0 B9R1.7 CC1=CC=C(N=C=O)S1 8H49-1-X4 [1,0,0,0,0,0|1,1,1]=4 1 B11R2.1 CC1=COC2=CC=CC=C12 2H10-1-25 [0,0,0,1,0,0|3,0,0]=4 2 B11R2.1 CC1=CSC2=CC=CC=C12 5H66-1-03 [0,0,0,1,0,0|3,0,0]=4 3 B11R2.10 BrC1=CC2=CC=CC=C2C1 1900-9-X4 [0,0,0,1,0,0|3,0,0]=4 4 B11R2.10 BrC1=CC2=CC=CC=C2S1 5H66-9-X3 [0,0,0,1,0,0|2,1,0]=4 5 B11R2.10 CC1=CC2=CC=CC=C2N1 3H30-1-A8 [0,0,0,1,0,0|2,0,0]=3 6 B11R2.10 CC1=CC2=CC=CN=C2N1 3H32-1-33 [0,0,0,1,0,0|3,0,0]=4 7 B11R2.10 CC1=NC2=NC=CC=C2O1 4H56-1-305 [0,0,0,1,0,0|2,0,0]=3 8 B11R2.10 ClC1=NC2=CC=CC=C2O1 4H56-5-K6 [0,0,0,1,0,0|3,0,0]=4 9 B11R2.10 NC1=NC2=CC=CC=C2O1 4H30-1-U3 [0,0,0,1,0,0|3,0,0]=4 10 B11R2.10 O=C1CC2=CC=CC=C2O1 2H25-1-44 [0,0,0,1,0,0|2,0,1]=4 11 B11R2.10 O=C1NC2=CC=CC=C2O1 4H56-1-QG [0,0,0,1,0,0|3,0,0]=4 12 B8R1.1 CC1=CC=C(C=O)S1 6H15-1-04 [2,0,0,0,0,0|0,1,0]=3 13 B8R1.1 CC1=CC=C(CO)O1 2H01-1-X2 [2,0,0,0,0,0|0,0,2]=4 14 B8R1.1 CC1=CSC(C=O)=C1 6H15-1-X4 [2,0,0,0,0,0|2,0,0]=4 15 B8R1.1 CC1=CSC(C=O)=N1 8H70-1-M1 [2,0,0,0,0,0|2,0,0]=4 16 B8R1.1 CC1=NC(C=O)=CN1 4H15-1-Q4 [2,0,0,0,0,0|2,0,0]=4 17 B8R1.1 CC1=NC(C=O)=CO1 4H15-1-21 [2,0,0,0,0,0|2,0,0]=4 18 B8R1.1 CC1=NC(C=O)=CS1 8H15-1-X1 [2,0,0,0,0,0|2,0,0]=4 19 B8R1.1 CC1=NC=C(C=O)S1 8H15-1-X5 [2,0,0,0,0,0|1,1,0]=4 20 B8R1.1 CN1C=CC(C=O)=N1 4H15-1-P4 [2,0,0,0,0,0|2,0,0]=4 21 B8R1.1 O=CC1=CC=C(Br)O1 2H15-9-X2 [2,0,0,0,0,0|1,0,0]=3 22 B8R1.1 O=CC1=CC=C(Br)S1 6H66-9-01 [2,0,0,0,0,0|1,1,0]=4 23 B8R1.1 O=CC1=CC=C(Cl)S1 6H15-5-X0 [2,0,0,0,0,0|1,1,0]=4 24 B8R1.1 O=CC1=CC=C(I)O1 2H15-H-X0 [2,0,0,0,0,0|1,0,0]=3 25 B8R1.8 O\N=C/C1=CC=CO1 4H47-1-Y2 [2,0,0,0,0,0|1,0,1]=4 26 B10R1.14 CCC(=O)C1=CC=C(C)O1 2H17-1-0Y [1,1,0,0,0,0|0,0,2]=4 27 B10R1.66 O=C(O)\C=C\C1=CC=CO1 2H21-1-Z9 [1,1,0,0,0,0|0,0,0]=2 28 B10R1.66 O=C(O)\C=C\C1=CC=CS1 6H21-1-Y4 [1,1,0,0,0,0|0,1,0]=3 29 B10R1.66 O=[N+]([O-])\C=C\C1=CC=CO1 4H54-1-T3 [1,1,0,0,0,0|1,0,0]=3 30 B10R1.66 O=[N+]([O-])\C=C\C1=CC=CS1 8H66-1-6A [1,1,0,0,0,0|1,1,0]=4 31 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 2921-1-Y5 [0,1,0,0,0,1|1,0,0]=3 32 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 2921-5-03 [0,1,0,0,0,1|2,0,0]=4 33 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 2921-3-04 [0,1,0,0,0,1|2,0,0]=4 34 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 2929-1-00 [0,1,0,0,0,1|2,0,0]=4 35 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 2929-1-E00 [0,1,0,0,0,1|2,0,0]=4 36 B12R1.226 CC(=O)\C=C/C1=CC=CC(Cl)=C1 2917-5-X1 [0,1,0,0,0,1|2,0,0]=4 37 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=C1 2921-1-31 [0,1,0,0,0,1|1,0,0]=3 38 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 2921-3-03 [0,1,0,0,0,1|2,0,0]=4 39 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 2921-9-X0 [0,1,0,0,0,1|2,0,0]=4 40 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 2921-5-X0 [0,1,0,0,0,1|2,0,0]=4 41 B10R1.61 CC(=O)C1=C(F)C=CC=C1 2617-3-02 [0,0,1,1,0,0|1,0,1]=4 42 B10R1.61 CC(=O)C1=CC=CC=C1C 2717-1-X2 [0,0,1,1,0,0|1,0,1]=4 43 B10R1.61 CC(=O)C1=CC=CC=C1Cl 2617-5-Y8 [0,0,1,1,0,0|1,0,1]=4 44 B10R1.61 CC(=O)C1=CC=CC=C1I 2617-H-X1 [0,0,1,1,0,0|1,0,1]=4 45 B10R1.61 CC(=O)C1=CC=CC=C1N 4648-1-Y8 [0,0,1,1,0,0|1,0,1]=4 46 B10R1.61 CC(=O)C1=CC=CC=C1O 2620-1-X2 [0,0,1,1,0,0|0,0,2]=4 47 B10R1.61 CC(O)C1=C(F)C=CC=C1 2602-3-02 [0,0,1,1,0,0|1,0,1]=4 48 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 2602-3-R2 [0,0,1,1,0,0|1,0,1]=4 49 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 2602-3-S2 [0,0,1,1,0,0|1,0,1]=4 50 B10R1.61 O=C(O)C1=C(F)C=CC=C1 2621-3-02 [0,0,1,1,0,0|2,0,0]=4 51 B10R1.61 O=C(O)C1=C(I)C=CC=C1 2621-H-X6 [0,0,1,1,0,0|2,0,0]=4 52 B10R1.61 O=C(O)C1=CC=CC=C1Br 2621-9-X4 [0,0,1,1,0,0|2,0,0]=4 53 B10R1.61 O=C(O)C1=CC=CC=C1Cl 2621-5-X5 [0,0,1,1,0,0|2,0,0]=4 54 B10R1.61 O=C(O)C1=CC=CC=C1O 2629-1-Y8 [0,0,1,1,0,0|1,0,1]=4 55 B10R1.8 CC1=CC(Br)=CC(C=O)=C1 2715-9-03 [0,0,1,1,0,0|2,0,0]=4 56 B10R1.8 CC1=CC(F)=CC(C=O)=C1 2715-3-02 [0,0,1,1,0,0|2,0,0]=4 57 B10R1.30 C=CC1=CC(C)=CC=C1C 1900-1-Y9 [0,0,1,1,0,0|2,0,0]=4 58 B10R1.30 CC1=C(C=O)C=C(F)C=C1 2715-3-52 [0,0,1,1,0,0|1,0,0]=3 59 B10R1.30 CC1=CC(C=O)=C(F)C=C1 2715-3-X2 [0,0,1,1,0,0|2,0,0]=4 60 B10R1.30 CC1=CC=C(O)C(C=O)=C1 2715-1-00 [0,0,1,1,0,0|2,0,0]=4 61 B10R1.30 CCC1=CC(O)=CC=C1Cl 2701-5-01 [0,0,1,1,0,0|1,0,1]=4 62 B10R1.30 COC1=C(Br)C=CC(O)=C1 2601-9-43 [0,0,1,1,0,0|2,0,0]=4 63 B10R1.30 COC1=CC(O)=CC=C1Cl 2607-5-19 [0,0,1,1,0,0|2,0,0]=4 64 B10R1.30 COC1=CC(O)=CC=C1F 2607-3-2T [0,0,1,1,0,0|2,0,0]=4 65 B10R1.30 COC1=CC(O)=CC=C1O 2607-1-X6 [0,0,1,1,0,0|1,0,1]=4 66 B10R1.30 O=CC1=C(Br)C=CC(F)=C1 2615-B-25 [0,0,1,1,0,0|2,0,0]=4 67 B10R1.30 O=CC1=C(Br)C=CC(O)=C1 2620-9-X4 [0,0,1,1,0,0|1,0,0]=3 68 B10R1.30 O=CC1=C(Cl)C=CC(Br)=C1 2615-D-52 [0,0,1,1,0,0|2,0,0]=4 69 B10R1.30 O=CC1=C(Cl)C=CC(F)=C1 2615-7-X1 [0,0,1,1,0,0|2,0,0]=4 70 B10R1.30 O=CC1=C(F)C=CC(Br)=C1 2615-B-05 [0,0,1,1,0,0|2,0,0]=4 71 B10R1.30 O=CC1=C(F)C=CC(Cl)=C1 2615-7-52 [0,0,1,1,0,0|2,0,0]=4 72 B10R1.30 O=CC1=C(F)C=CC(F)=C1 2615-3-25 [0,0,1,1,0,0|2,0,0]=4 73 B10R1.30 O=CC1=C(F)C=CC(I)=C1 2615-K-25 [0,0,1,1,0,0|2,0,0]=4 74 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 2620-5-X7 [0,0,1,1,0,0|2,0,0]=4 75 B10R1.30 O=CC1=C(O)C=CC(F)=C1 2620-3-52 [0,0,1,1,0,0|2,0,0]=4 76 B10R1.30 O=CC1=C(O)C=CC(O)=C1 2620-1-Y7 [0,0,1,1,0,0|1,0,0]=3 77 B10R1.30 O=CC1=CC(Br)=CC=C1Br 2615-9-07 [0,0,1,1,0,0|2,0,0]=4 78 B10R1.30 O=CC1=CC(Br)=CC=C1I 2615-S-01 [0,0,1,1,0,0|2,0,0]=4 79 B10R1.30 O=CC1=CC(Br)=CC=C1O 2615-9-X7 [0,0,1,1,0,0|2,0,0]=4 80 B10R1.30 O=CC1=CC(Cl)=CC=C1Br P612-A-23 [0,0,1,1,0,0|2,0,0]=4 81 B10R1.30 O=CC1=CC(Cl)=CC=C1Cl 2615-5-X6 [0,0,1,1,0,0|2,0,0]=4 82 B10R1.30 O=CC1=CC(F)=CC=C1I 2615-K-03 [0,0,1,1,0,0|2,0,0]=4 83 B10R1.30 O=CC1=CC(I)=CC=C1Br 2615-S-04 [0,0,1,1,0,0|2,0,0]=4 84 B10R1.30 O=CC1=CC(I)=CC=C1O 2615-H-01 [0,0,1,1,0,0|2,0,0]=4 85 B10R1.30 O=CC1=CC(O)=CC=C1Cl 2615-5-26 [0,0,1,1,0,0|1,0,0]=3 86 B10R1.1 CCOC1=CC=C(F)C=C1 2607-3-44 [0,0,1,1,0,0|1,0,1]=4 87 B10R1.1 CCOC1=CC=C(I)C=C1 2607-H-X0 [0,0,1,1,0,0|1,0,1]=4 88 B10R1.1 CCOC1=CC=C(O)C=C1 2607-1-23 [0,0,1,1,0,0|0,0,2]=4 89 B10R1.2 CC1=CC=CC(C=O)=C1Cl 2715-5-07 [0,0,1,1,0,0|2,0,0]=4 90 B10R1.2 CC1=CC=CC(C=O)=C1F 2715-3-04 [0,0,1,1,0,0|2,0,0]=4 91 B10R2.7 C1=CC=C2NC=CC2=C1 3H31-1-04 [1,0,0,1,0,0|2,0,0]=4 92 B10R2.7 C1=CC=C2OC=CC2=C1 2H10-1-Y6 [1,0,0,1,0,0|1,0,0]=3 93 B10R2.7 C1=CC=C2OC=NC2=C1 4H56-1-X6 [1,0,0,1,0,0|2,0,0]=4 94 B10R2.7 C1=CN=C2C=CNC2=C1 P311-A-55 [1,0,0,1,0,0|2,0,0]=4 95 B10R2.7 C1=CN=C2C=COC2=C1 4H56-1-2M [1,0,0,1,0,0|1,0,0]=3 96 B12R2.606 CC1=CC2=CC(Br)=CC=C2N1 3H31-9-59 [0,1,0,1,0,0|2,0,0]=4 97 B12R2.606 CC1=CC2=CC(Cl)=CC=C2N1 3H31-5-37 [0,1,0,1,0,0|2,0,0]=4 98 B12R2.606 CC1=CC2=CC(F)=CC=C2N1 3H31-3-52 [0,1,0,1,0,0|2,0,0]=4 99 B12R2.606 CC1=CC2=CC(N)=CC=C2N1 3H30-1-U4 [0,1,0,1,0,0|2,0,0]=4 100 B12R2.606 CC1=CC2=CC=C(Cl)C=C2N1 3H31-5-38 [0,1,0,1,0,0|2,0,0]=4 101 B12R2.606 CC1=CC=C2NC(C)=CC2=C1 3H31-1-P2 [0,1,0,1,0,0|2,0,0]=4 102 B12R2.606 CC1=NC2=CC(N)=CC=C2O1 4H30-1-Z7 [0,1,0,1,0,0|2,0,0]=4 103 B12R2.606 CC1=NC2=CC=C(N)C=C2O1 4H30-1-2E [0,1,0,1,0,0|2,0,0]=4 104 B12R2.18 CC1=CC2=CC=CC=C2N1C 3H32-1-5G [0,1,0,1,0,0|2,0,0]=4 105 B12R2.32 CCC1=CC2=CC=CC=C2O1 2H10-1-0V [0,1,0,1,0,0|1,0,0]=3 106 B12R2.32 ClCC1=NC2=CC=CC=C2O1 4H56-5-L5 [0,1,0,1,0,0|2,0,0]=4 107 B12R2.32 O=CC1=CC2=CC=CC=C2O1 2H15-1-07 [0,1,0,1,0,0|1,0,1]=4 108 B12R2.32 OCC1=CC2=CC=CC=C2N1 4H56-1-483 [0,1,0,1,0,0|2,0,0]=4 109 B12R2.32 OCC1=CC2=CC=CC=C2S1 6H01-1-X4 [0,1,0,1,0,0|1,1,0]=4