0 B5R0.3 C(C(CN)O)N BCP18704 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.3 C(C(CO)N)O BCP04588 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.3 CC[C](N)CO BCP16938 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.3 NCC(CO)O BCP18703 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.3 O=C(CBr)CC BCP08723 [0,0,0,0,0,0|1,0,3]=4 5 B5R0.3 O[C](CCl)CN BCP08810 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.3 SC(CS)CO BCP18145 [0,0,0,0,0,0|2,1,1]=4 7 B4R0.1 C=CC(Cl)=O BCP06212 [1,0,0,0,0,0|1,0,2]=4 8 B4R0.1 CC(C)[Mg]Cl BCP10965 [1,0,0,0,0,0|3,0,0]=4 9 B4R0.1 CC(Cl)C#N BCP10983 [1,0,0,0,0,0|2,0,1]=4 10 B4R0.1 CC(O)C#C BCP05896 [1,0,0,0,0,0|0,0,2]=3 11 B4R0.1 CC(O)CN BCP08083 [1,0,0,0,0,0|1,0,1]=3 12 B4R0.1 C[C@@H](O)C#C BCP15480 [1,0,0,0,0,0|0,0,2]=3 13 B4R0.1 C[C@@H](O)CC BCP06774 [1,0,0,0,0,0|0,0,1]=2 14 B4R0.1 C[C@H](N)CN BCP05857 [1,0,0,0,0,0|2,0,1]=4 15 B4R0.1 FC(F)CO BCP05861 [1,0,0,0,0,0|3,0,0]=4 16 B4R0.1 NC(C=C)=O BCP25183 [1,0,0,0,0,0|1,0,2]=4 17 B4R0.1 O=C(O)CCl BCP20585 [1,0,0,0,0,0|2,0,1]=4 18 B4R0.1 O=CC(O)=O BCP15407 [1,0,0,0,0,0|2,0,1]=4 19 B4R0.2 C#CCCN BCP19829 [1,0,0,0,0,0|1,0,2]=4 20 B4R0.2 C=CCON BCP19009 [1,0,0,0,0,0|2,0,0]=3 21 B4R0.2 CCN=C=S BCP05940 [1,0,0,0,0,0|2,0,1]=4 22 B4R0.2 CSCCN BCP16561 [1,0,0,0,0,0|2,0,1]=4 23 B4R0.2 ClCCCBr BCP16557 [1,0,0,0,0,0|2,0,1]=4 24 B4R0.2 NCCOC BCP15361 [1,0,0,0,0,0|2,0,1]=4 25 B4R0.2 NOCCO BCP11232 [1,0,0,0,0,0|3,0,0]=4 26 B6R0.1 O=C(C=C)OCC BCP06341 [0,1,0,0,0,0|0,0,2]=3 27 B6R0.1 OC[C@@H](C)COC BCP11697 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.3 CC[C@@H](N)C(O)=O BCP17075 [0,1,0,0,0,0|2,0,0]=3 29 B6R0.3 CC[C](N)C(O)=O BCP04716 [0,1,0,0,0,0|2,0,1]=4 30 B6R0.3 C[C@@H](CC)C(O)=O BCP18859 [0,1,0,0,0,0|2,0,0]=3 31 B6R0.3 NC(CC)C(N)=O BCP08675 [0,1,0,0,0,0|2,0,0]=3 32 B6R0.3 N[C@H](C(O)=N)CO BCP06965 [0,1,0,0,0,0|3,0,0]=4 33 B6R0.9 OCC(CO)CO BCP14986 [0,1,0,0,0,0|2,0,1]=4 34 B6R1.2 CC1CCCO1 BCP16203 [0,0,0,1,0,0|2,0,1]=4 35 B6R1.2 F[C@@H]1CCNC1 BCP14098 [0,0,0,1,0,0|2,0,1]=4 36 B6R1.2 IC1COCC1 BCP14190 [0,0,0,1,0,0|2,0,1]=4 37 B6R1.2 N[C@@H]1COCC1 BCP06180 [0,0,0,1,0,0|2,0,1]=4 38 B6R1.2 O=C1OCC=C1 BCP15247 [0,0,0,1,0,0|1,0,2]=4 39 B6R1.2 OC1COCC1 BCP13266 [0,0,0,1,0,0|1,0,1]=3 40 B6R1.2 O[C@@H]1CNCC1 BCP14826 [0,0,0,1,0,0|1,0,1]=3 41 B6R1.2 O[C@@H]1CNCC1 BCP15469 [0,0,0,1,0,0|1,0,1]=3 42 B6R1.2 O[C]1COCC1 BCP04605 [0,0,0,1,0,0|1,0,2]=4 43 B6R1.6 BrCC1CCC1 BCP18414 [0,0,0,1,0,0|2,0,1]=4 44 B6R1.6 OCC1CCC1 BCP17767 [0,0,0,1,0,0|2,0,1]=4 45 B3R0.1 C=CC=O BCP07056 [2,0,0,0,0,0|0,0,2]=4 46 B3R0.1 CCCN BCP18818 [2,0,0,0,0,0|1,0,0]=3 47 B3R0.1 COCCl BCP08223 [2,0,0,0,0,0|2,0,0]=4 48 B3R0.1 NCCS BCP15015 [2,0,0,0,0,0|1,1,0]=4 49 B3R0.1 NCCS BCP15033 [2,0,0,0,0,0|1,1,0]=4 50 B3R0.2 CB(O)O BCP10976 [2,0,0,0,0,0|2,0,0]=4 51 B3R0.2 CC(Br)Cl BCP14483 [2,0,0,0,0,0|2,0,0]=4 52 B3R0.2 CC(O)=O BCP05544 [2,0,0,0,0,0|1,0,1]=4 53 B5R0.1 C[C@@H](N)CCO BCP01279 [1,1,0,0,0,0|1,0,1]=4 54 B5R0.1 C[C@@H](N)COC BCP19342 [1,1,0,0,0,0|1,0,1]=4 55 B5R0.1 OC(CCO)=O BCP05902 [1,1,0,0,0,0|1,0,1]=4 56 B5R0.1 OC(CCS)=O BCP16636 [1,1,0,0,0,0|1,0,1]=4 57 B5R0.4 CC(O)(C)C#C BCP18661 [1,1,0,0,0,0|0,0,2]=4 58 B5R0.4 CC(O)(C)CN BCP16117 [1,1,0,0,0,0|1,0,1]=4 59 B5R0.5 C=C(Cl)C(O)=O BCP13841 [1,1,0,0,0,0|1,0,1]=4 60 B5R0.5 CC(C)C(C)O BCP29487 [1,1,0,0,0,0|0,0,1]=3 61 B5R0.5 CC(C)C(N)=N BCP07536 [1,1,0,0,0,0|2,0,0]=4 62 B5R0.5 C[C@@H](Cl)C(O)=O BCP14313 [1,1,0,0,0,0|1,0,1]=4 63 B5R0.5 C[C@@H](N)C(C)C BCP06945 [1,1,0,0,0,0|1,0,1]=4 64 B5R0.2 C=CCCC=C BCP08456 [1,1,0,0,0,0|0,0,1]=3 65 B5R0.2 ClCCOCC BCP15316 [1,1,0,0,0,0|1,0,1]=4 66 B5R0.2 NCCCCO BCP18612 [1,1,0,0,0,0|1,0,1]=4 67 B5R0.2 O=CCCC=O BCP20105 [1,1,0,0,0,0|1,0,1]=4 68 B7R0.2 O=C(O)C[C@@H](N)CC BCP07772 [0,2,0,0,0,0|1,0,1]=4 69 B7R0.5 CNC[C@H](N)C(O)=O BCP26260 [0,2,0,0,0,0|2,0,0]=4 70 B7R0.5 N[C@@H](COC)C(O)=O BCP14284 [0,2,0,0,0,0|2,0,0]=4 71 B7R0.5 O=C(O)[C@@H](CCN)N BCP11565 [0,2,0,0,0,0|2,0,0]=4 72 B7R0.10 O[C@@H](CO)C(CO)=O BCP10464 [0,2,0,0,0,0|1,0,1]=4 73 B7R0.12 COC(OC)CSC BCP20569 [0,2,0,0,0,0|1,0,1]=4 74 B7R0.13 N[C@](C(O)=O)(CC)C BCP11781 [0,2,0,0,0,0|2,0,0]=4 75 B7R0.16 CC(C)[C@@H](N)C(O)=O BCP10545 [0,2,0,0,0,0|2,0,0]=4 76 B7R0.16 N[C@@H]([C@@H](O)C)C(O)=O BCP08009 [0,2,0,0,0,0|2,0,0]=4 77 B5R1.2 O=C1CCO1 BCP07366 [1,0,0,1,0,0|1,0,1]=4 78 B5R1.3 C1C(O1)CCl BCP13411 [1,0,0,1,0,0|1,0,1]=4 79 B5R1.3 ClC[C@@H]1OC1 BCP08874 [1,0,0,1,0,0|1,0,1]=4 80 B5R1.1 C1=CCNC1 BCP09734 [1,0,0,1,0,0|1,0,0]=3 81 B7R1.1 BrCC1=CC=NO1 BCP11397 [0,1,0,1,0,0|1,0,1]=4 82 B7R1.1 CCC1=CC=CN1 BCP04114 [0,1,0,1,0,0|1,0,1]=4 83 B7R1.1 CNC1COCC1 BCP11597 [0,1,0,1,0,0|1,0,1]=4 84 B7R1.1 ClCC1=NC=CO1 BCP11468 [0,1,0,1,0,0|1,0,1]=4 85 B7R1.1 NCC1=CC=NO1 BCP11419 [0,1,0,1,0,0|1,0,1]=4 86 B7R1.1 NCC1=NC=CO1 BCP04231 [0,1,0,1,0,0|1,0,1]=4 87 B7R1.1 NCC1=NC=CO1 BCP16393 [0,1,0,1,0,0|1,0,1]=4 88 B7R1.1 O=CC1CCCC1 BCP12309 [0,1,0,1,0,0|2,0,0]=4 89 B7R1.1 OCC1=CC=NO1 BCP11418 [0,1,0,1,0,0|1,0,1]=4 90 B7R1.1 OCC1CCCC1 BCP29184 [0,1,0,1,0,0|0,0,2]=4 91 B7R1.1 OCC1OCCO1 BCP19203 [0,1,0,1,0,0|1,0,1]=4 92 B7R1.1 OC[C@@H]1CNCC1 BCP20710 [0,1,0,1,0,0|1,0,1]=4 93 B7R1.1 OCc1cnco1 BCP16363 [0,1,0,1,0,0|1,0,1]=4 94 B7R1.2 O=C1NCC(O)C1 BCP07569 [0,1,0,1,0,0|1,0,1]=4 95 B7R1.3 OC1C=CCCC1 BCP18001 [0,1,0,1,0,0|0,0,0]=2 96 B7R1.3 OC1CCCNC1 BCP05290 [0,1,0,1,0,0|0,0,2]=4 97 B7R1.3 OC1CCOCC1 BCP04889 [0,1,0,1,0,0|0,0,2]=4 98 B7R1.3 OC1CNCCC1 BCP05289 [0,1,0,1,0,0|0,0,2]=4 99 B7R1.4 C=C1CCOC1=O BCP18620 [0,1,0,1,0,0|0,0,2]=4 100 B7R1.4 N[C@@H]1CCC[C@H]1O BCP12204 [0,1,0,1,0,0|0,0,2]=4 101 B7R1.4 N[C@H]1CCOC1=O BCP20062 [0,1,0,1,0,0|2,0,0]=4 102 B7R1.4 O=C1OCC[C@@H]1N BCP19716 [0,1,0,1,0,0|2,0,0]=4 103 B7R1.4 OC1=CC=N[N]1C BCP17282 [0,1,0,1,0,0|1,0,1]=4 104 B7R1.4 OC1CCNC1=O BCP00893 [0,1,0,1,0,0|1,0,0]=3 105 B7R1.19 CC1(CC1)C(O)=O BCP16042 [0,1,0,1,0,0|2,0,0]=4 106 B7R1.19 NC1(CC1)C(O)=O BCP05245 [0,1,0,1,0,0|2,0,0]=4