0 B5R0.1 CC(C)/C=N/O AC010411 [0,0,0,0,0,0|2,1,0]=3 1 B5R0.1 CC(N)CC#N AC120042 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.1 CC(N)CCO AC511165 [0,0,0,0,0,0|2,1,1]=4 3 B5R0.1 CN(C)CCBr AC500092 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.1 CN(C)CCBr LN00009696 [0,0,0,0,0,0|3,0,1]=4 5 B5R0.1 CN(C)NC=O AC021455 [0,0,0,0,0,0|1,1,2]=4 6 B5R0.1 C[C@@H](O)CCO AC500114 [0,0,0,0,0,0|2,1,1]=4 7 B5R0.1 C[C@H](N)CCO AC512035 [0,0,0,0,0,0|2,1,1]=4 8 B4R0.1 C/C(N)=N/O AC511072 [1,0,0,0,0,0|1,1,1]=4 9 B4R0.1 CC(C)NN AC130058 [1,0,0,0,0,0|1,0,1]=3 10 B4R0.1 CC(C)ON AC511892 [1,0,0,0,0,0|2,0,0]=3 11 B4R0.1 CC(N)CO AC510879 [1,0,0,0,0,0|1,1,1]=4 12 B4R0.1 CNN(C)C AC021456 [1,0,0,0,0,0|1,0,2]=4 13 B4R0.1 C[C@@H](O)CN AC180581 [1,0,0,0,0,0|2,0,1]=4 14 B4R0.1 C[C@H](N)CO AC511021 [1,0,0,0,0,0|1,1,1]=4 15 B6R0.1 CCC(C)CNC AC010501 [0,1,0,0,0,0|3,0,0]=4 16 B6R0.1 CCC(C)CNC AC010533 [0,1,0,0,0,0|3,0,0]=4 17 B6R0.1 CCCC(C)NC AC010486 [0,1,0,0,0,0|2,0,1]=4 18 B6R0.1 CCCC(C)NC AC010524 [0,1,0,0,0,0|2,0,1]=4 19 B6R0.2 CC(C)CB(O)O AC090213 [0,1,0,0,0,0|2,1,0]=4 20 B6R0.2 CC(C)CB(O)O LN00119640 [0,1,0,0,0,0|2,1,0]=4 21 B6R0.2 CC(C)CC(N)=O HY-B1229 [0,1,0,0,0,0|1,1,1]=4 22 B6R0.3 CC(C)C(Cl)=NO AC010412 [0,1,0,0,0,0|2,1,0]=4 23 B6R0.3 CC(C)[C@@H](N)CO AC180576 [0,1,0,0,0,0|1,1,1]=4 24 B6R0.3 CC(C)[C@H](N)CO AC510687 [0,1,0,0,0,0|1,1,1]=4 25 B6R0.3 CNC(C)C(C)C AC010479 [0,1,0,0,0,0|3,0,0]=4 26 B6R0.3 CNC(C)C(C)C AC010530 [0,1,0,0,0,0|3,0,0]=4 27 B6R0.3 COC(=O)C(C)C AC130130 [0,1,0,0,0,0|3,0,0]=4 28 B6R0.4 CC(C)CCCO AC510897 [0,1,0,0,0,0|1,1,1]=4 29 B6R0.4 CC(C)OCCBr AC512105 [0,1,0,0,0,0|2,0,1]=4 30 B6R0.4 CNCCC(C)C AC010487 [0,1,0,0,0,0|2,0,1]=4 31 B6R0.4 CNCCC(C)C AC010537 [0,1,0,0,0,0|2,0,1]=4 32 B6R0.5 CC(C)(C)CCBr AC020699 [0,1,0,0,0,0|2,0,1]=4 33 B6R0.5 CNCC(C)(C)C AC010541 [0,1,0,0,0,0|3,0,0]=4 34 B6R0.5 CNCC(C)(C)C AC010542 [0,1,0,0,0,0|3,0,0]=4 35 B6R1.2 CC1CCNC1 LN00002080 [0,0,0,1,0,0|2,0,1]=4 36 B6R1.2 C[C@@H]1CCCN1 AC200009 [0,0,0,1,0,0|1,0,2]=4 37 B6R1.3 O=CNC1CC1 AC021249 [0,0,0,1,0,0|0,1,2]=4 38 B6R1.8 C[C@@H]1C[C@H]1CN LN00001858 [0,0,0,1,0,0|2,0,1]=4 39 B6R1.8 C[C@H]1C[C@@H]1CO LN00004886 [0,0,0,1,0,0|1,1,1]=4 40 B6R1.10 CC1(C)CNC1 AC182563 [0,0,0,1,0,0|3,0,0]=4 41 B3R0.1 CCC[CH2-] AC310111 [2,0,0,0,0,0|1,0,1]=4 42 B3R0.2 CC(N)=S AC510891 [2,0,0,0,0,0|1,0,1]=4 43 B3R0.2 CN(C)C AC130299 [2,0,0,0,0,0|1,0,1]=4 44 B3R0.2 CP(C)=O AC130246 [2,0,0,0,0,0|1,1,0]=4 45 B5R0.4 CC(C)(C)NN AC190172 [1,1,0,0,0,0|1,0,1]=4 46 B5R0.4 CC(C)(C)ON AC210024 [1,1,0,0,0,0|2,0,0]=4 47 B5R0.4 CC(C)(F)CO AC130344 [1,1,0,0,0,0|0,1,1]=4 48 B5R0.4 CC(C)(O)CN AC500020 [1,1,0,0,0,0|1,0,1]=4 49 B5R0.4 CC(C)(O)CO AC511880 [1,1,0,0,0,0|0,1,1]=4 50 B5R0.5 CC(C)B(O)O AC190241 [1,1,0,0,0,0|1,1,0]=4 51 B5R1.2 CC1CNC1 LN00002078 [1,0,0,1,0,0|1,0,1]=4 52 B5R1.3 C1CC1NN LN01252087 [1,0,0,1,0,0|1,0,1]=4 53 B5R1.3 N#CC1CC1 AC130285 [1,0,0,1,0,0|1,0,1]=4 54 B5R1.3 NCC1CC1 AC030129 [1,0,0,1,0,0|1,0,1]=4 55 B5R1.3 NNC1CC1 AC040018 [1,0,0,1,0,0|1,0,1]=4 56 B5R1.3 NNC1CC1 AC050915 [1,0,0,1,0,0|1,0,1]=4