0 B10R1.58 CC1=C(C)SC(C(F)F)=C1 5H66-3-00 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.58 CN1C=C([N+](=O)[O-])N=C1Cl 4H54-5-4U [0,0,0,0,0,0|3,0,1]=4 2 B10R1.58 CN1N=C(C(=O)O)C=C1N 4H58-1-AM [0,0,0,0,0,0|4,0,0]=4 3 B10R1.58 FC(F)C1=CC(Br)=C(Cl)S1 5H66-F-00 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.35 CC(=O)C1=CC(C)=NS1 8H15-1-0F [1,0,0,0,0,0|2,0,0]=3 5 B9R1.35 CC(=O)C1=CC=C(Br)O1 2H17-9-30 [1,0,0,0,0,0|1,2,0]=4 6 B9R1.35 CC(=O)C1=NC=C(Br)S1 8H70-9-16 [1,0,0,0,0,0|2,1,0]=4 7 B9R1.35 CC1=CSC(C(F)F)=C1 5H66-3-06 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.35 FC(F)C1=CC=C(Cl)S1 5H66-7-00 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.35 NC(=O)C1=NN=C(Cl)S1 8H48-5-0C [1,0,0,0,0,0|3,0,0]=4 10 B9R1.35 NC1=NC(C(=O)O)=CN1 4H57-1-0E [1,0,0,0,0,0|3,0,0]=4 11 B9R1.35 O=C(O)C1=CC(I)=CN1 4H21-H-0D [1,0,0,0,0,0|2,0,0]=3 12 B11R1.672 CC1=C(Br)C(C)=C(C(=O)O)N1 4H21-9-0N [0,1,0,0,0,0|2,1,0]=4 13 B11R1.672 CC1=C(Br)NC(C(=O)O)=C1C 4H21-9-0M [0,1,0,0,0,0|1,1,0]=3 14 B11R1.21 CC(=O)C1=CC(O)=C(Cl)C=C1 2617-5-1G [0,0,0,0,0,1|3,0,0]=4 15 B11R1.21 CC(=O)C1=CC=C(C)C(N)=C1 4756-1-1S [0,0,0,0,0,1|3,0,0]=4 16 B11R1.21 CC(=O)C1=CC=C(N)C(Cl)=C1 4656-5-2D [0,0,0,0,0,1|3,0,0]=4 17 B11R1.21 CC1=CC(C(N)=O)=NC=C1Br 4H48-9-0S [0,0,0,0,0,1|2,1,0]=4 18 B11R1.21 NC1=CC(C(=O)O)=CN=C1N 4H57-1-15 [0,0,0,0,0,1|3,0,0]=4 19 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br 4H57-1-72 [0,0,0,0,0,1|2,1,0]=4 20 B11R1.21 O=C(Cl)C1=CN=C(Cl)C(Br)=C1 4H16-D-00 [0,0,0,0,0,1|3,0,0]=4 21 B11R1.21 O=C(O)C1=CN=C(O)C(O)=C1 4H58-1-499 [0,0,0,0,0,1|3,0,0]=4 22 B11R1.74 CC1=CC(B(O)O)=CC(Cl)=N1 8H60-5-0B [0,0,0,0,0,1|2,0,1]=4 23 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 4H21-5-19 [0,0,0,0,0,1|1,0,0]=2 24 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=N1 4H58-5-BS [0,0,0,0,0,1|3,0,0]=4 25 B8R1.1 CC1=CC(C=O)=NN1 4H15-1-7M [2,0,0,0,0,0|2,0,0]=4 26 B8R1.1 CC1=CC=C(C=O)N1 4H15-1-7U [2,0,0,0,0,0|2,0,0]=4 27 B8R1.1 CC1=CN=C(C=O)S1 8H70-1-Y8 [2,0,0,0,0,0|2,0,0]=4 28 B8R1.1 CC1=CNC(C=O)=C1 4H15-1-4K [2,0,0,0,0,0|1,0,0]=3 29 B8R1.1 CC1=CNC(C=O)=N1 4H15-1-7G [2,0,0,0,0,0|2,0,0]=4 30 B8R1.1 CC1=NSC(C=O)=C1 8H15-1-0J [2,0,0,0,0,0|1,0,0]=3 31 B8R1.1 ClCC1=CC=C(Cl)S1 5H66-5-12 [2,0,0,0,0,0|1,0,1]=4 32 B8R1.1 O=CC1=CC(I)=CS1 6H15-H-00 [2,0,0,0,0,0|1,0,0]=3 33 B8R1.1 O=CC1=CC(O)=CS1 6H15-1-0J [2,0,0,0,0,0|1,0,0]=3 34 B8R1.1 O=CC1=CC=C(O)S1 6H15-1-0H [2,0,0,0,0,0|1,0,0]=3 35 B10R1.14 COC(=O)C1=CC(O)=CS1 6H23-1-0V [1,1,0,0,0,0|1,0,0]=3 36 B10R1.14 COC(=O)C1=CC=C(Cl)O1 2H23-5-0B [1,1,0,0,0,0|0,1,0]=3 37 B10R1.14 COC(=O)C1=CN(C)C=C1 4H23-1-GT [1,1,0,0,0,0|2,0,0]=4 38 B10R1.14 COC(=O)C1=CNC(C)=C1 4H23-1-KY [1,1,0,0,0,0|2,0,0]=4 39 B10R1.14 COC(=O)C1=NC=C(C)S1 8H23-1-0R [1,1,0,0,0,0|2,0,0]=4 40 B10R1.31 CCC1=NOC(C(=O)O)=C1 4H58-1-208 [1,1,0,0,0,0|1,1,0]=4 41 B10R1.59 CC1=C(C(=O)O)SC(Br)=N1 8H70-9-03 [1,1,0,0,0,0|1,1,0]=4 42 B10R1.194 CC1=NSC(C(=O)O)=C1Br 8H70-9-22 [1,1,0,0,0,0|1,0,0]=3 43 B12R1.56 CC1=CC=C(C(=O)O)C=C1C=O 2721-1-1Y [0,1,0,0,0,1|2,0,0]=4 44 B12R1.232 CC1=C(C)C=C(C(=O)O)C(N)=C1 4757-1-57 [0,1,0,0,0,1|2,0,0]=4 45 B12R1.232 CC1=CC(C(=O)Cl)=C(F)C=C1Cl 2716-7-29 [0,1,0,0,0,1|2,0,0]=4 46 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1O 2729-1-81 [0,1,0,0,0,1|2,0,0]=4 47 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1Cl 2721-7-07 [0,1,0,0,0,1|1,0,0]=3 48 B12R1.232 CC1=NC(O)=C(C(=O)O)C=C1Cl 4H21-5-3M [0,1,0,0,0,1|1,0,0]=3 49 B12R1.232 NC1=NC(N)=C(C(=O)O)N=C1Cl 4H58-5-7R [0,1,0,0,0,1|2,0,0]=4 50 B12R1.367 COC(=O)C1=CN=C(Cl)C(C)=N1 4H58-5-3B [0,1,0,0,0,1|2,0,0]=4 51 B12R1.367 COC(=O)C1=CN=C(O)C(C)=C1 4H58-1-337 [0,1,0,0,0,1|2,0,0]=4 52 B12R1.893 CC1=C(Br)C=CC(C(=O)O)=C1F 2721-B-33 [0,1,0,0,0,1|1,1,0]=4 53 B12R1.893 CC1=C(C)C(C(=O)O)=CC=C1F 2721-3-0K [0,1,0,0,0,1|1,1,0]=4 54 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1Cl 2621-7-0J [0,1,0,0,0,1|2,0,0]=4 55 B12R1.11 CC1=CC(C#N)=CC(C(=O)O)=C1 4737-1-0Y [0,1,0,0,0,1|2,0,0]=4 56 B12R1.11 CC1=CC(C(=O)O)=CC(C=O)=C1 2721-1-3T [0,1,0,0,0,1|2,0,0]=4 57 B12R1.11 O=C(O)C1=CC(CO)=CC(Cl)=C1 2629-5-42 [0,1,0,0,0,1|1,0,0]=3 58 B12R1.358 COC(=O)C1=CC(C)=CC(F)=C1 2723-3-0M [0,1,0,0,0,1|1,1,0]=4 59 B12R1.358 COC(=O)C1=CC(C)=CC(O)=C1 2729-1-0S [0,1,0,0,0,1|2,0,0]=4 60 B12R1.511 O=C(O)C1=C(Cl)C(F)=CC(Cl)=C1 2621-7-0G [0,1,0,0,0,1|2,0,0]=4 61 B12R1.511 O=C(O)C1=CC(Cl)=CC(Br)=C1O 2629-D-0A [0,1,0,0,0,1|2,0,0]=4 62 B12R1.511 O=C(O)C1=CC(Cl)=CC(Cl)=C1F 2621-7-08 [0,1,0,0,0,1|2,0,0]=4 63 B12R1.111 CC1=C(C(F)F)SC(C(=O)O)=C1 6H66-3-21 [0,2,0,0,0,0|0,1,0]=3 64 B12R1.766 COC1=C(C(=O)O)SC(Br)=C1Br 6H66-9-0A [0,2,0,0,0,0|1,1,0]=4 65 B10R1.13 O=C1C=CC(C(=O)Cl)=CO1 2H16-5-08 [0,0,1,1,0,0|0,1,1]=4 66 B10R1.54 O=C(O)CC1=NC(Cl)=CS1 8H70-5-23 [1,0,0,0,0,1|2,0,0]=4 67 B12R1.101 CC1=CC(Br)=CC(CC(=O)O)=C1 2721-9-17 [0,0,0,0,0,2|1,1,0]=4