0 B6R0.7 CC(=O)C(C)(C)O Z939661728 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.7 CC(C)(F)C(=O)O Z1201622349 [0,0,0,0,0,0|4,0,0]=4 2 B6R0.7 CC(C)(N)C(=O)O Z317024776 [0,0,0,0,0,0|4,0,0]=4 3 B6R0.7 CC(Cl)(Cl)C(=O)O Z1205493591 [0,0,0,0,0,0|4,0,0]=4 4 B6R0.7 O=C(O)C(Cl)(Cl)Cl Z104473288 [0,0,0,0,0,0|4,0,0]=4 5 B6R0.7 O=C(O)C(F)(F)Br Z328621122 [0,0,0,0,0,0|4,0,0]=4 6 B6R0.7 O=C(O)C(F)(F)Cl Z1270446583 [0,0,0,0,0,0|4,0,0]=4 7 B6R0.7 O=C(O)C(F)(F)F Z1834265899 [0,0,0,0,0,0|4,0,0]=4 8 B5R0.5 C=C(Cl)C(=O)O Z1201617183 [1,0,0,0,0,0|3,0,0]=4 9 B5R0.5 CC(=O)C(=O)O Z104495240 [1,0,0,0,0,0|2,0,0]=3 10 B5R0.5 CC(Br)C(=O)O Z57127555 [1,0,0,0,0,0|3,0,0]=4 11 B5R0.5 CC(C)C(=O)O Z104473380 [1,0,0,0,0,0|3,0,0]=4 12 B5R0.5 CC(Cl)C(=O)O Z147646840 [1,0,0,0,0,0|3,0,0]=4 13 B5R0.5 CC(N)C(=O)O Z57396987 [1,0,0,0,0,0|3,0,0]=4 14 B5R0.5 CC(O)C(=O)N Z57206008 [1,0,0,0,0,0|3,0,0]=4 15 B5R0.5 CC(S)C(=O)O Z104477082 [1,0,0,0,0,0|2,1,0]=4 16 B5R0.5 C[C@@H](N)C(=O)O Z802692914 [1,0,0,0,0,0|3,0,0]=4 17 B5R0.5 C[C@H](N)C(=O)O Z756424912 [1,0,0,0,0,0|3,0,0]=4 18 B5R0.5 O=C(O)C(=O)O Z1741978903 [1,0,0,0,0,0|1,0,0]=2 19 B5R0.5 O=C(O)C(Cl)Cl Z104476414 [1,0,0,0,0,0|3,0,0]=4 20 B5R0.5 O=C(O)C(F)F Z104474070 [1,0,0,0,0,0|3,0,0]=4 21 B7R0.13 C=CC(C)(O)C(=O)O Z1198182953 [0,1,0,0,0,0|3,0,0]=4 22 B7R0.13 CC(C)(CO)C(=O)O Z997726628 [0,1,0,0,0,0|3,0,0]=4 23 B7R0.13 CC(N)(CO)C(=O)O Z1509051726 [0,1,0,0,0,0|3,0,0]=4 24 B7R0.13 CC(O)(CO)C(=O)O Z1205493767 [0,1,0,0,0,0|2,0,0]=3 25 B7R0.13 CCC(C)(O)C(=O)O Z788000964 [0,1,0,0,0,0|3,0,0]=4 26 B7R0.13 COC(C)(C)C(=O)O Z803492148 [0,1,0,0,0,0|3,0,0]=4 27 B7R0.17 CC(C)(N)P(=O)(O)O Z57033887 [0,1,0,0,0,0|2,0,1]=4 28 B7R1.19 O=C(O)C1(CC1)O Z216340524 [0,0,0,1,0,0|3,0,0]=4 29 B7R0.9 CC(C)(O)CC(=O)O Z982131798 [0,0,0,0,0,1|3,0,0]=4 30 B7R0.9 CP(=O)([O-])CC(=O)[O-] Z2939810747 [0,0,0,0,0,1|1,0,2]=4 31 B7R0.9 CS(=O)(=O)CC(=O)O Z295402410 [0,0,0,0,0,1|2,0,1]=4 32 B7R0.9 NS(=O)(=O)CC(=O)O Z331472332 [0,0,0,0,0,1|2,0,1]=4 33 B7R0.9 O=C(O)CP(=O)(O)O Z277558864 [0,0,0,0,0,1|0,0,0]=1 34 B4R0.1 C#CC(=O)O Z104493798 [2,0,0,0,0,0|2,0,0]=4 35 B4R0.1 C=CC(=O)O Z57127944 [2,0,0,0,0,0|2,0,0]=4 36 B4R0.1 CC(=O)C=O Z104495190 [2,0,0,0,0,0|2,0,0]=4 37 B4R0.1 CC(=O)NO Z59181917 [2,0,0,0,0,0|1,1,0]=4 38 B4R0.1 CCC(=O)O Z104474154 [2,0,0,0,0,0|2,0,0]=4 39 B4R0.1 NC(=O)CO Z424788508 [2,0,0,0,0,0|2,0,0]=4 40 B4R0.1 NC(=O)NO Z1203577934 [2,0,0,0,0,0|1,1,0]=4 41 B4R0.1 NCC(=O)O Z955123660 [2,0,0,0,0,0|2,0,0]=4 42 B4R0.1 O=C(O)CBr Z104473018 [2,0,0,0,0,0|2,0,0]=4 43 B4R0.1 O=C(O)CO Z104473274 [2,0,0,0,0,0|1,0,0]=3 44 B4R0.3 CS(=O)(=O)O Z281776238 [2,0,0,0,0,0|2,0,0]=4 45 B4R0.3 O=P(O)(O)F Z1255360409 [2,0,0,0,0,0|1,0,0]=3 46 B6R0.5 N#CCP(=O)(O)O Z3025383580 [1,1,0,0,0,0|1,0,1]=4 47 B6R0.3 CC(CO)C(=O)O Z431541400 [1,1,0,0,0,0|2,0,0]=4 48 B6R0.3 CCC(O)C(=O)O Z246073650 [1,1,0,0,0,0|2,0,0]=4 49 B6R0.3 COC(C)C(=O)O Z316258898 [1,1,0,0,0,0|2,0,0]=4 50 B6R0.3 NC(CO)C(=O)O Z57396986 [1,1,0,0,0,0|2,0,0]=4 51 B6R0.3 NNC(=O)C(=O)O Z3068042919 [1,1,0,0,0,0|2,0,0]=4 52 B6R0.3 N[C@@H](CO)C(=O)O Z756440058 [1,1,0,0,0,0|2,0,0]=4 53 B6R0.3 N[C@H](CO)C(=O)O Z1070067572 [1,1,0,0,0,0|2,0,0]=4 54 B6R0.3 O=C(O)C(=O)CBr Z1079181768 [1,1,0,0,0,0|2,0,0]=4 55 B8R0.24 O=C(CP(=O)(O)O)NO Z1999520090 [0,1,0,0,0,1|0,0,0]=2 56 B8R0.27 CC(C(=O)O)S(=O)(=O)O Z1262510815 [0,1,0,0,0,1|1,0,1]=4 57 B8R0.27 CC(O)C(O)P(=O)(O)O Z2050515563 [0,1,0,0,0,1|1,0,1]=4 58 B8R0.27 CP(=O)(C)C(O)C(=O)O Z1262512998 [0,1,0,0,0,1|2,0,0]=4 59 B8R0.12 CCOP(=O)([O-])C(=O)[O-] Z1726084881 [0,2,0,0,0,0|0,0,2]=4 60 B8R0.12 COCC(C)(O)C(=O)O Z992448466 [0,2,0,0,0,0|2,0,0]=4 61 B8R0.37 CC(O)C(C)(O)C(=O)O Z1205494313 [0,2,0,0,0,0|2,0,0]=4 62 B6R0.2 NC(=O)CC(=O)O Z963467736 [1,0,0,0,0,1|2,0,0]=4 63 B6R0.2 O=C(O)CC(=O)O Z57965450 [1,0,0,0,0,1|1,0,0]=3