0 B7R1.2 C1C(OC(=O)O1)F LS40377 [0,0,0,0,0,0|2,0,1]=3 1 B7R1.2 C1CC(=O)CC1=O LS41637 [0,0,0,0,0,0|1,0,0]=1 2 B7R1.2 C1[C@@H](CNC1=O)O LS30539 [0,0,0,0,0,0|2,0,2]=4 3 B7R1.2 C1[C@@H](COC1=O)O LS30540 [0,0,0,0,0,0|2,0,2]=4 4 B7R1.2 C[C@@H]1COC(=O)O1 LS30247 [0,0,0,0,0,0|2,0,1]=3 5 B7R1.2 C[C@H]1COC(=O)O1 LS30246 [0,0,0,0,0,0|2,0,1]=3 6 B6R1.2 C1CC(=O)OC1 LS40356 [1,0,0,0,0,0|0,0,1]=2 7 B6R1.2 C1CNCC1=O LS20898 [1,0,0,0,0,0|2,0,0]=3 8 B6R1.2 C1COCC1=O LS21051 [1,0,0,0,0,0|2,0,0]=3 9 B6R1.2 C1CSCC1=O LS40268 [1,0,0,0,0,0|2,0,0]=3 10 B6R1.2 CC1=NCCC1 LS20850 [1,0,0,0,0,0|2,0,1]=4 11 B6R1.2 c1coc(=O)o1 LS40378 [1,0,0,0,0,0|1,0,1]=3 12 B8R1.1 C1[C@@H](OC(=O)N1)CCl LS30235 [0,1,0,0,0,0|2,0,1]=4 13 B8R1.1 C1[C@H](OC(=O)N1)CCl LS30234 [0,1,0,0,0,0|2,0,1]=4 14 B8R1.50 C1CC(=O)N(C1=O)I LS00001 [0,1,0,0,0,0|1,0,0]=2 15 B8R1.50 C1CC(=O)N(C1=O)O LS00022 [0,1,0,0,0,0|1,0,0]=2 16 B8R1.50 CN1C(=O)C=CC1=O LS40580 [0,1,0,0,0,0|1,0,2]=4 17 B6R0.1 CCOC(=O)CBr LS40563 [0,0,1,0,0,0|2,0,1]=4 18 B6R0.1 CCOC(=O)CF LS40582 [0,0,1,0,0,0|2,0,1]=4 19 B6R0.1 CCOC(=O)OC LS41158 [0,0,1,0,0,0|2,0,1]=4 20 B6R0.2 CC(=O)NC(=N)N LS40272 [0,0,1,0,0,0|3,0,0]=4 21 B6R0.4 C(CC(=O)Cl)CCl LS40415 [0,0,1,0,0,0|2,0,1]=4 22 B6R0.4 C=CCCC(=O)O LS41473 [0,0,1,0,0,0|1,0,0]=2 23 B8R1.3 C1=CC(=O)C=CC1=O LS41078 [0,0,0,0,0,1|1,0,2]=4 24 B8R1.3 CN1CCC(=O)CC1 LS20681 [0,0,0,0,0,1|3,0,0]=4 25 B8R1.4 C1CNC(=O)CC1N LS20121 [0,0,0,0,0,1|2,0,1]=4 26 B8R1.4 CN1CCNC(=O)C1 LS21189 [0,0,0,0,0,1|3,0,0]=4 27 B5R0.1 C(CCl)C(=O)Cl LS40026 [1,0,1,0,0,0|2,0,0]=4 28 B5R0.1 C(CO)C(=O)O LS40008 [1,0,1,0,0,0|0,0,1]=3 29 B5R0.3 COC(=O)CBr LS40562 [1,0,1,0,0,0|1,0,1]=4 30 B5R0.3 COC(=O)CF LS40581 [1,0,1,0,0,0|1,0,1]=4 31 B7R0.2 COC(=O)CC(=O)O LS41603 [0,1,1,0,0,0|2,0,0]=4 32 B7R0.5 CCOC(=O)[C@@H](C)O LS30021 [0,1,1,0,0,0|1,0,1]=4 33 B7R0.7 CCOC(=O)CCCl LS40099 [0,1,1,0,0,0|1,0,1]=4 34 B7R0.6 C(#CC(=O)O)C(=O)O LS40108 [0,1,1,0,0,0|0,0,2]=4 35 B7R0.6 C(#CC(=O)[O-])C(=O)O LS40685 [0,1,1,0,0,0|0,0,2]=4 36 B7R0.6 C(CC(=O)O)C(=O)O LS40373 [0,1,1,0,0,0|0,0,0]=2 37 B7R0.6 C(CC(=O)[O-])C(=O)[O-] LS40932 [0,1,1,0,0,0|0,0,1]=3 38 B7R0.6 CC(=O)CCC(=O)O LS41171 [0,1,1,0,0,0|0,0,0]=2 39 B7R1.4 C1COC(=O)C1Br LS40518 [1,1,0,0,0,0|0,0,1]=3 40 B7R1.14 C1COS(=O)(=O)C1 LS40762 [1,1,0,0,0,0|1,0,1]=4 41 B9R1.2 COC1=CC(=O)CCC1 LS41609 [0,1,0,0,0,1|1,0,1]=4 42 B9R1.34 CC1CC(=O)CC(=O)C1 LS40106 [0,1,0,0,0,1|1,0,0]=3 43 B9R1.21 c1cc(oc1C=O)C=O LS20855 [0,2,0,0,0,0|0,0,2]=4 44 B9R1.35 C1CC(=O)N[C@H]1C(=O)O LS30084 [0,2,0,0,0,0|1,0,1]=4 45 B7R1.18 C1C(CN1)C(=O)O LS41152 [0,0,1,1,0,0|2,0,0]=4 46 B5R0.5 C(=O)(C(=O)[O-])O LS41479 [0,0,1,0,1,0|2,0,0]=4 47 B5R0.5 C(=O)(C(=O)[O-])[O-] LS40476 [0,0,1,0,1,0|2,0,0]=4 48 B5R0.5 C(=O)(C(=O)[O-])[O-] LS41476 [0,0,1,0,1,0|2,0,0]=4 49 B5R0.5 C(=O)(C(=O)[O-])[O-] LS41477 [0,0,1,0,1,0|2,0,0]=4 50 B5R0.5 C(=O)(C(=O)[O-])[O-] LS41480 [0,0,1,0,1,0|2,0,0]=4 51 B5R0.5 C(=O)(C(=O)[O-])[O-] LS41481 [0,0,1,0,1,0|2,0,0]=4 52 B5R0.5 C(=O)(C(=O)[O-])[O-] LS41482 [0,0,1,0,1,0|2,0,0]=4 53 B5R0.5 C(=O)(C(=O)[O-])[O-] LS60291 [0,0,1,0,1,0|2,0,0]=4 54 B5R0.5 CC(=O)C(=O)O LS41153 [0,0,1,0,1,0|1,0,0]=3 55 B5R0.5 CC(=O)C(=O)[O-] LS41154 [0,0,1,0,1,0|1,0,0]=3 56 B5R0.5 CC(=O)C(=O)[O-] LS41155 [0,0,1,0,1,0|1,0,0]=3 57 B5R0.5 CC(=O)C(=O)[O-] LS41156 [0,0,1,0,1,0|1,0,0]=3 58 B5R0.5 CC(=O)C(=O)[O-] LS41157 [0,0,1,0,1,0|1,0,0]=3 59 B5R1.2 C1C(=O)CO1 LS41911 [1,0,0,0,1,0|1,0,1]=4 60 B5R1.2 C1C(=O)CS1 LS40394 [1,0,0,0,1,0|1,0,1]=4 61 B5R1.2 C1CC(=O)C1 LS40231 [1,0,0,0,1,0|0,0,1]=3 62 B9R1.48 C1CCC(=O)CC(=O)C1 LS40206 [0,0,0,0,0,2|1,0,0]=3