0 B5R0.2 BrCCCCBr BBL027293 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.2 CCCCC=O BBL027632 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.2 CCCCCN BBL011398 [0,0,0,0,0,0|3,0,0]=3 3 B5R0.2 CCNCCO BBL027409 [0,0,0,0,0,0|3,0,0]=3 4 B5R0.2 CCOCCBr BBL013472 [0,0,0,0,0,0|2,1,0]=3 5 B5R0.2 CNCCCN BBL011479 [0,0,0,0,0,0|4,0,0]=4 6 B5R0.2 COCCCN BBL011597 [0,0,0,0,0,0|4,0,0]=4 7 B5R0.2 NCCCCN BBL027703 [0,0,0,0,0,0|4,0,0]=4 8 B4R0.2 BrCCCBr BBL011375 [1,0,0,0,0,0|3,0,0]=4 9 B4R0.2 CCCCCl BBL012221 [1,0,0,0,0,0|2,0,0]=3 10 B4R0.2 CCCCI BBL027320 [1,0,0,0,0,0|2,0,0]=3 11 B4R0.2 CCCCN BBL027788 [1,0,0,0,0,0|2,0,0]=3 12 B4R0.2 CNCCN BBL027689 [1,0,0,0,0,0|3,0,0]=4 13 B4R0.2 CNCCO BBL027408 [1,0,0,0,0,0|3,0,0]=4 14 B4R0.2 C\C=C\CO BBL027414 [1,0,0,0,0,0|2,0,1]=4 15 B4R0.2 N#CSCCl BBL027358 [1,0,0,0,0,0|2,0,1]=4 16 B4R0.2 NCCCBr BBL010090 [1,0,0,0,0,0|3,0,0]=4 17 B4R0.2 NCCCCl BBL009705 [1,0,0,0,0,0|3,0,0]=4 18 B4R0.2 NCCCN BBL027701 [1,0,0,0,0,0|3,0,0]=4 19 B4R0.2 OCCCBr BBL027416 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.1 CCOC(=O)CBr BBL027288 [0,1,0,0,0,0|2,1,0]=4 21 B6R0.1 CCOC(=O)CCl BBL012578 [0,1,0,0,0,0|2,1,0]=4 22 B6R0.1 CCOC(=O)CS BBL011508 [0,1,0,0,0,0|2,1,0]=4 23 B6R0.4 CC(C)OCCCl BBL030951 [0,1,0,0,0,0|2,1,0]=4 24 B6R0.4 CCCCC(C)=O BBL011434 [0,1,0,0,0,0|2,0,1]=4 25 B6R0.6 BrCCCCCBr BBL012205 [0,1,0,0,0,0|3,0,0]=4 26 B6R0.6 CCCCCCBr BBL012217 [0,1,0,0,0,0|2,0,0]=3 27 B6R0.6 CCCCCCI BBL011465 [0,1,0,0,0,0|2,0,0]=3 28 B6R0.6 CCCCCCN BBL011106 [0,1,0,0,0,0|2,0,0]=3 29 B6R0.6 CCCNCCC BBL027756 [0,1,0,0,0,0|2,0,0]=3 30 B6R0.6 CCOCCCN BBL027700 [0,1,0,0,0,0|1,1,0]=3 31 B6R0.6 NCCCCCN BBL027704 [0,1,0,0,0,0|3,0,0]=4 32 B6R0.6 NCCNCCN BBL005239 [0,1,0,0,0,0|3,0,0]=4 33 B6R0.6 NCCNCCO BBL027690 [0,1,0,0,0,0|3,0,0]=4 34 B6R0.6 NCCOCCO BBL011501 [0,1,0,0,0,0|2,1,0]=4 35 B6R0.6 NCCSCCO BBL028287 [0,1,0,0,0,0|2,0,0]=3 36 B6R1.2 NC1CCCC1 BBL036999 [0,0,0,1,0,0|3,0,0]=4 37 B6R1.2 O=C1CCSC1 BBL027522 [0,0,0,1,0,0|2,0,1]=4 38 B3R0.1 ClCCBr BBL011345 [2,0,0,0,0,0|2,0,0]=4 39 B3R0.1 NCCCl BBL011524 [2,0,0,0,0,0|2,0,0]=4 40 B3R0.1 OCCCl BBL011477 [2,0,0,0,0,0|2,0,0]=4 41 B3R0.1 OCCF BBL027407 [2,0,0,0,0,0|2,0,0]=4 42 B3R0.1 OCCI BBL037216 [2,0,0,0,0,0|2,0,0]=4 43 B3R0.1 SCCS BBL011363 [2,0,0,0,0,0|2,0,0]=4 44 B5R0.1 CC(C)CCBr BBL011503 [1,1,0,0,0,0|2,0,0]=4 45 B5R0.1 CC(C)CCS BBL027486 [1,1,0,0,0,0|2,0,0]=4 46 B5R0.1 CC(O)CCO BBL037424 [1,1,0,0,0,0|2,0,0]=4 47 B5R0.1 CCCC(C)O BBL011460 [1,1,0,0,0,0|1,0,0]=3 48 B5R0.1 CSCC(C)=O BBL100878 [1,1,0,0,0,0|1,0,1]=4 49 B5R0.3 CCC(=O)CC BBL027755 [1,1,0,0,0,0|1,0,0]=3 50 B5R0.3 CCC(N)CO BBL027677 [1,1,0,0,0,0|2,0,0]=4 51 B7R0.3 CCCCC(=O)CC BBL011476 [0,2,0,0,0,0|2,0,0]=4 52 B7R0.5 CCOC(=O)[C@H](C)O BBL009712 [0,2,0,0,0,0|1,1,0]=4 53 B7R0.7 CCCC(=O)CCC BBL009715 [0,2,0,0,0,0|2,0,0]=4 54 B7R0.7 CCCC(N)CCC BBL003306 [0,2,0,0,0,0|2,0,0]=4 55 B7R0.7 CCNC(=O)CCCl BBL037203 [0,2,0,0,0,0|2,0,0]=4 56 B7R0.7 CCOC(C)OCC BBL011492 [0,2,0,0,0,0|0,2,0]=4 57 B7R0.4 CCCCCC(C)=O BBL011381 [0,2,0,0,0,0|2,0,0]=4 58 B7R0.1 C=CCCCCCC BBL027759 [0,2,0,0,0,0|2,0,0]=4 59 B7R0.1 CCCCCCCI BBL027321 [0,2,0,0,0,0|2,0,0]=4 60 B7R0.1 NCCCCCCN BBL027705 [0,2,0,0,0,0|2,0,0]=4 61 B7R0.1 NCCSSCCN BBL010640 [0,2,0,0,0,0|0,0,0]=2 62 B5R1.3 CCC1CO1 BBL011530 [1,0,0,1,0,0|1,1,0]=4 63 B5R1.3 NCC1CC1 BBL027928 [1,0,0,1,0,0|2,0,0]=4 64 B7R1.1 CNC1CCSC1 BBL035010 [0,1,0,1,0,0|1,0,0]=3 65 B7R1.1 OCC1CCCN1 BBL021035 [0,1,0,1,0,0|2,0,0]=4 66 B7R1.2 CC1CCC(=O)O1 BBL011475 [0,1,0,1,0,0|1,1,0]=4 67 B7R1.3 NN1CCCCC1 BBL027587 [0,1,0,1,0,0|2,0,0]=4 68 B7R1.3 O=C1CCCCN1 BBL027557 [0,1,0,1,0,0|2,0,0]=4 69 B7R1.3 OC1CCCCC1 BBL013186 [0,1,0,1,0,0|2,0,0]=4 70 B7R1.4 NC1CCSC1=O BBL028068 [0,1,0,1,0,0|2,0,0]=4 71 B7R1.4 N[C@@H]1CSC[C@@H]1O BBL012757 [0,1,0,1,0,0|2,0,0]=4 72 B7R1.7 CCCCC1CO1 BBL011099 [0,1,0,1,0,0|2,0,0]=4