0 B6R0.5 CS(=O)(=O)CCN AC-8328 [0,0,0,0,0,0|2,0,0]=2 1 B6R0.5 O=S(=O)(O)CCO AC-538 [0,0,0,0,0,0|0,1,0]=1 2 B6R0.5 O=S(=O)([O-])CCS AC-6011 [0,0,0,0,0,0|0,0,1]=1 3 B5R0.1 C#CCC(=O)O AC-30551 [1,0,0,0,0,0|2,0,1]=4 4 B5R0.1 C(Cl)CC(=O)O AC-16131 [1,0,0,0,0,0|2,0,0]=3 5 B5R0.1 C[C@@H](O)CCO AC-5640 [1,0,0,0,0,0|2,1,0]=4 6 B5R0.1 O=C(O)CCS AC-4722 [1,0,0,0,0,0|1,0,0]=2 7 B5R0.4 CC[PH](N)(=O)=O AC-8947 [1,0,0,0,0,0|2,0,0]=3 8 B5R0.4 NCS(=O)(=O)O AC-9853 [1,0,0,0,0,0|1,0,0]=2 9 B5R0.4 NOS(=O)(=O)O AC-4443 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.8 CCCNS(N)(=O)=O AC-29731 [0,1,0,0,0,0|2,0,0]=3 11 B7R0.8 CCC[N-]S(N)(=O)=O AC-29733 [0,1,0,0,0,0|2,0,0]=3 12 B7R0.8 CS(=O)(=O)CCC#N AC-36465 [0,1,0,0,0,0|2,0,0]=3 13 B7R0.8 O=S(=O)([O-])CCCS AC-32134 [0,1,0,0,0,0|0,0,1]=2 14 B7R1.26 NS(=O)(=O)C1CC1 AC-296 [0,0,0,1,0,0|2,0,0]=3 15 B7R1.26 O=S(=O)(Cl)C1CC1 AC-1501 [0,0,0,1,0,0|2,0,0]=3 16 B6R0.1 C(Cl)CC(=O)OC AC-16132 [1,1,0,0,0,0|2,0,0]=4 17 B6R0.1 COC(=O)CCN AC-22369 [1,1,0,0,0,0|2,0,0]=4 18 B6R0.2 CC(O)CC(=O)O AC-5701 [1,1,0,0,0,0|1,1,0]=4 19 B6R0.2 C[C@@H](N)CC(=O)O AC-22067 [1,1,0,0,0,0|2,0,0]=4 20 B6R0.2 C[C@H](N)CC(=O)O AC-5698 [1,1,0,0,0,0|2,0,0]=4 21 B6R0.3 CC[C@@H](N)C(=O)O AC-1209 [1,1,0,0,0,0|2,0,0]=4 22 B6R0.3 CC[C@H](N)C(=O)O AC-23985 [1,1,0,0,0,0|2,0,0]=4 23 B6R0.3 C[C@H](CO)C(=O)O AC-9519 [1,1,0,0,0,0|1,1,0]=4 24 B6R0.3 NC(CO)C(=O)O AC-24074 [1,1,0,0,0,0|1,1,0]=4 25 B6R0.3 NCC(N)C(=O)O AC-22379 [1,1,0,0,0,0|2,0,0]=4 26 B6R0.3 NCC(N)C(=O)O AC-5659 [1,1,0,0,0,0|2,0,0]=4 27 B6R0.3 NC[C@@H](N)C(=O)O AC-5660 [1,1,0,0,0,0|2,0,0]=4 28 B6R0.3 NC[C@H](N)C(=O)O AC-5654 [1,1,0,0,0,0|2,0,0]=4 29 B6R0.3 N[C@@H](CCl)C(=O)O AC-22368 [1,1,0,0,0,0|2,0,0]=4 30 B6R0.3 N[C@@H](CCl)C(=O)O AC-8102 [1,1,0,0,0,0|2,0,0]=4 31 B6R0.3 N[C@@H](CS)C(=O)O AC-12796 [1,1,0,0,0,0|1,0,0]=3 32 B6R0.3 N[C@H](CO)C(=O)O AC-24073 [1,1,0,0,0,0|1,1,0]=4 33 B6R0.3 N[C@H](CS)C(=O)O AC-7470 [1,1,0,0,0,0|1,0,0]=3 34 B6R0.3 N[C@H](CS)C(=O)O AC-7471 [1,1,0,0,0,0|1,0,0]=3 35 B6R0.3 OC(=O)[C@H](CO)N AC-1190 [1,1,0,0,0,0|1,1,0]=4 36 B6R0.3 [C@H](N)(CC)C(=O)O AC-1817 [1,1,0,0,0,0|2,0,0]=4 37 B6R0.4 O=C(O)CCCBr AC-6279 [1,1,0,0,0,0|2,0,0]=4 38 B6R0.7 CN(C)S(N)(=O)=O AC-6948 [1,1,0,0,0,0|2,0,0]=4 39 B8R0.25 CCCNS(=O)(=O)N[K] AC-29732 [0,2,0,0,0,0|2,0,0]=4 40 B8R0.33 O=S(=O)(O)OC(F)(F)F AC-20399 [0,2,0,0,0,0|2,0,0]=4 41 B8R1.51 C[C@@H]1COS(=O)(=O)O1 AC-30494 [0,1,0,1,0,0|1,0,0]=3 42 B8R1.51 C[C@H]1COS(=O)(=O)O1 AC-30495 [0,1,0,1,0,0|1,0,0]=3 43 B8R1.55 NS(=O)(=O)N1CCC1 AC-31564 [0,1,0,1,0,0|2,0,0]=4 44 B8R1.72 O=S1(=O)CCNCC1 AC-23959 [0,1,0,1,0,0|2,0,0]=4 45 B8R1.72 O=S1(=O)CCNCC1 AC-8258 [0,1,0,1,0,0|2,0,0]=4 46 B8R1.70 CC1(S(N)(=O)=O)CC1 AC-30862 [0,1,0,1,0,0|2,0,0]=4