0 B5R0.3 CCC(CO)N LS40333 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.3 CC[C@@H](CO)O LS30248 [0,0,0,0,0,0|4,0,0]=4 2 B5R0.3 CC[C@H](CO)O LS30249 [0,0,0,0,0,0|4,0,0]=4 3 B5R0.3 COC(=O)C#C LS40367 [0,0,0,0,0,0|2,0,2]=4 4 B5R0.3 COC(=O)CBr LS40562 [0,0,0,0,0,0|3,0,1]=4 5 B5R0.3 COC(=O)CF LS40581 [0,0,0,0,0,0|3,0,1]=4 6 B4R0.1 B(CC)(O)O LS11146 [1,0,0,0,0,0|3,0,0]=4 7 B4R0.1 CC(=NO)C LS00155 [1,0,0,0,0,0|2,0,1]=4 8 B4R0.1 CC(CCl)Cl LS40550 [1,0,0,0,0,0|3,0,0]=4 9 B4R0.1 CC[C@@H](C)O LS30261 [1,0,0,0,0,0|1,0,0]=2 10 B4R0.1 CC[C@H](C)O LS30260 [1,0,0,0,0,0|1,0,0]=2 11 B4R0.1 COC(Cl)Cl LS00123 [1,0,0,0,0,0|2,0,0]=3 12 B4R0.1 C[C@@H](CCl)O LS30025 [1,0,0,0,0,0|2,0,0]=3 13 B4R0.1 C[C@@H](CO)Cl LS30257 [1,0,0,0,0,0|3,0,0]=4 14 B4R0.1 C[C@@H](CO)N LS30252 [1,0,0,0,0,0|3,0,0]=4 15 B4R0.1 C[C@@H](CO)O LS30238 [1,0,0,0,0,0|2,0,0]=3 16 B4R0.1 C[C@H](CCl)O LS30026 [1,0,0,0,0,0|2,0,0]=3 17 B4R0.1 C[C@H](CO)Cl LS30085 [1,0,0,0,0,0|3,0,0]=4 18 B4R0.1 C[C@H](CO)N LS30253 [1,0,0,0,0,0|3,0,0]=4 19 B4R0.1 C[C@H](CO)O LS30239 [1,0,0,0,0,0|2,0,0]=3 20 B4R0.2 CNCCO LS40382 [1,0,0,0,0,0|3,0,0]=4 21 B4R0.2 COCCBr LS40281 [1,0,0,0,0,0|2,0,0]=3 22 B6R0.1 CCOC(=O)OC LS41158 [0,1,0,0,0,0|1,0,1]=3 23 B6R0.1 COC(=N)CCCl LS40140 [0,1,0,0,0,0|2,0,1]=4 24 B6R0.1 C\C(=N/C#N)\OC LS41000 [0,1,0,0,0,0|1,0,2]=4 25 B6R0.3 B(C(C)CC)(O)O LS11154 [0,1,0,0,0,0|3,0,0]=4 26 B6R0.3 CC(=O)N(C)OC LS41178 [0,1,0,0,0,0|2,0,0]=3 27 B6R0.3 C[C@@H](C(=O)OC)Cl LS30250 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.8 CC(C)(CO)OC LS40980 [0,1,0,0,0,0|2,0,0]=3 29 B6R0.9 CCN(CC)CC LS40534 [0,1,0,0,0,0|3,0,0]=4 30 B6R0.9 CCP(CC)CC LS41012 [0,1,0,0,0,0|3,0,0]=4 31 B6R0.9 CC[SiH](CC)CC LS41206 [0,1,0,0,0,0|2,1,0]=4 32 B6R0.9 COC(CBr)OC LS41675 [0,1,0,0,0,0|0,0,0]=1 33 B6R1.2 C1CC(=O)OC1 LS40356 [0,0,0,1,0,0|2,0,1]=4 34 B6R1.2 CC1=NCCC1 LS20850 [0,0,0,1,0,0|2,0,1]=4 35 B6R1.6 C1CC(C1)CBr LS40121 [0,0,0,1,0,0|3,0,0]=4 36 B6R1.6 C1CC(C1)CN LS40614 [0,0,0,1,0,0|3,0,0]=4 37 B6R1.6 C1CC(C1)CN LS40654 [0,0,0,1,0,0|3,0,0]=4 38 B6R1.6 C1CC(C1)CO LS41574 [0,0,0,1,0,0|3,0,0]=4 39 B6R1.7 CC1(CO1)CCl LS40232 [0,0,0,1,0,0|2,0,0]=3 40 B3R0.1 C(CF)O LS40655 [2,0,0,0,0,0|2,0,0]=4 41 B3R0.1 C(CO)N LS41686 [2,0,0,0,0,0|2,0,0]=4 42 B3R0.1 CCNN LS40292 [2,0,0,0,0,0|2,0,0]=4 43 B3R0.1 CNOC LS41340 [2,0,0,0,0,0|1,0,0]=3 44 B3R0.2 B(C)(O)O LS11144 [2,0,0,0,0,0|1,0,0]=3 45 B3R0.2 B(O)(O)O LS41322 [2,0,0,0,0,0|2,0,0]=4 46 B3R0.2 BN(C)C LS00132 [2,0,0,0,0,0|2,0,0]=4 47 B3R0.2 CC(=O)O LS00077 [2,0,0,0,0,0|0,0,2]=4 48 B3R0.2 CC(C)[O-] LS60292 [2,0,0,0,0,0|0,0,1]=3 49 B3R0.2 CN(C)C LS41629 [2,0,0,0,0,0|1,0,0]=3 50 B3R0.2 CP(C)C LS41013 [2,0,0,0,0,0|1,0,0]=3 51 B3R0.2 OP(O)[O-] LS00064 [2,0,0,0,0,0|2,0,0]=4 52 B5R0.1 CC(CCO)N LS41893 [1,1,0,0,0,0|2,0,0]=4 53 B5R0.1 CCC[C@@H](C)O LS30259 [1,1,0,0,0,0|1,0,0]=3 54 B5R0.1 CCC[C@H](C)O LS30258 [1,1,0,0,0,0|1,0,0]=3 55 B5R0.1 CN(C)CCCl LS41162 [1,1,0,0,0,0|2,0,0]=4 56 B5R0.1 C[C@@H](CCO)N LS30207 [1,1,0,0,0,0|2,0,0]=4 57 B5R0.1 C[C@H](CCO)N LS30127 [1,1,0,0,0,0|2,0,0]=4 58 B5R0.4 CC(C)(C)C=C LS40301 [1,1,0,0,0,0|1,0,1]=4 59 B5R0.4 CC(C)(C)CO LS40233 [1,1,0,0,0,0|2,0,0]=4 60 B5R0.4 CC(C)(CCl)O LS40441 [1,1,0,0,0,0|2,0,0]=4 61 B5R0.5 B(C(C)C)(O)O LS11150 [1,1,0,0,0,0|2,0,0]=4 62 B5R0.2 COCCC#N LS40792 [1,1,0,0,0,0|1,0,1]=4 63 B5R0.2 COCCCBr LS40222 [1,1,0,0,0,0|1,0,0]=3 64 B7R0.2 CCC(C)CC(C)N LS41471 [0,2,0,0,0,0|2,0,0]=4 65 B7R0.12 COCC(OC)OC LS40169 [0,2,0,0,0,0|0,0,0]=2 66 B7R0.15 CN(C)C(OC)OC LS40617 [0,2,0,0,0,0|0,0,0]=2 67 B5R1.2 C1C(CN1)O LS40392 [1,0,0,1,0,0|2,0,0]=4 68 B5R1.3 C1[C@@H](O1)CCl LS30047 [1,0,0,1,0,0|2,0,0]=4 69 B5R1.3 C1[C@@H](O1)CO LS30048 [1,0,0,1,0,0|2,0,0]=4 70 B5R1.3 C1[C@H](O1)CO LS30049 [1,0,0,1,0,0|2,0,0]=4 71 B5R1.3 CC[C@@H]1CO1 LS30243 [1,0,0,1,0,0|1,0,0]=3 72 B5R1.3 CC[C@H]1CO1 LS30242 [1,0,0,1,0,0|1,0,0]=3 73 B7R1.1 C1C[C@@H](OC1)CN LS30245 [0,1,0,1,0,0|1,0,0]=3 74 B7R1.1 C1C[C@H](OC1)CN LS30244 [0,1,0,1,0,0|1,0,0]=3 75 B7R1.2 C1C(OC(=O)O1)F LS40377 [0,1,0,1,0,0|1,0,1]=4 76 B7R1.2 C[C@@H]1COC(=O)O1 LS30247 [0,1,0,1,0,0|1,0,1]=4 77 B7R1.2 C[C@H]1COC(=O)O1 LS30246 [0,1,0,1,0,0|1,0,1]=4 78 B7R1.3 C1COC(=O)CO1 LS40469 [0,1,0,1,0,0|1,0,1]=4 79 B7R1.3 CC1CCCCN1 LS21158 [0,1,0,1,0,0|2,0,0]=4 80 B7R1.3 C[C@@H]1CNCCN1 LS30176 [0,1,0,1,0,0|2,0,0]=4 81 B7R1.3 C[C@@H]1CNCCO1 LS30015 [0,1,0,1,0,0|1,0,0]=3 82 B7R1.3 C[C@@H]1COCCN1 LS30002 [0,1,0,1,0,0|1,0,0]=3 83 B7R1.3 C[C@@H]1COCCN1 LS30011 [0,1,0,1,0,0|1,0,0]=3 84 B7R1.3 C[C@H]1CNCCN1 LS30177 [0,1,0,1,0,0|2,0,0]=4 85 B7R1.3 C[C@H]1CNCCO1 LS30016 [0,1,0,1,0,0|1,0,0]=3 86 B7R1.3 C[C@H]1COCCN1 LS30012 [0,1,0,1,0,0|1,0,0]=3 87 B7R1.3 C[C@H]1COCCN1 LS30156 [0,1,0,1,0,0|1,0,0]=3 88 B7R1.25 CC1(COC1)CO LS40343 [0,1,0,1,0,0|2,0,0]=4