0 B6R1.1 C1=CN=CC=N1 BBL027560 [0,0,0,0,0,0|0,0,0]=0 1 B6R1.1 C1=CN=NC=C1 BBL027585 [0,0,0,0,0,0|2,0,0]=2 2 B7R1.3 BrC1=CC=CC=N1 BBL027568 [0,1,0,0,0,0|1,0,0]=2 3 B7R1.3 BrC1=CC=NC=C1 BBL009972 [0,1,0,0,0,0|1,0,0]=2 4 B7R1.3 BrC1=CN=CC=C1 BBL027581 [0,1,0,0,0,0|1,0,0]=2 5 B7R1.3 CC1=CC=NC=C1 BBL011459 [0,1,0,0,0,0|1,0,0]=2 6 B7R1.3 ClC1=NC=CC=C1 BBL027569 [0,1,0,0,0,0|1,0,0]=2 7 B7R1.3 ClC1=NC=CN=C1 BBL011919 [0,1,0,0,0,0|0,0,0]=1 8 B7R1.3 FC1=CC=CC=N1 BBL010032 [0,1,0,0,0,0|1,0,0]=2 9 B7R1.3 IC1=CC=NC=C1 BBL009973 [0,1,0,0,0,0|1,0,0]=2 10 B7R1.3 NC1=CC=CC=N1 BBL011573 [0,1,0,0,0,0|1,0,0]=2 11 B7R1.3 OC1=CC=NC=C1 BBL022970 [0,1,0,0,0,0|1,0,0]=2 12 B7R1.3 OC1=CN=CC=C1 BBL010946 [0,1,0,0,0,0|1,0,0]=2 13 B7R1.3 OC1=NC=CC=C1 BBL027571 [0,1,0,0,0,0|1,0,0]=2 14 B7R1.3 SC1=NC=CC=N1 BBL025630 [0,1,0,0,0,0|2,0,0]=3 15 B5R1.1 C1=CNC=C1 BBL011520 [0,0,0,0,1,0|0,0,1]=2 16 B5R1.1 C1=CSC=N1 BBL027512 [0,0,0,0,1,0|1,0,0]=2 17 B7R1.24 C1=CC=CCC=C1 BBL027452 [0,0,0,0,0,1|2,0,0]=3 18 B4R0.2 C\C=C\C=O BBL011428 [1,0,1,0,0,0|1,0,1]=4 19 B6R1.2 BrC1=CNC=N1 BBL011159 [0,1,0,0,1,0|0,0,1]=3 20 B6R1.2 BrC1=NC=CS1 BBL027513 [0,1,0,0,1,0|1,0,0]=3 21 B6R1.2 BrC1=NN=CN1 BBL013240 [0,1,0,0,1,0|1,0,1]=4 22 B6R1.2 CC1=NC=CN1 BBL013047 [0,1,0,0,1,0|0,0,1]=3 23 B6R1.2 CN1C=CN=C1 BBL011447 [0,1,0,0,1,0|0,0,1]=3 24 B6R1.2 ClC1=CC=CS1 BBL027523 [0,1,0,0,1,0|1,0,0]=3 25 B6R1.2 ClC1=NSN=C1 BBL033325 [0,1,0,0,1,0|1,0,0]=3 26 B6R1.2 IC1=NNC=N1 BBL012756 [0,1,0,0,1,0|1,0,0]=3 27 B6R1.2 NC1=CC=NN1 BBL008564 [0,1,0,0,1,0|1,0,0]=3 28 B6R1.2 NC1=CNN=C1 BBL012618 [0,1,0,0,1,0|1,0,0]=3 29 B6R1.2 NC1=NC=CN1 BBL029017 [0,1,0,0,1,0|0,0,1]=3 30 B6R1.2 NC1=NN=NN1 BBL012169 [0,1,0,0,1,0|2,0,0]=4 31 B6R1.2 NC1=NNC=N1 BBL012592 [0,1,0,0,1,0|1,0,0]=3 32 B6R1.2 O=C1C=CCC1 BBL100014 [0,1,0,0,1,0|1,0,1]=4 33 B6R1.2 O=C1NC=NN1 BBL028622 [0,1,0,0,1,0|1,0,1]=4 34 B6R1.2 O=C1OC=CO1 BBL027517 [0,1,0,0,1,0|2,0,0]=4 35 B6R1.2 OC1=NC=NN1 BBL033023 [0,1,0,0,1,0|1,0,0]=3 36 B6R1.2 [NH3+]N1C=NN=C1 BBL002894 [0,1,0,0,1,0|1,0,1]=4 37 B8R1.2 C=CC1=CC=CC=N1 BBL027578 [0,2,0,0,0,0|1,0,0]=3 38 B8R1.2 C=CC1=CC=NC=C1 BBL027584 [0,2,0,0,0,0|1,0,0]=3 39 B8R1.2 COC1=NC=CC=C1 BBL011495 [0,2,0,0,0,0|1,0,0]=3 40 B8R1.2 ClCC1=CC=CC=N1 BBL009975 [0,2,0,0,0,0|1,0,0]=3 41 B8R1.2 N#CC1=CN=CC=C1 BBL037217 [0,2,0,0,0,0|1,0,0]=3 42 B8R1.2 NCC1=CC=CN=C1 BBL036897 [0,2,0,0,0,0|1,0,0]=3 43 B8R1.2 NNC1=CC=CC=C1 BBL011601 [0,2,0,0,0,0|2,0,0]=4 44 B8R1.2 NNC1=NC=CC=C1 BBL027570 [0,2,0,0,0,0|1,0,0]=3 45 B8R1.2 O=CC1=CC=CC=N1 BBL027574 [0,2,0,0,0,0|1,0,0]=3 46 B8R1.2 O=CC1=CC=NC=C1 BBL025920 [0,2,0,0,0,0|1,0,0]=3 47 B8R1.2 OCC1=CC=CC=C1 BBL011938 [0,2,0,0,0,0|2,0,0]=4 48 B8R1.2 [NH3+]CC1=CC=CC=C1 BBL002893 [0,2,0,0,0,0|2,0,0]=4 49 B8R1.3 CC1=CC=C(Cl)N=N1 BBL036277 [0,2,0,0,0,0|2,0,0]=4 50 B8R1.3 CC1=CC=[N+]([O-])C=C1 BBL027567 [0,2,0,0,0,0|1,0,1]=4 51 B8R1.3 CC1=CN=C(S)N=C1 BBL038257 [0,2,0,0,0,0|2,0,0]=4 52 B8R1.3 ClC1=CC=C(Br)C=N1 BBL012798 [0,2,0,0,0,0|1,0,0]=3 53 B8R1.3 FC1=CN=C(Cl)C=C1 BBL029883 [0,2,0,0,0,0|1,0,0]=3 54 B8R1.3 NC1=CC=C(N)C=C1 BBL011602 [0,2,0,0,0,0|2,0,0]=4 55 B8R1.3 NC1=CN=C(Cl)C=C1 BBL011061 [0,2,0,0,0,0|1,0,0]=3 56 B8R1.3 O=C1C=CC(=O)C=C1 BBL010327 [0,2,0,0,0,0|2,0,0]=4 57 B8R1.3 OC1=NC=C(Cl)C=C1 BBL027573 [0,2,0,0,0,0|1,0,0]=3 58 B8R1.4 CC1=CC(C)=NC=C1 BBL027575 [0,2,0,0,0,0|1,0,0]=3 59 B8R1.4 CC1=CC=CC(C)=N1 BBL013176 [0,2,0,0,0,0|1,0,0]=3 60 B8R1.4 NC1=CC(S)=CC=C1 BBL027659 [0,2,0,0,0,0|2,0,0]=4 61 B8R1.4 NC1=CC=CC(N)=N1 BBL011548 [0,2,0,0,0,0|1,0,0]=3 62 B8R1.4 NC1=CC=NC(Cl)=C1 BBL009974 [0,2,0,0,0,0|1,0,0]=3 63 B8R1.4 NC1=NC(Cl)=CN=C1 BBL028064 [0,2,0,0,0,0|0,0,0]=2 64 B8R1.4 NC1=NC=CC(Cl)=C1 BBL011142 [0,2,0,0,0,0|1,0,0]=3 65 B8R1.4 [O-][N+]1=CC=CC(O)=C1 BBL027566 [0,2,0,0,0,0|1,0,1]=4 66 B8R1.5 CC1=C(Br)C=NC=C1 BBL028165 [0,2,0,0,0,0|1,0,0]=3 67 B8R1.5 CC1=CC=NC=C1C BBL027583 [0,2,0,0,0,0|1,0,0]=3 68 B8R1.5 C[N+]1=CC=CC=C1Cl BBL011337 [0,2,0,0,0,0|1,0,1]=4 69 B8R1.5 NC1=C(I)C=CC=C1 BBL011389 [0,2,0,0,0,0|2,0,0]=4 70 B8R1.5 NC1=C(N)C=NC=C1 BBL013269 [0,2,0,0,0,0|1,0,0]=3 71 B8R1.5 NC1=C(O)C=CC=N1 BBL009590 [0,2,0,0,0,0|1,0,0]=3 72 B8R1.5 NC1=C(O)C=CN=C1 BBL011065 [0,2,0,0,0,0|1,0,0]=3 73 B8R1.5 NC1=CC=CN=C1N BBL011063 [0,2,0,0,0,0|1,0,0]=3 74 B8R1.5 OC1=C(O)N=CC=C1 BBL027572 [0,2,0,0,0,0|1,0,0]=3 75 B8R1.5 OC1=CC=CN=C1Br BBL013305 [0,2,0,0,0,0|1,0,0]=3 76 B8R1.49 C1=CC=CC=CC=C1 BBL027453 [0,0,0,0,0,2|2,0,0]=4