0 B6R1.2 NC1=NCCC1 BBL031757 [0,0,0,0,0,0|3,0,1]=4 1 B6R1.2 NC1=NCCS1 BBL000029 [0,0,0,0,0,0|2,0,1]=3 2 B6R1.2 NC1CCCC1 BBL036999 [0,0,0,0,0,0|3,0,0]=3 3 B6R1.2 O=C1OCCO1 BBL011402 [0,0,0,0,0,0|1,2,1]=4 4 B6R1.2 SC1=NCCS1 BBL027511 [0,0,0,0,0,0|2,0,1]=3 5 B7R1.1 BrCC1OCCO1 BBL027424 [0,1,0,0,0,0|0,2,0]=3 6 B7R1.1 CNC1CCSC1 BBL035010 [0,1,0,0,0,0|3,0,0]=4 7 B7R1.1 ClCC1OCCO1 BBL011357 [0,1,0,0,0,0|0,2,0]=3 8 B7R1.1 OCC1CCCN1 BBL021035 [0,1,0,0,0,0|2,0,0]=3 9 B7R1.2 CC1CCC(=O)O1 BBL011475 [0,1,0,0,0,0|1,1,1]=4 10 B7R1.4 NC1CCSC1=O BBL028068 [0,1,0,0,0,0|2,0,1]=4 11 B5R0.1 CC(C)CCBr BBL011503 [0,0,1,0,0,0|3,0,0]=4 12 B5R0.1 CC(C)CCS BBL027486 [0,0,1,0,0,0|3,0,0]=4 13 B5R0.1 CC(O)CCO BBL037424 [0,0,1,0,0,0|2,1,0]=4 14 B5R0.1 CCCC(C)O BBL011460 [0,0,1,0,0,0|1,1,0]=3 15 B5R0.2 BrCCCCBr BBL027293 [0,0,1,0,0,0|3,0,0]=4 16 B5R0.2 CCCCC=O BBL027632 [0,0,1,0,0,0|1,1,1]=4 17 B5R0.2 CCCCCN BBL011398 [0,0,1,0,0,0|2,0,0]=3 18 B5R0.2 CCNCCO BBL027409 [0,0,1,0,0,0|1,1,0]=3 19 B5R0.2 CCOCCBr BBL013472 [0,0,1,0,0,0|1,1,0]=3 20 B5R0.2 CNCCCN BBL011479 [0,0,1,0,0,0|3,0,0]=4 21 B5R0.2 COCCCN BBL011597 [0,0,1,0,0,0|3,0,0]=4 22 B5R0.2 NCCCCN BBL027703 [0,0,1,0,0,0|3,0,0]=4 23 B5R1.2 OC1CNC1 BBL023120 [0,0,0,0,1,0|3,0,0]=4 24 B7R1.3 OC1CCCCC1 BBL013186 [0,0,0,0,0,1|3,0,0]=4 25 B4R0.1 CC(C)C=O BBL034648 [1,0,1,0,0,0|2,0,0]=4 26 B4R0.1 CC(C)CBr BBL036259 [1,0,1,0,0,0|2,0,0]=4 27 B4R0.1 CC(N)CN BBL027674 [1,0,1,0,0,0|2,0,0]=4 28 B4R0.1 CC(O)CCl BBL011446 [1,0,1,0,0,0|1,1,0]=4 29 B4R0.1 CC(O)CN BBL027685 [1,0,1,0,0,0|1,1,0]=4 30 B4R0.1 CC(O)CO BBL011472 [1,0,1,0,0,0|1,1,0]=4 31 B4R0.1 CCC(C)O BBL011463 [1,0,1,0,0,0|0,1,0]=3 32 B4R0.2 BrCCCBr BBL011375 [1,0,1,0,0,0|2,0,0]=4 33 B4R0.2 CCCCCl BBL012221 [1,0,1,0,0,0|1,0,0]=3 34 B4R0.2 CCCCI BBL027320 [1,0,1,0,0,0|1,0,0]=3 35 B4R0.2 CCCCN BBL027788 [1,0,1,0,0,0|1,0,0]=3 36 B4R0.2 CNCCN BBL027689 [1,0,1,0,0,0|2,0,0]=4 37 B4R0.2 CNCCO BBL027408 [1,0,1,0,0,0|1,1,0]=4 38 B4R0.2 NCCCBr BBL010090 [1,0,1,0,0,0|2,0,0]=4 39 B4R0.2 NCCCCl BBL009705 [1,0,1,0,0,0|2,0,0]=4 40 B4R0.2 NCCCN BBL027701 [1,0,1,0,0,0|2,0,0]=4 41 B4R0.2 OCCCBr BBL027416 [1,0,1,0,0,0|1,1,0]=4 42 B6R0.4 CC(C)OCCCl BBL030951 [0,1,1,0,0,0|1,1,0]=4 43 B6R0.6 BrCCCCCBr BBL012205 [0,1,1,0,0,0|2,0,0]=4 44 B6R0.6 CCCCCCBr BBL012217 [0,1,1,0,0,0|2,0,0]=4 45 B6R0.6 CCCCCCI BBL011465 [0,1,1,0,0,0|2,0,0]=4 46 B6R0.6 CCCCCCN BBL011106 [0,1,1,0,0,0|2,0,0]=4 47 B6R0.6 CCCNCCC BBL027756 [0,1,1,0,0,0|2,0,0]=4 48 B6R0.6 CCOCCCN BBL027700 [0,1,1,0,0,0|1,1,0]=4 49 B6R0.6 NCCCCCN BBL027704 [0,1,1,0,0,0|2,0,0]=4 50 B6R0.6 NCCNCCN BBL005239 [0,1,1,0,0,0|2,0,0]=4 51 B6R0.6 NCCNCCO BBL027690 [0,1,1,0,0,0|1,1,0]=4 52 B6R0.6 NCCOCCO BBL011501 [0,1,1,0,0,0|0,2,0]=4 53 B6R0.6 NCCSCCO BBL028287 [0,1,1,0,0,0|0,1,0]=3 54 B6R0.9 COC(CCl)OC BBL011494 [0,1,1,0,0,0|0,2,0]=4 55 B6R0.9 COC(CN)OC BBL011384 [0,1,1,0,0,0|0,2,0]=4 56 B8R1.2 BrCC1CCCCO1 BBL027774 [0,1,0,0,0,1|1,1,0]=4 57 B8R1.2 CCC1CCCCN1 BBL100012 [0,1,0,0,0,1|2,0,0]=4 58 B8R1.2 CNC1CCSCC1 BBL032171 [0,1,0,0,0,1|2,0,0]=4 59 B8R1.2 COC1CCNCC1 BBL025762 [0,1,0,0,0,1|2,0,0]=4 60 B8R1.2 ClCC1CCCCO1 BBL027598 [0,1,0,0,0,1|1,1,0]=4 61 B8R1.2 ClCC1COCCO1 BBL033753 [0,1,0,0,0,1|0,2,0]=4 62 B8R1.3 CC1CCC(N)CC1 BBL036898 [0,1,0,0,0,1|2,0,0]=4 63 B8R1.3 CC1CNC(C)CN1 BBL027547 [0,1,0,0,0,1|2,0,0]=4 64 B8R1.4 CC1CCCC(=O)C1 BBL013179 [0,1,0,0,0,1|2,0,0]=4 65 B8R1.4 CC1CCNC(C)C1 BBL038129 [0,1,0,0,0,1|2,0,0]=4 66 B8R1.5 CC1CCCCC1=O BBL011421 [0,1,0,0,0,1|2,0,0]=4 67 B8R1.7 CC(C)C1CCCN1 BBL020618 [0,2,0,0,0,0|2,0,0]=4 68 B8R1.7 CC(N)C1CCCO1 BBL037392 [0,2,0,0,0,0|1,1,0]=4 69 B8R1.7 O=C(O)C1NCCS1 BBL034715 [0,2,0,0,0,0|1,0,1]=4 70 B8R1.52 CC1(CBr)OCCO1 BBL037736 [0,2,0,0,0,0|0,2,0]=4