0 B8R1.2 NCC1=NC=CN=C1 B050555 [0,1,0,0,0,0|3,0,0]=4 1 B8R1.3 BrC1=CC=C(I)C=N1 B050029 [0,1,0,0,0,0|3,0,0]=4 2 B8R1.3 ClC1=CC=C(Br)C=N1 B050028 [0,1,0,0,0,0|3,0,0]=4 3 B8R1.3 ClC1=CC=C(I)C=N1 B050030 [0,1,0,0,0,0|3,0,0]=4 4 B8R1.4 BrC1=CC(I)=CC=N1 B050026 [0,1,0,0,0,0|1,0,0]=2 5 B8R1.4 BrC1=CC=NC(Br)=C1 B050031 [0,1,0,0,0,0|1,0,0]=2 6 B8R1.4 ClC1=CC=NC(Cl)=C1 B050033 [0,1,0,0,0,0|1,0,0]=2 7 B8R1.4 FC1=CC=NC(Cl)=C1 B050032 [0,1,0,0,0,0|1,0,0]=2 8 B8R1.5 ClC1=C(I)C=CC=N1 B050034 [0,1,0,0,0,0|3,0,0]=4 9 B8R1.5 NC1=C(Br)C=CC=N1 B049992 [0,1,0,0,0,0|2,0,0]=3 10 B6R1.2 BrC1=CNN=C1 B001462 [0,0,0,0,1,0|2,0,0]=3 11 B6R1.2 BrC1=CSN=C1 B049126 [0,0,0,0,1,0|2,0,0]=3 12 B6R1.2 BrC1=NNC=C1 B050964 [0,0,0,0,1,0|2,0,1]=4 13 B6R1.2 CC1=CNN=C1 B014452 [0,0,0,0,1,0|2,0,0]=3 14 B6R1.2 CC1=NN=CN1 B037419 [0,0,0,0,1,0|3,0,0]=4 15 B6R1.2 CC1=NNC=C1 B022230 [0,0,0,0,1,0|2,0,1]=4 16 B6R1.2 CN1C=CC=N1 B006761 [0,0,0,0,1,0|3,0,0]=4 17 B6R1.2 CN1C=CN=C1 B039756 [0,0,0,0,1,0|2,0,0]=3 18 B6R1.2 CN1C=NC=N1 B051876 [0,0,0,0,1,0|3,0,0]=4 19 B6R1.2 ClC1=CNN=C1 B001464 [0,0,0,0,1,0|2,0,0]=3 20 B6R1.2 FC1=CC=CS1 B039753 [0,0,0,0,1,0|2,0,0]=3 21 B6R1.2 IC1=CNN=C1 B037442 [0,0,0,0,1,0|2,0,0]=3 22 B6R1.2 IC1=NNC=C1 B050979 [0,0,0,0,1,0|2,0,1]=4 23 B6R1.2 NC1=CCNN1 B029440 [0,0,0,0,1,0|1,0,2]=4 24 B6R1.2 NC1=CNN=C1 B035785 [0,0,0,0,1,0|1,0,0]=2 25 B6R1.2 NC1=CNN=C1 B035956 [0,0,0,0,1,0|1,0,0]=2 26 B6R1.2 NC1=NC=NS1 B050769 [0,0,0,0,1,0|2,0,0]=3 27 B6R1.2 NC1=NNC=C1 B007331 [0,0,0,0,1,0|1,0,1]=3 28 B6R1.2 NC1=NNC=C1 B037276 [0,0,0,0,1,0|1,0,1]=3 29 B7R1.1 C(=O)C1=CC=NN1 B039168 [0,1,0,0,1,0|2,0,0]=4 30 B7R1.1 CCN1C=CN=C1 B039755 [0,1,0,0,1,0|2,0,0]=4 31 B7R1.1 ClCC1=CC=NO1 B049837 [0,1,0,0,1,0|2,0,0]=4 32 B7R1.1 ClCC1=CN=CS1 B059804 [0,1,0,0,1,0|2,0,0]=4 33 B7R1.1 N#CC1=CNN=C1 B046379 [0,1,0,0,1,0|1,0,1]=4 34 B7R1.1 NCC1=CN=CS1 B059797 [0,1,0,0,1,0|1,0,0]=3 35 B7R1.1 NCC1=CNN=C1 B037991 [0,1,0,0,1,0|1,0,0]=3 36 B7R1.1 NCC1=CNN=C1 B046389 [0,1,0,0,1,0|1,0,0]=3 37 B7R1.1 NCC1=NC=CS1 B059667 [0,1,0,0,1,0|2,0,0]=4 38 B7R1.1 NCC1=NNC=C1 B014395 [0,1,0,0,1,0|1,0,1]=4 39 B7R1.1 O=CC1=CNN=C1 B015969 [0,1,0,0,1,0|2,0,0]=4 40 B7R1.1 O=CC1=CNN=C1 B039241 [0,1,0,0,1,0|2,0,0]=4 41 B7R1.1 OCC1=CNN=C1 B047363 [0,1,0,0,1,0|2,0,0]=4 42 B7R1.2 CC1=CC(I)=NN1 B051816 [0,1,0,0,1,0|2,0,0]=4 43 B7R1.2 CC1=CN(C)C=N1 B046338 [0,1,0,0,1,0|2,0,0]=4 44 B7R1.2 CC1=CN(C)N=C1 B046181 [0,1,0,0,1,0|2,0,0]=4 45 B7R1.2 CC1=NN=C(N)O1 B036399 [0,1,0,0,1,0|2,0,0]=4 46 B7R1.2 CC1=NOC(N)=C1 B030049 [0,1,0,0,1,0|1,0,0]=3 47 B7R1.2 CN1C=C(Br)C=N1 B040735 [0,1,0,0,1,0|2,0,0]=4 48 B7R1.2 CN1C=C(Cl)C=N1 B040734 [0,1,0,0,1,0|2,0,0]=4 49 B7R1.2 CN1C=C(I)C=N1 B047728 [0,1,0,0,1,0|2,0,0]=4 50 B7R1.2 CN1C=C(N)C=N1 B022860 [0,1,0,0,1,0|1,0,0]=3 51 B7R1.2 CN1C=C(N)C=N1 B037105 [0,1,0,0,1,0|1,0,0]=3 52 B7R1.2 CN1C=CC(N)=N1 B014443 [0,1,0,0,1,0|1,0,1]=4 53 B7R1.2 FC1=CC=C(Br)S1 B052433 [0,1,0,0,1,0|2,0,0]=4 54 B7R1.2 FC1=CC=C(I)S1 B052477 [0,1,0,0,1,0|2,0,0]=4 55 B7R1.2 NC1=CC(Br)=NN1 B062305 [0,1,0,0,1,0|1,0,0]=3 56 B7R1.2 NC1=CC(Br)=NN1 B062306 [0,1,0,0,1,0|1,0,0]=3 57 B7R1.2 NC1=CC(I)=NN1 B062381 [0,1,0,0,1,0|1,0,0]=3 58 B7R1.2 NC1=CC(I)=NN1 B062398 [0,1,0,0,1,0|1,0,0]=3 59 B7R1.2 NC1=CC(N)=NN1 B046387 [0,1,0,0,1,0|1,0,0]=3 60 B7R1.2 NC1=CC(O)=NN1 B038492 [0,1,0,0,1,0|1,0,0]=3 61 B7R1.2 NC1=NN=C(Br)S1 B049888 [0,1,0,0,1,0|2,0,0]=4 62 B7R1.2 NC1=NNC(N)=N1 B046189 [0,1,0,0,1,0|2,0,0]=4 63 B7R1.4 CC1=CC=NN1C B006758 [0,1,0,0,1,0|2,0,0]=4 64 B7R1.4 CC1=CN=CN1C B051897 [0,1,0,0,1,0|2,0,0]=4 65 B7R1.4 CC1=CNN=C1N B007334 [0,1,0,0,1,0|1,0,1]=4 66 B7R1.4 CC1=CNN=C1N B039349 [0,1,0,0,1,0|1,0,1]=4 67 B7R1.4 CC1=NC=CN1C B046339 [0,1,0,0,1,0|2,0,0]=4 68 B7R1.4 CC1=NNC=C1Br B030262 [0,1,0,0,1,0|2,0,0]=4 69 B7R1.4 CC1=NNC=C1Cl B020772 [0,1,0,0,1,0|2,0,0]=4 70 B7R1.4 CC1=NNC=C1I B047689 [0,1,0,0,1,0|2,0,0]=4 71 B7R1.4 CC1=NNC=C1N B020740 [0,1,0,0,1,0|1,0,0]=3 72 B7R1.4 CC1=NNC=C1N B047500 [0,1,0,0,1,0|1,0,0]=3 73 B7R1.4 CN1N=CC=C1Br B051184 [0,1,0,0,1,0|2,0,0]=4 74 B7R1.4 CN1N=CC=C1F B052471 [0,1,0,0,1,0|2,0,0]=4 75 B7R1.4 CN1N=CC=C1I B051213 [0,1,0,0,1,0|2,0,0]=4 76 B7R1.4 CN1N=CC=C1N B024266 [0,1,0,0,1,0|1,0,0]=3 77 B7R1.4 CN1N=CC=C1N B029997 [0,1,0,0,1,0|1,0,0]=3 78 B7R1.4 ClC1=CNN=C1Br B062267 [0,1,0,0,1,0|2,0,0]=4 79 B7R1.4 ClC1=CNN=C1I B062281 [0,1,0,0,1,0|2,0,0]=4 80 B7R1.4 NC1=C(Br)C=NN1 B028559 [0,1,0,0,1,0|1,0,0]=3 81 B7R1.4 NC1=C(Cl)C=NN1 B007332 [0,1,0,0,1,0|1,0,0]=3 82 B7R1.4 NC1=C(N)NN=C1 B047068 [0,1,0,0,1,0|1,0,0]=3 83 B7R1.4 NC1=CNN=C1N B036753 [0,1,0,0,1,0|1,0,0]=3 84 B7R1.4 NC1=NNC=C1Br B007333 [0,1,0,0,1,0|1,0,1]=4 85 B7R1.4 NC1=NNC=C1Cl B046412 [0,1,0,0,1,0|1,0,1]=4 86 B7R1.4 NC1=NNC=C1I B051713 [0,1,0,0,1,0|1,0,1]=4 87 B7R1.4 NN1C=NN=C1S B016098 [0,1,0,0,1,0|2,0,0]=4 88 B9R1.1 NCC1=CC=C(N)C=C1 B049905 [0,2,0,0,0,0|1,0,0]=3 89 B9R1.1 NCC1=CC=C(O)C=C1 B039583 [0,2,0,0,0,0|1,0,0]=3 90 B9R1.2 CC1=NC=CC(CN)=N1 B059729 [0,2,0,0,0,0|1,0,0]=3 91 B9R1.2 NC1=NC=CC(CO)=C1 B039501 [0,2,0,0,0,0|1,0,0]=3 92 B9R1.6 CC(N)C1=CC=NC=C1 B006179 [0,2,0,0,0,0|0,0,0]=2 93 B9R1.6 NC(=S)C1=CC=CN=C1 B028584 [0,2,0,0,0,0|2,0,0]=4 94 B9R1.8 CNCC1=CC=CC=N1 B059678 [0,2,0,0,0,0|2,0,0]=4 95 B9R1.8 NOCC1=CC=CC=C1 B022277 [0,2,0,0,0,0|1,0,0]=3 96 B9R1.15 NC1=C(C=O)C=NC=C1 B050347 [0,2,0,0,0,0|0,0,0]=2 97 B9R1.15 NC1=NC=CC=C1C=O B049085 [0,2,0,0,0,0|2,0,0]=4 98 B9R1.69 CC1=NC(C)=C(N)C=C1 B049993 [0,2,0,0,0,0|2,0,0]=4 99 B9R1.69 CC1=NC(N)=CC=C1I B049349 [0,2,0,0,0,0|2,0,0]=4 100 B9R1.69 NC1=CC(Br)=C(F)C=C1 B049228 [0,2,0,0,0,0|1,0,0]=3 101 B9R1.69 NC1=CC(N)=C(N)C=C1 B050159 [0,2,0,0,0,0|1,0,0]=3 102 B9R1.3 ClC1=CN=NC(Cl)=C1Cl B049609 [0,2,0,0,0,0|2,0,0]=4 103 B9R1.3 NC1=CC=CC(N)=C1N B050139 [0,2,0,0,0,0|1,0,0]=3 104 B9R1.3 O=C1NN=CC(Cl)=C1Cl B029197 [0,2,0,0,0,0|2,0,0]=4 105 B9R1.34 CC1=CC(O)=CC(=O)O1 B048736 [0,2,0,0,0,0|2,0,0]=4