0 B10R0.3 C=C(C)CCCC(=O)OCC HR109800 [0,0,0,0,0,0|2,0,2]=4 1 B10R0.3 CC(C)CCCC(C)CCBr HR144869 [0,0,0,0,0,0|3,0,1]=4 2 B10R0.3 CCCC(=O)OCCC(C)C HR131806 [0,0,0,0,0,0|0,0,0]=0 3 B10R0.3 CCOC(=O)CCCC(C)=O HR116780 [0,0,0,0,0,0|3,0,1]=4 4 B9R0.1 C=CC(=O)OCCN(C)C HR125499 [1,0,0,0,0,0|1,0,2]=4 5 B9R0.1 CC(C)CCOC(=S)S[K] HR144988 [1,0,0,0,0,0|2,1,0]=4 6 B9R0.2 CC(C)CCCCCCO HR100685 [1,0,0,0,0,0|2,0,1]=4 7 B9R0.2 CCCCCCCC(C)O HR140839 [1,0,0,0,0,0|2,0,1]=4 8 B9R0.5 CCCCCC(O)CCC HR100209 [1,0,0,0,0,0|1,0,2]=4 9 B9R0.5 CCCCOC(=O)CC#N HR124420 [1,0,0,0,0,0|1,0,1]=3 10 B9R0.5 CCCCOC(=O)CCS HR144609 [1,0,0,0,0,0|1,0,0]=2 11 B9R0.5 CCC\C=C\C(=O)OCC HR127011 [1,0,0,0,0,0|2,0,1]=4 12 B9R0.5 CCOC(=O)CCCCBr HR125890 [1,0,0,0,0,0|3,0,0]=4 13 B9R0.5 CCOC(=O)CCCCN HR148504 [1,0,0,0,0,0|3,0,0]=4 14 B9R0.5 CCOCCC(=O)OCC HR122912 [1,0,0,0,0,0|3,0,0]=4 15 B9R0.5 COCCOC(=O)CC#N HR140049 [1,0,0,0,0,0|2,0,1]=4 16 B11R0.1 CCOC(=O)CC(=O)CC(C)C HR121098 [0,1,0,0,0,0|2,0,1]=4 17 B11R0.1 C\C=C\C(=O)OC(C)CC(C)C HR108384 [0,1,0,0,0,0|0,0,2]=3 18 B11R0.6 CC(C)CCOC(=O)CC(C)C HR132069 [0,1,0,0,0,0|0,0,0]=1 19 B11R0.145 CCC(C)C(=O)OCCC(C)C HR123321 [0,1,0,0,0,0|0,0,0]=1 20 B11R0.147 CCCCC(=O)OCCC(C)C HR110855 [0,1,0,0,0,0|0,0,0]=1 21 B11R0.180 CCCC(=O)SCC[N+](C)(C)C HR116425 [0,1,0,0,0,0|1,1,0]=3 22 B9R0.48 CC(C)COC(=O)CC#N HR125981 [0,0,0,0,1,0|1,0,1]=3 23 B9R0.48 CCCC(=O)OCC(C)C HR119768 [0,0,0,0,1,0|0,0,0]=1 24 B9R0.48 CCOC(=O)CCC(C)=O HR131025 [0,0,0,0,1,0|2,0,1]=4 25 B9R0.48 CCOC(=O)CCC(C)Cl HR102899 [0,0,0,0,1,0|2,0,0]=3 26 B9R0.48 C\C=C\C(=O)OCC(C)C HR133085 [0,0,0,0,1,0|0,0,2]=3 27 B8R0.6 CCCCCC(=O)CI HR120235 [2,0,0,0,0,0|2,0,0]=4 28 B8R0.6 CCCCCC(=O)SC HR105293 [2,0,0,0,0,0|2,0,0]=4 29 B8R0.6 CCCCNC(=O)CCl HR147680 [2,0,0,0,0,0|2,0,0]=4 30 B8R0.6 CCCCOC(=O)CO HR135884 [2,0,0,0,0,0|1,0,0]=3 31 B8R0.6 CCCCOC(=O)CS HR123589 [2,0,0,0,0,0|1,0,0]=3 32 B8R0.7 CC(C)CCCCCO HR101450 [2,0,0,0,0,0|1,0,1]=4 33 B8R0.7 CC(C)CCCCCO HR144906 [2,0,0,0,0,0|1,0,1]=4 34 B8R0.7 CCCCCCC(C)Br HR126862 [2,0,0,0,0,0|1,0,1]=4 35 B8R0.7 CCCCCCC(C)N HR132596 [2,0,0,0,0,0|1,0,1]=4 36 B8R0.7 CCCCCCC(C)N HR139394 [2,0,0,0,0,0|1,0,1]=4 37 B8R0.7 CCCCCCC(C)O HR125954 [2,0,0,0,0,0|1,0,1]=4 38 B8R0.7 CCCCCCC(C)O HR128561 [2,0,0,0,0,0|1,0,1]=4 39 B8R0.7 CCCCCCC(C)O HR132915 [2,0,0,0,0,0|1,0,1]=4 40 B8R0.7 CCCCCCC(C)O HR133230 [2,0,0,0,0,0|1,0,1]=4 41 B8R0.7 CCCCCCC(C)S HR114461 [2,0,0,0,0,0|1,0,1]=4 42 B8R0.7 CCCCOCC(C)O HR132803 [2,0,0,0,0,0|1,0,1]=4 43 B8R0.7 CN(C)CCOCCO HR105201 [2,0,0,0,0,0|2,0,0]=4 44 B8R0.28 CC(=O)CCCC(C)C HR145408 [2,0,0,0,0,0|1,0,0]=3 45 B8R0.28 CC(=O)OCC=C(C)C HR128839 [2,0,0,0,0,0|0,0,2]=4 46 B8R0.28 CC(C)CCOC(=O)Cl HR143844 [2,0,0,0,0,0|1,0,0]=3 47 B8R0.4 CCCCCCCCC HR133812 [2,0,0,0,0,0|1,0,1]=4 48 B8R0.4 CCCCNCCCC HR147605 [2,0,0,0,0,0|1,0,1]=4 49 B8R0.4 CCCCOCCCN HR134450 [2,0,0,0,0,0|1,0,1]=4 50 B8R0.4 CCCCSCCCC HR138897 [2,0,0,0,0,0|0,1,1]=4 51 B8R0.4 CCCC[SnH4+2]CCCC HR126830 [2,0,0,0,0,0|1,0,1]=4 52 B8R0.4 CCCC[SnH4+2]CCCC HR135636 [2,0,0,0,0,0|1,0,1]=4 53 B8R0.4 CCC\C=C\CCCC HR142398 [2,0,0,0,0,0|1,0,0]=3 54 B8R0.1 CCCC(=O)OCSC HR128277 [2,0,0,0,0,0|1,0,0]=3 55 B8R0.1 CCCCC(Br)CCC HR120549 [2,0,0,0,0,0|1,0,1]=4 56 B8R0.1 CCCOC(=O)CCS HR117505 [2,0,0,0,0,0|1,0,0]=3 57 B8R0.1 CCOC(=O)CCCBr HR133499 [2,0,0,0,0,0|2,0,0]=4 58 B8R0.1 CCOC(=O)CCCN HR142861 [2,0,0,0,0,0|2,0,0]=4 59 B8R0.1 CCOC(=O)CCC[Zn+] HR140860 [2,0,0,0,0,0|2,0,0]=4 60 B8R0.1 C\C=C\C(=O)CCCC HR108746 [2,0,0,0,0,0|0,0,2]=4 61 B10R0.98 CC(C)CCOC(=O)C(C)C HR137707 [1,1,0,0,0,0|0,0,0]=2 62 B10R0.98 CC(C)CCOC(=O)C(C)O HR104630 [1,1,0,0,0,0|0,0,0]=2 63 B10R0.4 CC(C)CCCCCCCO HR105072 [1,1,0,0,0,0|1,0,1]=4 64 B10R0.4 CC(C)CCCCCCCO HR120527 [1,1,0,0,0,0|1,0,1]=4 65 B10R0.4 CCCCCCCCC(C)C HR147297 [1,1,0,0,0,0|1,0,1]=4 66 B10R0.6 CCCCOC(=O)CC(C)C HR122128 [1,1,0,0,0,0|0,0,2]=4 67 B10R0.1 CCCCCCC(=O)OCC HR126759 [1,1,0,0,0,0|2,0,0]=4 68 B10R0.1 CCOC(=O)CCCCCBr HR132204 [1,1,0,0,0,0|2,0,0]=4 69 B10R0.1 CCOCCOC(=O)CC#N HR145103 [1,1,0,0,0,0|1,0,1]=4 70 B10R0.2 CCCC(O)CC(=O)OCC HR135411 [1,1,0,0,0,0|2,0,0]=4 71 B10R0.19 CCCCC(=O)C(=O)OCC HR137991 [1,1,0,0,0,0|2,0,0]=4 72 B10R0.19 CCCCC(Br)C(=O)OCC HR132160 [1,1,0,0,0,0|2,0,0]=4 73 B10R0.83 CCCCOC(=O)C(C)CC HR129373 [1,1,0,0,0,0|0,0,0]=2 74 B10R0.91 CCCCOC(=O)CCCC HR144017 [1,1,0,0,0,0|0,0,0]=2 75 B10R0.26 CCOC(=O)CC(=O)C(C)C HR136440 [0,1,0,0,1,0|1,0,1]=4 76 B10R0.32 CCOC(=O)C(=O)CC(C)C HR112965 [0,1,0,0,1,0|1,0,1]=4 77 B10R0.32 CCOC(=O)C(N)CC(C)C HR130607 [0,1,0,0,1,0|1,0,0]=3 78 B10R0.32 CCOC(=O)C(N)CC(C)C HR140458 [0,1,0,0,1,0|1,0,0]=3 79 B10R0.96 CC(=O)CC(=O)OCC(C)C HR136696 [0,1,0,0,1,0|0,0,1]=3 80 B10R0.96 CC(C)COC(=O)CC(C)C HR123848 [0,1,0,0,1,0|0,0,0]=2 81 B10R0.109 CCCC(=O)OCC(F)(F)F HR140951 [0,1,0,0,1,0|2,0,0]=4 82 B12R0.95 C=CCOC(=O)COCCC(C)C HR135373 [0,1,0,0,0,1|0,0,2]=4 83 B12R0.95 CCCOC(=O)NCCCN(C)C HR102472 [0,1,0,0,0,1|2,0,0]=4 84 B12R0.95 CCCOC(=O)NCCCN(C)C HR135311 [0,1,0,0,0,1|2,0,0]=4 85 B12R0.233 CCCCCC(=O)OCCC(C)C HR138847 [0,2,0,0,0,0|0,0,0]=2 86 B12R0.285 CCCC(=O)OCCC(S)CCC HR105867 [0,2,0,0,0,0|1,0,0]=3 87 B10R1.13 CC(C)C1CCC(=O)CC1 HR139660 [1,0,0,1,0,0|1,0,0]=3 88 B10R1.13 CC(C)N1CCC(=O)CC1 HR132734 [1,0,0,1,0,0|2,0,0]=4 89 B10R1.13 CN(C)C1CCC(=O)CC1 HR112667 [1,0,0,1,0,0|2,0,0]=4 90 B10R1.18 CC(C)CC1CNCCO1 HR145922 [1,0,0,1,0,0|1,0,1]=4 91 B10R1.18 CC(C)CC1CNCCO1 HR145967 [1,0,0,1,0,0|1,0,1]=4 92 B10R1.18 CC(C)CC1CNCCO1 HR145968 [1,0,0,1,0,0|1,0,1]=4 93 B10R1.29 CCCCN1CCCC1=O HR130366 [1,0,0,1,0,0|1,0,0]=3 94 B10R1.29 COCCN1CCCC1=O HR103009 [1,0,0,1,0,0|2,0,0]=4 95 B10R1.29 NCCCN1CCCC1=O HR142285 [1,0,0,1,0,0|2,0,0]=4 96 B10R1.29 O=C1CCCN1CCCO HR103322 [1,0,0,1,0,0|2,0,0]=4 97 B10R1.138 CCCC(=O)OCC1CO1 AMSA01602 [1,0,0,1,0,0|1,0,0]=3 98 B10R1.138 CCCC(=O)OCC1CO1 HR129751 [1,0,0,1,0,0|1,0,0]=3 99 B10R1.138 CCCC(=O)OCC1CO1 HR137955 [1,0,0,1,0,0|1,0,0]=3 100 B10R1.138 CCCC(=O)OCC1CO1 HR5780 [1,0,0,1,0,0|1,0,0]=3 101 B10R1.138 CCCC(=O)OCC1CO1 MRXF01107 [1,0,0,1,0,0|1,0,0]=3 102 B10R1.113 CC(C)N1CCCC(=O)C1 HR108552 [0,0,0,1,1,0|1,0,0]=3 103 B12R1.17 CCOC(=O)C1CC(C)CCN1 HR120337 [0,0,0,1,0,1|2,0,0]=4 104 B8R0.9 CCC(=O)CCC(C)=O HR121178 [1,0,0,0,1,0|1,0,1]=4 105 B8R0.9 COC(=O)CCC(C)O HR125584 [1,0,0,0,1,0|2,0,0]=4 106 B8R0.5 CC(C)OC(=O)CC#N HR136578 [0,0,0,0,2,0|1,0,1]=4 107 B8R0.5 CC(C)OC(=O)CCS HR117191 [0,0,0,0,2,0|1,0,0]=3 108 B8R0.5 CC(C)OC(=O)OCCl HR138445 [0,0,0,0,2,0|2,0,0]=4 109 B8R0.5 CCNC(=S)OC(C)C HR109488 [0,0,0,0,2,0|1,1,0]=4 110 B8R0.5 CCOC(=O)CC(C)O HR103958 [0,0,0,0,2,0|2,0,0]=4 111 B8R0.5 CCOC(=O)CC(C)O HR115663 [0,0,0,0,2,0|2,0,0]=4 112 B8R0.5 CCOC(=O)CC(C)O HR126277 [0,0,0,0,2,0|2,0,0]=4 113 B8R0.5 CCOC(=O)CC(C)S HR114517 [0,0,0,0,2,0|2,0,0]=4 114 B8R0.5 CCOC(=O)CN(C)C HR135000 [0,0,0,0,2,0|2,0,0]=4 115 B8R0.5 CCOC(=O)OC(C)Cl HR127687 [0,0,0,0,2,0|2,0,0]=4 116 B8R0.5 CCOC(=O)OC(C)I HR138111 [0,0,0,0,2,0|2,0,0]=4