0 B5R0.1 CC(C)N=C=O BCP15287 [0,0,0,0,0,0|1,0,1]=2 1 B5R0.1 CN(CCBr)C BCP20000 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.1 C[C@@H](N)CCO BCP01279 [0,0,0,0,0,0|1,0,2]=3 3 B5R0.1 C[C@@H](N)COC BCP19342 [0,0,0,0,0,0|3,0,0]=3 4 B5R0.1 NNCC(C)C BCP06610 [0,0,0,0,0,0|2,0,0]=2 5 B4R0.1 CC(C)[Mg]Cl BCP10965 [1,0,0,0,0,0|2,0,0]=3 6 B4R0.1 CC(CBr)=O BCP06577 [1,0,0,0,0,0|2,0,1]=4 7 B4R0.1 CC(Cl)C#N BCP10983 [1,0,0,0,0,0|2,0,1]=4 8 B4R0.1 CC(O)C#C BCP05896 [1,0,0,0,0,0|1,0,2]=4 9 B4R0.1 CC(O)CN BCP08083 [1,0,0,0,0,0|2,0,0]=3 10 B4R0.1 CN(C)NC BCP16365 [1,0,0,0,0,0|2,0,1]=4 11 B4R0.1 C[C@@H](O)C#C BCP15480 [1,0,0,0,0,0|1,0,2]=4 12 B4R0.1 C[C@@H](O)CC BCP06774 [1,0,0,0,0,0|1,0,1]=3 13 B4R0.1 C[C@H](N)CN BCP05857 [1,0,0,0,0,0|2,0,0]=3 14 B4R0.1 C[C](N)CO BCP13388 [1,0,0,0,0,0|1,0,2]=4 15 B4R0.1 FC(F)CO BCP05861 [1,0,0,0,0,0|2,0,1]=4 16 B4R0.1 O=CC(O)=O BCP15407 [1,0,0,0,0,0|2,0,1]=4 17 B4R0.2 C#CCCN BCP19829 [1,0,0,0,0,0|2,0,1]=4 18 B4R0.2 C=CCON BCP19009 [1,0,0,0,0,0|3,0,0]=4 19 B4R0.2 CCN=C=S BCP05940 [1,0,0,0,0,0|1,1,1]=4 20 B4R0.2 CSCCN BCP16561 [1,0,0,0,0,0|2,0,1]=4 21 B4R0.2 ClCCCBr BCP16557 [1,0,0,0,0,0|2,0,1]=4 22 B4R0.2 NCCOC BCP15361 [1,0,0,0,0,0|2,0,1]=4 23 B4R0.2 NOCCO BCP11232 [1,0,0,0,0,0|3,0,0]=4 24 B6R0.1 OC[C@@H](C)COC BCP11697 [0,1,0,0,0,0|2,0,0]=3 25 B6R0.2 CC(C)CC(N)=O BCP05941 [0,1,0,0,0,0|0,0,0]=1 26 B6R0.2 CC(C)NC(C)=O BCP19527 [0,1,0,0,0,0|1,0,0]=2 27 B6R0.2 CC(CC(N)=O)=O BCP19964 [0,1,0,0,0,0|1,0,1]=3 28 B6R0.2 CC(OC(C)=O)=O BCP20665 [0,1,0,0,0,0|2,0,1]=4 29 B6R0.2 CC(\C=C([O-])C)=O BCP15074 [0,1,0,0,0,0|1,0,2]=4 30 B6R0.2 C[C@@H](N)CC(O)=O BCP11586 [0,1,0,0,0,0|1,0,0]=2 31 B6R0.2 C[C@@H](N)CC(O)=O BCP16924 [0,1,0,0,0,0|1,0,0]=2 32 B6R0.2 OB(CC(C)C)O BCP12813 [0,1,0,0,0,0|1,0,1]=3 33 B6R0.2 OC(CC(O)=O)=O BCP05571 [0,1,0,0,0,0|2,0,1]=4 34 B6R0.4 BrCCCN(C)C BCP18662 [0,1,0,0,0,0|2,0,1]=4 35 B6R0.4 CC(C)CCCO BCP06801 [0,1,0,0,0,0|0,0,2]=3 36 B6R0.5 C[N+](C)(C)CC=C BCP14578 [0,1,0,0,0,0|2,0,0]=3 37 B6R0.5 NC(CCO)(C)C BCP10686 [0,1,0,0,0,0|0,0,2]=3 38 B6R1.2 CC1CCCO1 BCP16203 [0,0,0,1,0,0|2,0,1]=4 39 B6R1.2 F[C@@H]1CCNC1 BCP14098 [0,0,0,1,0,0|2,0,1]=4 40 B6R1.2 IC1COCC1 BCP14190 [0,0,0,1,0,0|1,0,2]=4 41 B6R1.2 N[C@@H]1COCC1 BCP06180 [0,0,0,1,0,0|1,0,2]=4 42 B6R1.2 OC1COCC1 BCP13266 [0,0,0,1,0,0|1,0,2]=4 43 B6R1.2 O[C@@H]1CNCC1 BCP14826 [0,0,0,1,0,0|2,0,1]=4 44 B6R1.2 O[C@@H]1CNCC1 BCP15469 [0,0,0,1,0,0|2,0,1]=4 45 B6R1.5 OC1CN(C)C1 BCP20498 [0,0,0,1,0,0|1,0,2]=4 46 B6R1.10 NC1(C)CCC1 BCP13870 [0,0,0,1,0,0|2,0,1]=4 47 B3R0.1 C#CC=O BCP06452 [2,0,0,0,0,0|0,0,2]=4 48 B3R0.1 C=CC=O BCP07056 [2,0,0,0,0,0|0,0,2]=4 49 B3R0.1 CCCN BCP18818 [2,0,0,0,0,0|1,0,0]=3 50 B3R0.1 COCCl BCP08223 [2,0,0,0,0,0|2,0,0]=4 51 B3R0.1 NCCS BCP15015 [2,0,0,0,0,0|1,1,0]=4 52 B3R0.1 NCCS BCP15033 [2,0,0,0,0,0|1,1,0]=4 53 B3R0.2 CC(Br)Cl BCP14483 [2,0,0,0,0,0|2,0,0]=4 54 B3R0.2 CC(O)=O BCP05544 [2,0,0,0,0,0|1,0,1]=4 55 B3R0.2 [O-]C(=O)C BCP05504 [2,0,0,0,0,0|1,0,1]=4 56 B5R0.3 C(C(CN)O)N BCP18704 [1,1,0,0,0,0|2,0,0]=4 57 B5R0.3 C(C(CO)N)O BCP04588 [1,1,0,0,0,0|1,0,1]=4 58 B5R0.3 NCC(CO)O BCP18703 [1,1,0,0,0,0|1,0,1]=4 59 B5R0.3 SC(CS)CO BCP18145 [1,1,0,0,0,0|1,0,1]=4 60 B5R0.4 CC(C)(C)CN BCP11254 [1,1,0,0,0,0|1,0,0]=3 61 B5R0.4 CC(C)(S)CN BCP10543 [1,1,0,0,0,0|1,0,0]=3 62 B5R0.4 CC(O)(C)C#C BCP18661 [1,1,0,0,0,0|0,0,2]=4 63 B5R0.4 CC(O)(C)CN BCP16117 [1,1,0,0,0,0|1,0,0]=3 64 B5R0.4 FC(CO)(C)F BCP15466 [1,1,0,0,0,0|1,0,1]=4 65 B5R0.4 NOC(C)(C)C BCP10169 [1,1,0,0,0,0|2,0,0]=4 66 B5R0.5 CC(C)C(C)O BCP29487 [1,1,0,0,0,0|0,0,1]=3 67 B5R0.5 CC(C)C(N)=N BCP07536 [1,1,0,0,0,0|1,0,0]=3 68 B5R0.5 C[C@@H](Cl)C(O)=O BCP14313 [1,1,0,0,0,0|1,0,0]=3 69 B5R0.5 C[C@@H](N)C(C)C BCP06945 [1,1,0,0,0,0|0,0,1]=3 70 B5R0.5 C[C](Cl)C(O)=O BCP11281 [1,1,0,0,0,0|1,0,1]=4 71 B5R0.5 O=C(C)C([O-])=O BCP13503 [1,1,0,0,0,0|1,0,1]=4 72 B5R0.2 C=CCCC=C BCP08456 [1,1,0,0,0,0|1,0,1]=4 73 B5R0.2 ClCCOCC BCP15316 [1,1,0,0,0,0|1,0,1]=4 74 B5R0.2 NCCCCO BCP18612 [1,1,0,0,0,0|0,0,2]=4 75 B5R0.2 O=CCCC=O BCP20105 [1,1,0,0,0,0|0,0,1]=3 76 B7R0.2 CC(CN(C)C)CCl BCP09620 [0,2,0,0,0,0|2,0,0]=4 77 B7R0.2 CC(N)CC(C)CC BCP07039 [0,2,0,0,0,0|1,0,1]=4 78 B7R0.2 CC(N)CC(C)CC BCP18792 [0,2,0,0,0,0|1,0,1]=4 79 B7R0.2 C[C@@H](O)CC(OC)=O BCP15245 [0,2,0,0,0,0|1,0,0]=3 80 B7R0.2 C[C](O)CC(OC)=O BCP12973 [0,2,0,0,0,0|1,0,1]=4 81 B7R0.2 O=C(O)C[C@@H](N)CC BCP07772 [0,2,0,0,0,0|1,0,0]=3 82 B7R0.2 O=C(OC)C=C(C)C BCP10333 [0,2,0,0,0,0|0,0,2]=4 83 B7R0.10 NCC(C)[C@@H](CO)N BCP14692 [0,2,0,0,0,0|0,0,2]=4 84 B7R0.12 COC(OC)CSC BCP20569 [0,2,0,0,0,0|2,0,0]=4 85 B7R0.9 CC(C)CS(=O)(Cl)=O BCP07920 [0,2,0,0,0,0|1,0,0]=3 86 B7R0.16 CC(C)[C@@H](N)C(O)=O BCP10545 [0,2,0,0,0,0|0,0,0]=2 87 B7R0.16 N[C@@H]([C@@H](O)C)C(O)=O BCP08009 [0,2,0,0,0,0|1,0,0]=3 88 B7R0.16 O=C(C([O-])=O)C(C)C BCP18017 [0,2,0,0,0,0|0,0,1]=3 89 B7R0.6 O=C(O)CSC(F)F BCP19125 [0,2,0,0,0,0|2,0,0]=4 90 B7R0.6 O=[N+](\C=C\N(C)C)[O-] BCP29102 [0,2,0,0,0,0|1,0,1]=4 91 B7R0.8 C[Si](C)(C)C\C=C\O BCP10915 [0,2,0,0,0,0|0,1,1]=4 92 B5R1.2 FC1CNC1 BCP14095 [1,0,0,1,0,0|2,0,0]=4 93 B5R1.2 IC1COC1 BCP08336 [1,0,0,1,0,0|1,0,1]=4 94 B5R1.2 NC1COC1 BCP07405 [1,0,0,1,0,0|1,0,1]=4 95 B5R1.2 NC1COC1 BCP10369 [1,0,0,1,0,0|1,0,1]=4 96 B5R1.3 C1C(O1)CCl BCP13411 [1,0,0,1,0,0|2,0,0]=4 97 B5R1.3 CNC1CC1 BCP29185 [1,0,0,1,0,0|1,0,1]=4 98 B5R1.3 ClC[C@@H]1OC1 BCP08874 [1,0,0,1,0,0|2,0,0]=4 99 B5R1.3 NNC1CC1 BCP28107 [1,0,0,1,0,0|2,0,0]=4 100 B5R1.1 C1=CCNC1 BCP09734 [1,0,0,1,0,0|2,0,0]=4 101 B7R1.1 CNC1COCC1 BCP11597 [0,1,0,1,0,0|0,0,2]=4 102 B7R1.1 OCC1CCCC1 BCP29184 [0,1,0,1,0,0|1,0,1]=4 103 B7R1.1 OC[C@@H]1CNCC1 BCP20710 [0,1,0,1,0,0|1,0,1]=4 104 B7R1.2 O=C1NCC(O)C1 BCP07569 [0,1,0,1,0,0|1,0,0]=3 105 B7R1.2 O=C1OC[C@@H](C)O1 BCP12993 [0,1,0,1,0,0|1,0,0]=3 106 B7R1.3 C[C@@H]1CNCCN1 BCP19769 [0,1,0,1,0,0|1,0,1]=4 107 B7R1.3 C[C@@H]1CNCCO1 BCP07192 [0,1,0,1,0,0|1,0,1]=4 108 B7R1.3 C[C@@H]1NCCOC1 BCP05272 [0,1,0,1,0,0|0,0,2]=4 109 B7R1.3 C[C@@H]1NCCOC1 BCP06972 [0,1,0,1,0,0|0,0,2]=4 110 B7R1.12 O=C(O)[C@@H]1[C@@H](C1)F BCP07708 [0,1,0,1,0,0|1,0,0]=3 111 B7R1.20 O=C(O)CC1CC1 BCP05386 [0,1,0,1,0,0|0,0,0]=2 112 B7R2.13 C12CNCC1C2 BCP14124 [0,0,0,2,0,0|1,0,1]=4