0 B7R1.2 BrC1=CC=C(Br)O1 BCP17059 [0,0,0,0,0,0|2,0,2]=4 1 B7R1.2 O=C1NCC(O)C1 BCP07569 [0,0,0,0,0,0|2,0,2]=4 2 B7R1.2 O=C1OC[C@@H](C)O1 BCP12993 [0,0,0,0,0,0|2,0,1]=3 3 B6R1.2 CC1CCCO1 BCP16203 [1,0,0,0,0,0|1,0,2]=4 4 B6R1.2 NC1=NCCC1 BCP11252 [1,0,0,0,0,0|2,0,1]=4 5 B6R1.2 O=C1COCC1 BCP14176 [1,0,0,0,0,0|2,0,0]=3 6 B6R1.2 O=C1NCCC1 BCP15175 [1,0,0,0,0,0|1,0,1]=3 7 B6R1.2 O=C1OCC=C1 BCP15247 [1,0,0,0,0,0|2,0,0]=3 8 B6R1.2 O=C1SCCN1 BCP16484 [1,0,0,0,0,0|1,1,1]=4 9 B6R1.2 O=c1[nH]cc[nH]1 BCP13352 [1,0,0,0,0,0|2,0,1]=4 10 B8R1.18 C[C]1NC(=O)OC1=O BCP18817 [0,1,0,0,0,0|1,0,1]=3 11 B8R1.18 N=C1NC(CN1C)=O BCP14736 [0,1,0,0,0,0|3,0,0]=4 12 B8R1.18 O=C1NC(=O)C(N1)=O BCP20123 [0,1,0,0,0,0|2,0,1]=4 13 B8R1.50 O=C1CCC(N1Br)=O BCP15478 [0,1,0,0,0,0|1,0,0]=2 14 B8R1.50 O=C1CCC(N1I)=O BCP18538 [0,1,0,0,0,0|1,0,0]=2 15 B6R0.1 O=C(OCC)CBr BCP04940 [0,0,1,0,0,0|2,0,1]=4 16 B6R0.2 CC(C)NC(C)=O BCP19527 [0,0,1,0,0,0|2,0,1]=4 17 B6R0.2 CC(CC(N)=O)=O BCP19964 [0,0,1,0,0,0|2,0,0]=3 18 B6R0.2 CC(OC(C)=O)=O BCP20665 [0,0,1,0,0,0|0,0,0]=1 19 B6R0.2 CC(\C=C([O-])C)=O BCP15074 [0,0,1,0,0,0|1,0,1]=3 20 B6R0.2 OC(CC(O)=O)=O BCP05571 [0,0,1,0,0,0|3,0,0]=4 21 B6R0.4 OC(CSCC)=O BCP05241 [0,0,1,0,0,0|2,0,1]=4 22 B8R1.3 O=C1NCC(C)CC1 BCP14293 [0,0,0,0,0,1|2,0,1]=4 23 B8R1.3 O=C1NCC(NC1)=O BCP20475 [0,0,0,0,0,1|2,0,0]=3 24 B8R1.4 CN1CCNC(=O)C1 BCP17253 [0,0,0,0,0,1|3,0,0]=4 25 B8R1.4 NC=1CCCC(C1)=O BCP19985 [0,0,0,0,0,1|2,0,0]=3 26 B8R1.4 O=C1CC(N)CCN1 BCP07513 [0,0,0,0,0,1|2,0,1]=4 27 B8R1.4 O=C1NCC[C](O)C1 BCP14222 [0,0,0,0,0,1|1,0,2]=4 28 B8R1.4 OC1CCNC(=O)C1 BCP11689 [0,0,0,0,0,1|1,0,2]=4 29 B5R0.1 CC(OCCl)=O BCP16170 [1,0,1,0,0,0|1,0,1]=4 30 B5R0.1 O=C(Cl)CCBr BCP20557 [1,0,1,0,0,0|2,0,0]=4 31 B5R0.1 O=C(Cl)CCCl BCP09962 [1,0,1,0,0,0|2,0,0]=4 32 B5R0.1 OC(CCO)=O BCP05902 [1,0,1,0,0,0|0,0,1]=3 33 B5R0.1 OC(CCS)=O BCP16636 [1,0,1,0,0,0|0,1,0]=3 34 B5R0.2 C=CCCC=C BCP08456 [1,0,1,0,0,0|2,0,0]=4 35 B5R0.2 O=CCCC=O BCP20105 [1,0,1,0,0,0|0,0,0]=2 36 B5R0.3 O=C(CBr)CC BCP08723 [1,0,1,0,0,0|1,0,1]=4 37 B5R0.3 O=C(OC)CBr BCP06456 [1,0,1,0,0,0|1,0,1]=4 38 B7R0.4 O=C(O)CCCCO BCP10662 [0,1,1,0,0,0|0,0,2]=4 39 B7R0.6 O=C(O)CC[N+]([O-])=O BCP15066 [0,1,1,0,0,0|1,0,0]=3 40 B7R1.4 C=C1CCOC1=O BCP18620 [1,1,0,0,0,0|0,0,2]=4 41 B7R1.4 N[C@H]1CCOC1=O BCP20062 [1,1,0,0,0,0|0,0,1]=3 42 B7R1.4 O=C1CCCN1N BCP15282 [1,1,0,0,0,0|1,0,1]=4 43 B7R1.4 O=C1N(N)CCC1 BCP08744 [1,1,0,0,0,0|1,0,1]=4 44 B7R1.4 O=C1OCC[C@@H]1N BCP19716 [1,1,0,0,0,0|0,0,1]=3 45 B7R1.4 OC1CCNC1=O BCP00893 [1,1,0,0,0,0|1,0,1]=4 46 B9R1.10 O=[S]1(CCC(CC1)=O)=O BCP08509 [0,1,0,0,0,1|2,0,0]=4 47 B9R1.2 COC=1CCCC(C1)=O BCP12186 [0,1,0,0,0,1|1,0,1]=4 48 B9R1.21 O=CC1=CC=C(C=O)O1 BCP14987 [0,2,0,0,0,0|0,0,2]=4 49 B9R1.35 O=C([O-])[C]1CCC(N1)=O BCP11962 [0,2,0,0,0,0|1,0,1]=4 50 B9R1.35 O=C1CC[C@@H](N1)C(=O)O BCP09505 [0,2,0,0,0,0|1,0,1]=4 51 B7R1.18 O=C(C1CNC1)O BCP07094 [0,0,1,1,0,0|2,0,0]=4 52 B9R2.25 O=C1OC(C2C1C2)=O BCP11186 [0,0,0,1,0,1|0,0,0]=2 53 B5R0.5 O=C(C)C([O-])=O BCP13503 [0,0,1,0,1,0|1,0,0]=3 54 B5R1.2 O=C1CCO1 BCP07366 [1,0,0,0,1,0|0,0,0]=2 55 B5R1.2 O=C1CNC1 BCP10186 [1,0,0,0,1,0|1,0,1]=4 56 B5R1.2 O=C1COC1 BCP05482 [1,0,0,0,1,0|1,0,1]=4 57 B5R1.2 O=C1O[Mg]O1 BCP17142 [1,0,0,0,1,0|2,0,0]=4