0 B11R2.1 BrC1=NOC2=NC=CC=C12 20690 [1,0,0,0,0,0|3,0,0]=4 1 B11R2.1 CC1=CCC2=CC=CC=C12 16664 [1,0,0,0,0,0|3,0,0]=4 2 B11R2.1 ClC1=NN=C2C=CC=CC12 20517 [1,0,0,0,0,0|1,0,2]=4 3 B11R2.1 ClC1=NOC2=C1C=CC=N2 20480 [1,0,0,0,0,0|3,0,0]=4 4 B11R2.1 OC1=NN=C2C=CC=CN12 20582 [1,0,0,0,0,0|1,0,1]=3 5 B11R2.1 [N-]=[N+]1ONC2=CC=CC=C21 22285 [1,0,0,0,0,0|3,0,0]=4 6 B13R2.11642 N1N=C(N)C2=C(C)C=C(C)N=C21 20681 [0,1,0,0,0,0|3,0,0]=4 7 B11R1.22 ON=C(Cl)C1=CC=C(Cl)C=C1 20114 [0,0,1,0,0,0|2,1,0]=4 8 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 102172 [0,0,1,0,0,0|3,0,0]=4 9 B11R1.166 CC1=CC=C(C(=O)O)C(C)=C1 15222 [0,0,1,0,0,0|3,0,0]=4 10 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=N1 100668 [0,0,1,0,0,0|3,0,0]=4 11 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 101300 [0,0,1,0,0,0|2,1,0]=4 12 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 101178 [0,0,1,0,0,0|2,0,0]=3 13 B11R1.166 O=C(O)C1=CC=C(Cl)C=C1O 101171 [0,0,1,0,0,0|2,1,0]=4 14 B11R1.166 O=C(O)C1=CC=C(F)C=C1F 102048 [0,0,1,0,0,0|2,0,0]=3 15 B11R1.166 O=C(O)C1=CC=C(F)N=C1F 100238 [0,0,1,0,0,0|3,0,0]=4 16 B11R1.166 O=C(O)C1=CC=C(I)C=C1F 102972 [0,0,1,0,0,0|2,1,0]=4 17 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl 101155 [0,0,1,0,0,0|3,0,0]=4 18 B11R1.166 O=C(O)C1=CC=C(O)C=C1F 101158 [0,0,1,0,0,0|3,0,0]=4 19 B11R1.166 O=C(O)C1=CN=C(F)C=C1F 100664 [0,0,1,0,0,0|3,0,0]=4 20 B11R2.363 CC1=CC=C2C(=O)CC2=C1 16221 [0,0,0,0,1,0|2,0,1]=4 21 B13R2.3683 NC1=CC=C2C=C(O)C=CC2=C1 10794 [0,0,0,0,0,1|3,0,0]=4 22 B13R2.3683 OC1=CC2=CC=C(Cl)C=C2C=C1 10896 [0,0,0,0,0,1|2,1,0]=4 23 B10R1.1 O\N=CC1=CC=C(Br)C=C1 20648 [1,0,1,0,0,0|1,1,0]=4 24 B10R1.1 O\N=CC1=CC=C(C)C=C1 20713 [1,0,1,0,0,0|2,0,0]=4 25 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 19845 [1,0,1,0,0,0|1,1,0]=4 26 B10R1.1 O\N=C\C1=CC=C(O)C=C1 15709 [1,0,1,0,0,0|2,0,0]=4 27 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15778 [1,0,1,0,0,0|2,0,0]=4 28 B10R1.13 O=C(O)C1=CC=C(F)C=C1 101191 [1,0,1,0,0,0|1,0,0]=3 29 B10R1.13 O=C(O)C1=CC=C(F)C=N1 100749 [1,0,1,0,0,0|2,0,0]=4 30 B10R1.13 O=C(O)C1=CC=C(O)C=C1 15302 [1,0,1,0,0,0|2,0,0]=4 31 B10R1.13 O=C(O)C1=CN=C(F)C=C1 100678 [1,0,1,0,0,0|2,0,0]=4 32 B10R1.15 C\C(=N/O)C1=CC=CC=C1 16747 [1,0,1,0,0,0|2,0,0]=4 33 B10R1.15 NCC(O)C1=CC=CC=C1 12321 [1,0,1,0,0,0|1,0,1]=4 34 B10R1.15 N\C(=N\O)C1=CC=CC=C1 12254 [1,0,1,0,0,0|2,0,0]=4 35 B10R1.15 O\N=C(\O)C1=CC=CC=C1 12250 [1,0,1,0,0,0|1,0,0]=3 36 B10R1.10 O\N=C\C1=CC=CC(Br)=C1 102460 [1,0,1,0,0,0|1,1,0]=4 37 B10R1.10 O\N=C\C1=CC=CC(Cl)=C1 102223 [1,0,1,0,0,0|1,1,0]=4 38 B10R1.10 O\N=C\C1=CC=CC(O)=C1 102535 [1,0,1,0,0,0|2,0,0]=4 39 B10R1.17 O=CNNC1=CC=CC=C1 16370 [1,0,1,0,0,0|0,0,2]=4 40 B10R1.61 NC1=CC=CC=C1C(=O)O 22066 [1,0,1,0,0,0|1,0,0]=3 41 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 101190 [1,0,1,0,0,0|2,0,0]=4 42 B10R1.61 O=C(O)C1=C(O)C=CC=C1 15776 [1,0,1,0,0,0|2,0,0]=4 43 B10R1.61 O=C(O)C1=CC=CC=C1F 100197 [1,0,1,0,0,0|2,0,0]=4 44 B10R2.7 N1N=CC2=CC=CN=C21 20622 [2,0,0,0,0,0|1,0,0]=3 45 B12R1.232 O=C(O)C1=C(F)C=C(F)C(Br)=C1 102778 [0,1,1,0,0,0|2,0,0]=4 46 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1O 102819 [0,1,1,0,0,0|2,0,0]=4 47 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1F 102970 [0,1,1,0,0,0|2,0,0]=4 48 B12R1.232 O=C(O)C1=CC(O)=C(F)C=C1F 100027 [0,1,1,0,0,0|2,0,0]=4 49 B12R1.893 O=C(O)C1=C(O)C(Cl)=C(F)C=C1 100038 [0,1,1,0,0,0|2,0,0]=4 50 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1F 100052 [0,1,1,0,0,0|2,0,0]=4 51 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1O 102821 [0,1,1,0,0,0|2,0,0]=4 52 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1Br 102783 [0,1,1,0,0,0|2,0,0]=4 53 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1F 100046 [0,1,1,0,0,0|2,0,0]=4 54 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1O 100036 [0,1,1,0,0,0|2,0,0]=4 55 B12R2.1 COC1=CCC2=CC=CC=C21 16665 [1,1,0,0,0,0|2,0,0]=4 56 B12R2.18 C=C1C(=O)NC2=CC=CC=C12 18545 [1,1,0,0,0,0|2,0,0]=4 57 B12R2.18 CC1=C(C)C2=CC=CC=C2N1 16046 [1,1,0,0,0,0|2,0,0]=4 58 B12R2.18 O=C1NC2=CC=CC=C2C1=O 20896 [1,1,0,0,0,0|1,0,1]=4 59 B14R2.8239 O=C1NC2=CC(F)=CC=C2C=C1F 101681 [0,1,0,0,0,1|2,0,0]=4 60 B10R2.320 O=C1CC2=CC=CC=C12 16218 [1,0,0,0,1,0|1,0,1]=4 61 B10R2.320 OC1CC2=CC=CC=C21 16154 [1,0,0,0,1,0|1,0,1]=4