(O)C=C1 17197 [1,0,0,0,0,1|1,0,0]=3