0 B5R0.1 CC(CCO)N LS41893 [0,0,0,0,0,0|2,0,2]=4 1 B5R0.1 CCC[C@@H](C)O LS30259 [0,0,0,0,0,0|1,0,2]=3 2 B5R0.1 CCC[C@H](C)O LS30258 [0,0,0,0,0,0|1,0,2]=3 3 B5R0.1 CN(C)CCCl LS41162 [0,0,0,0,0,0|2,0,2]=4 4 B5R0.1 C[C@@H](CCO)N LS30207 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.1 C[C@H](CCO)N LS30127 [0,0,0,0,0,0|2,0,2]=4 6 B4R0.1 CC(=NO)C LS00155 [1,0,0,0,0,0|2,0,1]=4 7 B4R0.1 CC(CCl)Cl LS40550 [1,0,0,0,0,0|2,0,1]=4 8 B4R0.1 CC[C@@H](C)O LS30261 [1,0,0,0,0,0|1,0,1]=3 9 B4R0.1 CC[C@H](C)O LS30260 [1,0,0,0,0,0|1,0,1]=3 10 B4R0.1 COC(Cl)Cl LS00123 [1,0,0,0,0,0|3,0,0]=4 11 B4R0.1 C[C@@H](CCl)O LS30025 [1,0,0,0,0,0|2,0,1]=4 12 B4R0.1 C[C@@H](CO)Cl LS30257 [1,0,0,0,0,0|2,0,1]=4 13 B4R0.1 C[C@@H](CO)N LS30252 [1,0,0,0,0,0|2,0,1]=4 14 B4R0.1 C[C@@H](CO)O LS30238 [1,0,0,0,0,0|2,0,1]=4 15 B4R0.1 C[C@H](CCl)O LS30026 [1,0,0,0,0,0|2,0,1]=4 16 B4R0.1 C[C@H](CO)Cl LS30085 [1,0,0,0,0,0|2,0,1]=4 17 B4R0.1 C[C@H](CO)N LS30253 [1,0,0,0,0,0|2,0,1]=4 18 B4R0.1 C[C@H](CO)O LS30239 [1,0,0,0,0,0|2,0,1]=4 19 B4R0.2 C=CCCBr LS20765 [1,0,0,0,0,0|1,0,2]=4 20 B4R0.2 C=CCCO LS40761 [1,0,0,0,0,0|1,0,2]=4 21 B4R0.2 CNCCO LS40382 [1,0,0,0,0,0|2,0,1]=4 22 B4R0.2 COCCBr LS40281 [1,0,0,0,0,0|2,0,1]=4 23 B6R0.2 B(CC(C)C)(O)O LS40457 [0,1,0,0,0,0|2,0,1]=4 24 B6R0.2 CC(C)CC(C)N LS41472 [0,1,0,0,0,0|0,0,2]=3 25 B6R0.2 C[C@@H](CC(=O)O)N LS30205 [0,1,0,0,0,0|2,0,1]=4 26 B6R0.2 C[C@H](CC(=O)O)N LS30206 [0,1,0,0,0,0|2,0,1]=4 27 B6R0.2 C[SiH](C)O[SiH](C)C LS40745 [0,1,0,0,0,0|1,2,0]=4 28 B6R0.3 CC(=C)C(=O)NC LS41593 [0,1,0,0,0,0|1,0,2]=4 29 B6R0.3 C[C@@H](C(=O)OC)Cl LS30250 [0,1,0,0,0,0|2,0,0]=3 30 B6R0.5 CC(C)(C)CC=O LS40274 [0,1,0,0,0,0|1,0,1]=3 31 B6R0.5 C[Si](C)(C)CC=C LS40348 [0,1,0,0,0,0|0,1,2]=4 32 B6R1.2 C1CNCC1N LS20700 [0,0,0,1,0,0|2,0,1]=4 33 B6R1.2 C1CNC[C@@H]1O LS30060 [0,0,0,1,0,0|2,0,1]=4 34 B6R1.2 C1CNC[C@@H]1O LS30061 [0,0,0,1,0,0|2,0,1]=4 35 B6R1.2 C1CNC[C@H]1N LS30070 [0,0,0,1,0,0|2,0,1]=4 36 B6R1.2 C1COCC1O LS21045 [0,0,0,1,0,0|2,0,1]=4 37 B6R1.2 C1COC[C@@H]1N LS30001 [0,0,0,1,0,0|2,0,1]=4 38 B6R1.2 C1COC[C@@H]1O LS30063 [0,0,0,1,0,0|2,0,1]=4 39 B6R1.2 C1COC[C@H]1O LS30020 [0,0,0,1,0,0|2,0,1]=4 40 B6R1.2 C1COC[C@H]1O LS30064 [0,0,0,1,0,0|2,0,1]=4 41 B6R1.2 CC1=NCCC1 LS20850 [0,0,0,1,0,0|1,0,2]=4 42 B6R1.2 Cc1cc[nH]n1 LS20095 [0,0,0,1,0,0|2,0,1]=4 43 B6R1.2 Cc1cccs1 LS20640 [0,0,0,1,0,0|1,0,2]=4 44 B6R1.2 Cn1cccn1 LS20706 [0,0,0,1,0,0|2,0,1]=4 45 B6R1.2 Cn1ccnc1 LS20202 [0,0,0,1,0,0|2,0,1]=4 46 B6R1.3 COC[C@@H]1CO1 LS30113 [0,0,0,1,0,0|2,0,1]=4 47 B3R0.1 CCNN LS40292 [2,0,0,0,0,0|2,0,0]=4 48 B3R0.1 CNOC LS41340 [2,0,0,0,0,0|2,0,0]=4 49 B3R0.2 BN(C)C LS00132 [2,0,0,0,0,0|2,0,0]=4 50 B3R0.2 CC(C)[O-] LS60292 [2,0,0,0,0,0|1,0,0]=3 51 B3R0.2 CN(C)C LS41629 [2,0,0,0,0,0|1,0,0]=3 52 B3R0.2 CP(C)C LS41013 [2,0,0,0,0,0|1,0,0]=3 53 B5R0.3 CCC(CO)N LS40333 [1,1,0,0,0,0|1,0,1]=4 54 B5R0.3 CC[C@@H](CO)O LS30248 [1,1,0,0,0,0|1,0,1]=4 55 B5R0.3 CC[C@H](CO)O LS30249 [1,1,0,0,0,0|1,0,1]=4 56 B5R0.4 CC(C)(C)C=C LS40301 [1,1,0,0,0,0|0,0,0]=2 57 B5R0.4 CC(C)(C)CO LS40233 [1,1,0,0,0,0|1,0,1]=4 58 B5R0.4 CC(C)(CCl)O LS40441 [1,1,0,0,0,0|1,0,1]=4 59 B5R0.5 B(C(C)C)(O)O LS11150 [1,1,0,0,0,0|2,0,0]=4 60 B5R0.5 CC(C(=O)O)Br LS40410 [1,1,0,0,0,0|2,0,0]=4 61 B5R0.5 C[C@@H](C(=O)O)Br LS30293 [1,1,0,0,0,0|2,0,0]=4 62 B5R0.5 C[C@@H](C(=O)O)Cl LS30117 [1,1,0,0,0,0|2,0,0]=4 63 B5R0.2 C(\C=C/CCl)Cl LS30130 [1,1,0,0,0,0|1,0,0]=3 64 B5R0.2 C(\C=C\CCl)Cl LS30302 [1,1,0,0,0,0|1,0,0]=3 65 B5R0.2 C=CCCCBr LS20766 [1,1,0,0,0,0|0,0,2]=4 66 B5R0.2 COCCCBr LS40222 [1,1,0,0,0,0|1,0,1]=4 67 B7R0.2 CC(C)NC(=O)CBr LS40529 [0,2,0,0,0,0|1,0,0]=3 68 B7R0.2 CCC(C)CC(C)N LS41471 [0,2,0,0,0,0|0,0,2]=4 69 B7R0.2 C[C@@H](CC(=O)OC)N LS30208 [0,2,0,0,0,0|1,0,1]=4 70 B7R0.2 C[C@@H](CC(=O)OC)O LS30199 [0,2,0,0,0,0|1,0,1]=4 71 B7R0.2 C[C@H](CC(=O)OC)N LS30209 [0,2,0,0,0,0|1,0,1]=4 72 B7R0.2 C[C@H](CC(=O)OC)O LS30200 [0,2,0,0,0,0|1,0,1]=4 73 B7R0.2 C\C(=C\C(=O)OC)\N LS40727 [0,2,0,0,0,0|1,0,1]=4 74 B7R0.5 CCOC(=O)[C@@H](C)O LS30021 [0,2,0,0,0,0|1,0,1]=4 75 B7R0.12 COCC(OC)OC LS40169 [0,2,0,0,0,0|1,0,1]=4 76 B7R0.16 CN(C)C(=[N+](C)C)F LS40001 [0,2,0,0,0,0|2,0,0]=4 77 B7R0.14 CC(C)(C(=O)OC)N LS40067 [0,2,0,0,0,0|1,0,0]=3 78 B7R0.14 CC(C)(C(=O)OC)O LS40349 [0,2,0,0,0,0|1,0,0]=3 79 B7R0.14 CC(C)(C)C(=O)CCl LS40447 [0,2,0,0,0,0|1,0,1]=4 80 B7R0.4 CCC\C=C\C(=O)C LS41924 [0,2,0,0,0,0|1,0,1]=4 81 B7R0.6 CC(C)CCC(C)N LS41494 [0,2,0,0,0,0|0,0,2]=4 82 B5R1.3 CC[C@@H]1CO1 LS30243 [1,0,0,1,0,0|1,0,1]=4 83 B5R1.3 CC[C@H]1CO1 LS30242 [1,0,0,1,0,0|1,0,1]=4 84 B5R1.1 C1C=CCN1 LS20566 [1,0,0,1,0,0|1,0,0]=3 85 B7R1.1 C1C=CCC1CO LS40472 [0,1,0,1,0,0|0,0,2]=4 86 B7R1.1 C1CNC[C@@H]1CO LS30145 [0,1,0,1,0,0|1,0,1]=4 87 B7R1.1 C1CNC[C@H]1CO LS30146 [0,1,0,1,0,0|1,0,1]=4 88 B7R1.1 C1C[C@@H](OC1)CN LS30245 [0,1,0,1,0,0|1,0,1]=4 89 B7R1.1 C1C[C@H](OC1)CN LS30244 [0,1,0,1,0,0|1,0,1]=4 90 B7R1.2 C[C@@H]1COC(=O)O1 LS30247 [0,1,0,1,0,0|2,0,0]=4 91 B7R1.2 C[C@H]1COC(=O)O1 LS30246 [0,1,0,1,0,0|2,0,0]=4 92 B7R1.2 Cc1ccc(s1)C LS20641 [0,1,0,1,0,0|1,0,1]=4 93 B7R1.2 Cc1ccn(n1)C LS20249 [0,1,0,1,0,0|1,0,1]=4 94 B7R1.3 CC1CCCCN1 LS21158 [0,1,0,1,0,0|0,0,2]=4 95 B7R1.3 C[C@@H]1CNCCN1 LS30176 [0,1,0,1,0,0|1,0,1]=4 96 B7R1.3 C[C@@H]1CNCCO1 LS30015 [0,1,0,1,0,0|1,0,1]=4 97 B7R1.3 C[C@@H]1COCCN1 LS30002 [0,1,0,1,0,0|1,0,1]=4 98 B7R1.3 C[C@@H]1COCCN1 LS30011 [0,1,0,1,0,0|1,0,1]=4 99 B7R1.3 C[C@H]1CNCCN1 LS30177 [0,1,0,1,0,0|1,0,1]=4 100 B7R1.3 C[C@H]1CNCCO1 LS30016 [0,1,0,1,0,0|1,0,1]=4 101 B7R1.3 C[C@H]1COCCN1 LS30012 [0,1,0,1,0,0|1,0,1]=4 102 B7R1.3 C[C@H]1COCCN1 LS30156 [0,1,0,1,0,0|1,0,1]=4 103 B7R1.4 C1COC(=O)C1Br LS40518 [0,1,0,1,0,0|2,0,0]=4 104 B7R1.25 CC1(COC1)CO LS40343 [0,1,0,1,0,0|1,0,1]=4