0 B5R0.3 CCC(N)CN Y2034 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.3 CC[C@H](C)C#N 1254AL [0,0,0,0,0,0|3,0,0]=3 2 B5R0.3 COC(=O)C=O Y1686 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.3 COC(=O)CN W7382 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.3 COC(=S)S[K] 0990AE [0,0,0,0,0,0|2,1,1]=4 5 B5R0.3 C[C@@H](CO)CBr 6877AC [0,0,0,0,0,0|4,0,0]=4 6 B5R0.3 C\C=C(/C)[Mg]Br 7715AJ [0,0,0,0,0,0|3,0,1]=4 7 B4R0.1 C#C[C@@H](C)N 8949AH [1,0,0,0,0,0|2,0,1]=4 8 B4R0.1 C#C[C@@H](C)N 8950AH [1,0,0,0,0,0|2,0,1]=4 9 B4R0.1 CC(=O)OS V0446 [1,0,0,0,0,0|1,0,2]=4 10 B4R0.1 CC(C)=CCl R244 [1,0,0,0,0,0|2,0,1]=4 11 B4R0.1 CC(C)NO C506 [1,0,0,0,0,0|2,0,0]=3 12 B4R0.1 CC(Cl)CCl Y6563 [1,0,0,0,0,0|3,0,0]=4 13 B4R0.1 CC(O)CN 8099AL [1,0,0,0,0,0|2,0,0]=3 14 B4R0.1 CC[C@H](C)N 4197AL [1,0,0,0,0,0|2,0,0]=3 15 B4R0.1 COC(=N)N V1401 [1,0,0,0,0,0|2,0,1]=4 16 B4R0.2 C=CCON 7592AH [1,0,0,0,0,0|2,0,1]=4 17 B4R0.2 CCCC[NH3+] 7121AF [1,0,0,0,0,0|3,0,0]=4 18 B4R0.2 CCCC[O-] S459 [1,0,0,0,0,0|3,0,0]=4 19 B4R0.2 CCC[Mg]Cl 9030AJ [1,0,0,0,0,0|3,0,0]=4 20 B4R0.2 CCNCC Y1600 [1,0,0,0,0,0|3,0,0]=4 21 B4R0.2 ClO[Ca]OCl 8452AJ [1,0,0,0,0,0|3,0,0]=4 22 B4R0.2 NOCCO 0128AP [1,0,0,0,0,0|3,0,0]=4 23 B6R0.1 CC(CN)CCN 7844AA [0,1,0,0,0,0|3,0,0]=4 24 B6R0.1 CCCC(N)CC 7574AF [0,1,0,0,0,0|3,0,0]=4 25 B6R0.1 CCC[C@@H](C)CO N835 [0,1,0,0,0,0|3,0,0]=4 26 B6R0.1 CCN(C)CCO Z5820 [0,1,0,0,0,0|3,0,0]=4 27 B6R0.1 CCOC(Br)CBr V0731 [0,1,0,0,0,0|3,0,0]=4 28 B6R0.1 CC[C@@H](N)COC 8544AH [0,1,0,0,0,0|2,0,0]=3 29 B6R0.1 CC[C@H](N)COC 8568AH [0,1,0,0,0,0|2,0,0]=3 30 B6R0.1 CC\C(C)=N\O[SiH3] O469 [0,1,0,0,0,0|1,1,1]=4 31 B6R0.1 COC(=O)CCN 5700AB [0,1,0,0,0,0|2,0,1]=4 32 B6R0.1 CO\C(C)=N\C#N C733 [0,1,0,0,0,0|1,0,2]=4 33 B6R0.1 C\C=C\C(C)CC 6598AL [0,1,0,0,0,0|2,0,0]=3 34 B6R0.3 C=C(C)C(=O)OC P536 [0,1,0,0,0,0|2,0,1]=4 35 B6R0.3 C=C(C)C(C)CC 7776AF [0,1,0,0,0,0|2,0,0]=3 36 B6R0.3 CC(CCl)N(C)C X4629 [0,1,0,0,0,0|3,0,0]=4 37 B6R0.3 CC[C@H](C)C(=O)O Z9667 [0,1,0,0,0,0|3,0,0]=4 38 B6R0.3 COC(=O)C(C)N X3707 [0,1,0,0,0,0|2,0,1]=4 39 B6R0.8 C=CC(C)(O)CC 7513AF [0,1,0,0,0,0|2,0,1]=4 40 B6R0.8 CC[N+](C)(C)CC 8568AJ [0,1,0,0,0,0|3,0,0]=4 41 B6R0.8 COP(=S)([S-])OC S680 [0,1,0,0,0,0|2,0,0]=3 42 B6R0.8 CO[Si](F)(F)OC Y1673 [0,1,0,0,0,0|1,1,0]=3 43 B6R0.9 C=CC(CC)CO 7511AB [0,1,0,0,0,0|2,0,1]=4 44 B6R0.9 CCN(CC)CC 9279AL [0,1,0,0,0,0|3,0,0]=4 45 B6R0.9 CC[NH+](CC)CC X5323 [0,1,0,0,0,0|3,0,0]=4 46 B6R0.9 CC[O+](CC)CC 0270AP [0,1,0,0,0,0|3,0,0]=4 47 B6R0.9 CC[O+](CC)CC 0741AP [0,1,0,0,0,0|3,0,0]=4 48 B6R0.9 CO[10B](OC)OC 9158AJ [0,1,0,0,0,0|1,0,0]=2 49 B6R1.2 NC1CCCC1 0142AP [0,0,0,1,0,0|3,0,0]=4 50 B6R1.2 OC1CCCO1 5572AJ [0,0,0,1,0,0|2,0,0]=3 51 B6R1.6 CNC1COC1 4219AF [0,0,0,1,0,0|3,0,0]=4 52 B6R1.6 [C-]#[N+]C1CCC1 2868AF [0,0,0,1,0,0|2,0,1]=4 53 B6R1.7 C=CC1(C)CO1 2118AL [0,0,0,1,0,0|1,0,1]=3 54 B6R1.7 CC1(CN)CC1 4593AF [0,0,0,1,0,0|3,0,0]=4 55 B6R1.7 CC1(CN)CC1 X3846 [0,0,0,1,0,0|3,0,0]=4 56 B3R0.1 CNOC 2107AA [2,0,0,0,0,0|1,0,0]=3 57 B3R0.2 CC(C)=O 5788AL [2,0,0,0,0,0|0,0,2]=4 58 B3R0.2 CC(C)N 8113AL [2,0,0,0,0,0|1,0,0]=3 59 B3R0.2 CC(C)O 7082AF [2,0,0,0,0,0|0,0,0]=2 60 B3R0.2 CC(Cl)Cl 9227AE [2,0,0,0,0,0|2,0,0]=4 61 B3R0.2 O=S(O)O S352 [2,0,0,0,0,0|2,0,0]=4 62 B3R0.2 OP(O)O X6457 [2,0,0,0,0,0|2,0,0]=4 63 B3R0.2 O[10B](O)O 8439AJ [2,0,0,0,0,0|2,0,0]=4 64 B3R0.2 O[11B](O)O 8440AJ [2,0,0,0,0,0|2,0,0]=4 65 B3R0.2 O[AlH3](O)Cl 5474AF [2,0,0,0,0,0|2,0,0]=4 66 B3R0.2 O[AlH3](O)Cl 5475AF [2,0,0,0,0,0|2,0,0]=4 67 B3R0.2 O[AlH3](O)O 8684AF [2,0,0,0,0,0|2,0,0]=4 68 B3R0.2 O[Fe](O)O 8655AF [2,0,0,0,0,0|2,0,0]=4 69 B5R0.1 C=CC[C@@H](C)O 1174AL [1,1,0,0,0,0|1,0,1]=4 70 B5R0.1 CC#C[C@H](C)O S982 [1,1,0,0,0,0|1,0,0]=3 71 B5R0.1 CC(C)C[Mg]Cl 8723AJ [1,1,0,0,0,0|2,0,0]=4 72 B5R0.1 CC(Cl)CCBr 7250AF [1,1,0,0,0,0|2,0,0]=4 73 B5R0.1 CC(O)CC=O 7261AF [1,1,0,0,0,0|1,0,1]=4 74 B5R0.1 CCCC(C)I 7327AF [1,1,0,0,0,0|2,0,0]=4 75 B5R0.1 CCO[PH](C)=O 8330AA [1,1,0,0,0,0|1,0,1]=4 76 B5R0.1 CN(C)CCCl X8859 [1,1,0,0,0,0|2,0,0]=4 77 B5R0.1 C[C@H](O)CC#N W1944 [1,1,0,0,0,0|1,0,1]=4 78 B5R0.4 CC(C)(C)N=O 9880AL [1,1,0,0,0,0|2,0,0]=4 79 B5R0.4 CC(C)(N)C#N E319 [1,1,0,0,0,0|2,0,0]=4 80 B5R0.4 CC[Si](C)(C)C 9692AJ [1,1,0,0,0,0|1,1,0]=4 81 B5R0.4 COP(=O)(O)O 8247AL [1,1,0,0,0,0|2,0,0]=4 82 B5R0.5 CC(=O)C(C)Br V0402 [1,1,0,0,0,0|2,0,0]=4 83 B5R0.5 CC(C)C(C)N 4455AL [1,1,0,0,0,0|1,0,0]=3 84 B5R0.5 CC(Cl)C(C)Cl 5219AL [1,1,0,0,0,0|2,0,0]=4 85 B5R0.5 CC(O)C(=O)[O-] P973 [1,1,0,0,0,0|2,0,0]=4 86 B5R0.5 CC(O)C(=O)[O-] Z1915 [1,1,0,0,0,0|2,0,0]=4 87 B5R0.5 CC(O)C(=O)[O-] Z1916 [1,1,0,0,0,0|2,0,0]=4 88 B5R0.5 CC(O)C(N)=O 7066AF [1,1,0,0,0,0|2,0,0]=4 89 B5R0.5 C[C@H](O)C(N)=O 4862AC [1,1,0,0,0,0|2,0,0]=4 90 B5R0.2 COCCC=O Y8542 [1,1,0,0,0,0|1,0,1]=4 91 B7R0.3 CCC(C)OCCO 1705AL [0,2,0,0,0,0|1,0,0]=3 92 B7R0.7 CCOP(C)OCC R038 [0,2,0,0,0,0|1,0,0]=3 93 B7R0.10 CCC(C)C(=O)SC U625 [0,2,0,0,0,0|1,1,0]=4 94 B7R0.10 COC(=O)C(C)C=O Z3080 [0,2,0,0,0,0|2,0,0]=4 95 B7R0.10 COC(=O)C(C)CN X3684 [0,2,0,0,0,0|2,0,0]=4 96 B7R0.10 COC(=O)C(O)OC 0175AB [0,2,0,0,0,0|1,0,0]=3 97 B7R0.12 [C-]#[N+]CC(OC)OC Y1561 [0,2,0,0,0,0|0,0,0]=2 98 B7R0.18 CO[Si](C)(CCl)OC R874 [0,2,0,0,0,0|0,1,0]=3 99 B5R1.2 CC1CCN1 2132AL [1,0,0,1,0,0|1,0,0]=3 100 B5R1.3 C=CC1CC1 3916AL [1,0,0,1,0,0|1,0,1]=4 101 B5R1.3 CCC1CN1 Y8453 [1,0,0,1,0,0|2,0,0]=4 102 B5R1.4 CC1OC1C 5247AL [1,0,0,1,0,0|1,0,0]=3 103 B5R1.5 CC1(N)CC1 W4667 [1,0,0,1,0,0|2,0,0]=4 104 B5R1.1 C1CCOC1 V2332 [1,0,0,1,0,0|1,0,0]=3 105 B5R1.1 C1CNOC1 4176AJ [1,0,0,1,0,0|2,0,0]=4 106 B7R1.1 CO[C@@H]1CCNC1 Z2120 [0,1,0,1,0,0|1,0,0]=3 107 B7R1.1 CO[C@H]1CCNC1 Z2151 [0,1,0,1,0,0|1,0,0]=3 108 B7R1.1 ClCC1CCCN1 1258AJ [0,1,0,1,0,0|2,0,0]=4 109 B7R1.2 CC1CCC(C)N1 Y8778 [0,1,0,1,0,0|2,0,0]=4 110 B7R1.2 C[C@@H]1CC[C@@H](C)N1 8295AH [0,1,0,1,0,0|2,0,0]=4 111 B7R1.2 C[C@@H]1CC[C@@H](C)N1 8559AH [0,1,0,1,0,0|2,0,0]=4 112 B7R1.2 C[C@H]1CC[C@H](C)N1 8586AH [0,1,0,1,0,0|2,0,0]=4 113 B7R1.3 C[C@@H]1CCCCN1 W3754 [0,1,0,1,0,0|2,0,0]=4 114 B7R1.3 C[C@@H]1CCCNC1 8114AA [0,1,0,1,0,0|2,0,0]=4 115 B7R1.3 N[C@@H]1CCCOC1 X8827 [0,1,0,1,0,0|2,0,0]=4 116 B7R1.3 N[C@H]1CCCOC1 X6276 [0,1,0,1,0,0|2,0,0]=4 117 B7R1.4 CC1=C(S)CCO1 R544 [0,1,0,1,0,0|1,0,1]=4 118 B7R1.4 C[C@@H]1CCC[C@H]1O S086 [0,1,0,1,0,0|2,0,0]=4 119 B7R2.11 C1CC2CC1N2 3085AJ [0,0,0,2,0,0|2,0,0]=4