0 B8R1.7 NC(=O)C1=CC=CO1 16899 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.7 O=C(O)C1=CN=CN1 21322 [0,0,0,0,0,0|2,0,0]=2 2 B8R1.7 O=C(O)C1=CNN=C1 21414 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.7 O=C(O)C1=CSC=C1 1212 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.1 C[Se]C1=CSC=C1 19191 [1,0,0,0,0,0|3,0,0]=4 5 B7R1.1 NCC1=CN=CN1 21313 [1,0,0,0,0,0|2,0,1]=4 6 B9R1.11 COC(=O)C1=CSN=N1 10109 [0,1,0,0,0,0|2,0,1]=4 7 B9R1.11 COC(=O)N1C=CCC1 13476 [0,1,0,0,0,0|2,0,1]=4 8 B9R1.11 NNC(=O)C1=CC=CO1 517 [0,1,0,0,0,0|2,0,0]=3 9 B9R1.19 C[Si](C)(C)C1=CC=CO1 102395 [0,1,0,0,0,0|2,1,0]=4 10 B9R1.35 CC1=NN(C(N)=O)C=C1 16678 [0,1,0,0,0,0|2,0,1]=4 11 B9R1.41 CC1=C(C(N)=O)OC=N1 13733 [0,1,0,0,0,0|3,0,0]=4 12 B9R1.41 CC1=CC=NN1C(N)=O 16679 [0,1,0,0,0,0|2,0,1]=4 13 B7R0.4 CC(=O)OC\C=C/Br 103141 [0,0,1,0,0,0|2,0,1]=4 14 B9R1.6 NC(=S)C1=CC=CN=C1 20784 [0,0,0,0,0,1|1,1,1]=4 15 B9R1.6 O=C(O)C1=CC=CC=C1 15736 [0,0,0,0,0,1|2,0,0]=3 16 B9R1.6 O=C(O)C1=CC=CN=C1 20778 [0,0,0,0,0,1|1,0,1]=3 17 B9R1.13 CC(=O)NC1=NN=CS1 22386 [0,0,0,0,0,1|2,0,1]=4 18 B9R1.13 N(C(C)=O)C1=NC=CS1 20692 [0,0,0,0,0,1|1,0,1]=3 19 B6R1.2 CC1=NNC=C1 16756 [2,0,0,0,0,0|1,0,1]=4 20 B6R1.2 O=C1C=CCC1 16113 [2,0,0,0,0,0|1,0,1]=4 21 B8R0.6 C\C=C\C=C\C(=O)OC 102289 [0,1,1,0,0,0|1,0,0]=3 22 B8R0.7 C\C=C\C=C\C=C(C)C 102628 [0,1,1,0,0,0|2,0,0]=4 23 B8R0.20 C=CN(C=C)C(=O)CCl 100881 [0,1,1,0,0,0|2,0,0]=4 24 B10R1.13 CC(=O)C1=CNC(=O)CC1 13376 [0,1,0,0,0,1|0,0,2]=4 25 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15778 [0,1,0,0,0,1|2,0,0]=4 26 B10R1.13 NC(=O)C1=CC=C(Cl)N=C1 20768 [0,1,0,0,0,1|1,0,1]=4 27 B10R1.13 O=C(O)C1=CC=C(F)C=C1 101191 [0,1,0,0,0,1|2,0,0]=4 28 B10R1.13 O=C(O)C1=CC=C(F)C=N1 100749 [0,1,0,0,0,1|1,0,1]=4 29 B10R1.13 O=C(O)C1=CC=C(O)C=C1 15302 [0,1,0,0,0,1|2,0,0]=4 30 B10R1.13 O=C(O)C1=CN=C(F)C=C1 100678 [0,1,0,0,0,1|1,0,1]=4 31 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 101615 [0,1,0,0,0,1|1,0,1]=4 32 B10R1.15 C#CC(=O)C1=CC=CC=C1 20316 [0,1,0,0,0,1|1,0,1]=4 33 B10R1.15 CNC(=O)C1=CC=CC=C1 20760 [0,1,0,0,0,1|1,0,0]=3 34 B10R1.15 C\C(=C/Cl)C1=CC=CC=C1 103092 [0,1,0,0,0,1|2,0,0]=4 35 B10R1.15 C\C(=N/O)C1=CC=CC=C1 16747 [0,1,0,0,0,1|1,0,1]=4 36 B10R1.15 C\C=C(\C)C1=CC=CC=C1 103072 [0,1,0,0,0,1|2,0,0]=4 37 B10R1.15 O=C(CBr)C1=CC=CC=C1 18427 [0,1,0,0,0,1|1,0,0]=3 38 B10R1.61 CC1=C(C(=O)O)C=NC=C1 15747 [0,1,0,0,0,1|1,0,1]=4 39 B10R1.61 CC1=C(C(=O)O)C=NC=C1 15765 [0,1,0,0,0,1|1,0,1]=4 40 B10R1.61 CC1=C(C(N)=O)C=NC=C1 15751 [0,1,0,0,0,1|1,0,1]=4 41 B10R1.61 CC1=CC=CC=C1C(=O)Br 16795 [0,1,0,0,0,1|2,0,0]=4 42 B10R1.61 N1C=CC=C([N+](=O)[O-])C1=O 20547 [0,1,0,0,0,1|2,0,0]=4 43 B10R1.61 NC(=O)C1=CC=CC=C1F 102470 [0,1,0,0,0,1|2,0,0]=4 44 B10R1.61 NC(=O)C1=CC=CC=C1I 10354 [0,1,0,0,0,1|2,0,0]=4 45 B10R1.61 NC1=CC=CC=C1C(=O)O 22066 [0,1,0,0,0,1|2,0,0]=4 46 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 101190 [0,1,0,0,0,1|2,0,0]=4 47 B10R1.61 O=C(O)C1=C(F)C=CC=N1 100687 [0,1,0,0,0,1|1,0,1]=4 48 B10R1.61 O=C(O)C1=C(F)C=NC=C1 100632 [0,1,0,0,0,1|2,0,0]=4 49 B10R1.61 O=C(O)C1=C(F)N=CC=C1 100686 [0,1,0,0,0,1|1,0,1]=4 50 B10R1.61 O=C(O)C1=C(O)C=CC=C1 15776 [0,1,0,0,0,1|2,0,0]=4 51 B10R1.61 O=C(O)C1=CC=CC=C1F 100197 [0,1,0,0,0,1|2,0,0]=4 52 B10R1.61 O=C(O)C1=CC=NC=C1Cl 100086 [0,1,0,0,0,1|2,0,0]=4 53 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 15663 [0,1,0,0,0,1|1,0,1]=4 54 B10R1.113 NC(=O)C1=CC=CC(F)=C1 102469 [0,1,0,0,0,1|2,0,0]=4 55 B10R1.113 O=C(O)C1=CC(F)=NC=C1 100685 [0,1,0,0,0,1|2,0,0]=4 56 B10R1.113 O=C(O)C1=CC(O)=CC=C1 18167 [0,1,0,0,0,1|2,0,0]=4 57 B10R1.113 O=C(O)C1=CC=CC(F)=N1 100675 [0,1,0,0,0,1|1,0,1]=4 58 B10R1.113 O=C(O)C1=CN=CC(F)=C1 100682 [0,1,0,0,0,1|1,0,1]=4 59 B10R1.14 COC(=O)C1=CC(C)=NN1 16675 [0,2,0,0,0,0|1,0,0]=3 60 B10R1.14 COC(=O)C1=NNC(C)=C1 19851 [0,2,0,0,0,0|1,0,1]=4 61 B10R1.14 COC(=O)N1=CC=C(C)N1 16785 [0,2,0,0,0,0|1,0,0]=3 62 B10R1.14 COC(=O)N1C=CC(C)=N1 16687 [0,2,0,0,0,0|1,0,1]=4 63 B10R1.149 COC(=O)C1=C(C)C=CO1 21147 [0,2,0,0,0,0|1,0,0]=3 64 B10R1.149 COC(=O)N1N=CC=C1C 16784 [0,2,0,0,0,0|1,0,1]=4 65 B8R1.4 CC1=CC=CC(I)=N1 100813 [0,0,1,1,0,0|2,0,0]=4 66 B8R1.4 NC1=CC(F)=CC=C1 20479 [0,0,1,1,0,0|1,0,1]=4 67 B8R1.4 NC1=CC=CC(N)=C1 21487 [0,0,1,1,0,0|1,0,1]=4 68 B8R1.4 NC1=NC(F)=CC=C1 101259 [0,0,1,1,0,0|2,0,0]=4 69 B8R1.5 NC1=CC=CC=C1N 22078 [0,0,1,1,0,0|1,0,1]=4 70 B8R1.5 NC1=CC=CN=C1Cl 20953 [0,0,1,1,0,0|2,0,0]=4 71 B10R2.320 O=C1CC2=CC=CC=C12 16218 [0,0,0,1,0,1|1,0,0]=3 72 B10R1.18 CC(=O)CC1=CC=CC=C1 12126 [0,0,0,0,0,2|1,0,0]=3 73 B10R1.18 CC(=O)NC1=CC=CC=C1 20132 [0,0,0,0,0,2|1,0,0]=3 74 B10R1.18 O=C(O)CC1=CC=CC=C1 12288 [0,0,0,0,0,2|2,0,0]=4 75 B10R1.18 O=C(O)CC1=CC=CC=C1 15735 [0,0,0,0,0,2|2,0,0]=4 76 B10R1.66 NC(=O)\C=C\C1=CC=CO1 16902 [0,0,0,0,0,2|2,0,0]=4 77 B10R1.66 O=C(O)C=CC1=CC=CO1 13414 [0,0,0,0,0,2|2,0,0]=4