0 B7R0.4 CCCCCC(C)O SC-81258 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.4 CN(C)CCCCBr SC-48986 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.4 C=COCC(C)C SC-19102 [1,0,0,0,0,0|1,0,0]=2 3 B6R0.4 CC(Br)CCCBr SC-74609 [1,0,0,0,0,0|2,0,1]=4 4 B6R0.4 CC(C)=NNC=O SC-26098 [1,0,0,0,0,0|2,0,1]=4 5 B6R0.4 CC(C)CCCO SC-67391 [1,0,0,0,0,0|0,0,2]=3 6 B6R0.4 CC(C)OCCN SC-47370 [1,0,0,0,0,0|2,0,1]=4 7 B6R0.4 CCCNC(C)C SC-50047 [1,0,0,0,0,0|2,0,1]=4 8 B6R0.6 C=CCCCC=O SC-34117 [1,0,0,0,0,0|1,0,2]=4 9 B6R0.6 C=CCCCCN SC-34878 [1,0,0,0,0,0|3,0,0]=4 10 B6R0.6 C=CCCCCO SC-44461 [1,0,0,0,0,0|3,0,0]=4 11 B6R0.6 C=CCCCC[Zn+] SC-89392 [1,0,0,0,0,0|3,0,0]=4 12 B6R0.6 CCCCCCO SC-22734 [1,0,0,0,0,0|1,0,2]=4 13 B6R0.6 CCCCNCC SC-47234 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.6 CCOCCCN SC-74768 [1,0,0,0,0,0|2,0,1]=4 15 B6R0.6 COCCCC=O SC-88270 [1,0,0,0,0,0|2,0,0]=3 16 B6R0.6 O=C=NCCCCl SC-77667 [1,0,0,0,0,0|2,0,1]=4 17 B8R0.6 C=CCCC[C@@H](C)CO SC-31639 [0,1,0,0,0,0|2,0,0]=3 18 B8R0.6 C=CCCC[C@H](C)CO SC-31524 [0,1,0,0,0,0|2,0,0]=3 19 B8R0.7 CC(C)CCCCCBr SC-22592 [0,1,0,0,0,0|2,0,1]=4 20 B8R0.7 CC(C)CCCCCO SC-51101 [0,1,0,0,0,0|1,0,2]=4 21 B8R0.9 CC(C)CCC(=O)NN SC-59735 [0,1,0,0,0,0|3,0,0]=4 22 B8R0.9 CC(C)CCC(C)NN SC-39161 [0,1,0,0,0,0|3,0,0]=4 23 B8R0.9 CC(C)O\C=C(/Br)C=O SC-31946 [0,1,0,0,0,0|2,0,1]=4 24 B8R0.21 C=CCCC[Si](C)(C)C SC-34267 [0,1,0,0,0,0|2,1,0]=4 25 B8R0.28 C=C(C)CCCC(=O)O SC-31519 [0,1,0,0,0,0|1,0,2]=4 26 B8R0.28 CN(C)CCCC(=N)N SC-42054 [0,1,0,0,0,0|3,0,0]=4 27 B8R1.1 CC1CCC(NN)C1 SC-41314 [0,0,0,1,0,0|3,0,0]=4 28 B8R1.1 CC1CCC(NN)C1 SC-41791 [0,0,0,1,0,0|3,0,0]=4 29 B8R1.4 CC1CCCC(N)C1 SC-22240 [0,0,0,1,0,0|2,0,1]=4 30 B8R1.4 C[C@H]1CCCC(=O)N1 SC-51761 [0,0,0,1,0,0|2,0,0]=3 31 B8R1.19 CC1(C)CONC1=O SC-83064 [0,0,0,1,0,0|2,0,0]=3 32 B8R1.72 CC1(O)CCOCC1 SC-21971 [0,0,0,1,0,0|2,0,1]=4 33 B5R0.1 C=CCC(C)O SC-49226 [2,0,0,0,0,0|1,0,1]=4 34 B5R0.1 CC(Br)CCN SC-40141 [2,0,0,0,0,0|2,0,0]=4 35 B5R0.1 CC(N)CCN SC-66926 [2,0,0,0,0,0|2,0,0]=4 36 B5R0.1 COC[C@H](C)N SC-43750 [2,0,0,0,0,0|1,0,1]=4 37 B5R0.1 COC[C@H](C)N SC-51779 [2,0,0,0,0,0|1,0,1]=4 38 B5R0.2 C=COCCC SC-13613 [2,0,0,0,0,0|1,0,0]=3 39 B5R0.2 CCCCNN SC-40662 [2,0,0,0,0,0|2,0,0]=4 40 B5R0.2 CCCCNN SC-41028 [2,0,0,0,0,0|2,0,0]=4 41 B5R0.2 COCCCO SC-01427 [2,0,0,0,0,0|1,0,1]=4 42 B7R0.2 CC(C)CC(C)NN SC-38647 [1,1,0,0,0,0|2,0,0]=4 43 B7R0.3 C=CCCC(C)CC SC-69778 [1,1,0,0,0,0|1,0,0]=3 44 B7R0.3 C=CCCC(O)CN SC-34956 [1,1,0,0,0,0|2,0,0]=4 45 B7R0.6 CC(=O)CCN(C)C SC-53808 [1,1,0,0,0,0|1,0,0]=3 46 B7R0.6 CC(C)CCC(C)O SC-53086 [1,1,0,0,0,0|0,0,2]=4 47 B7R0.6 CN(C)CCC(=N)N SC-40941 [1,1,0,0,0,0|2,0,0]=4 48 B7R0.6 CN(C)CCC(=O)O SC-84792 [1,1,0,0,0,0|1,0,0]=3 49 B7R0.8 C=CCCC(C)(C)O SC-54598 [1,1,0,0,0,0|1,0,0]=3 50 B7R0.8 C=CCC[Si](C)(C)C SC-34310 [1,1,0,0,0,0|1,1,0]=4 51 B7R0.8 CC(C)(C)CN=C=O SC-52558 [1,1,0,0,0,0|1,0,1]=4 52 B9R0.48 CC(C)CCC(=O)OCCl SC-69819 [0,2,0,0,0,0|1,0,1]=4 53 B9R0.48 CCOC(=O)CCC(C)C SC-41649 [0,2,0,0,0,0|1,0,1]=4 54 B9R0.55 CN(C)CCNCC(=O)O SC-48750 [0,2,0,0,0,0|2,0,0]=4 55 B9R0.7 CC(=O)C(=O)OCC(C)C SC-26296 [0,2,0,0,0,0|2,0,0]=4 56 B9R0.7 CC(C)OC[C@H](N)C(=O)O SC-68757 [0,2,0,0,0,0|2,0,0]=4 57 B9R0.56 CC(=O)OCC[N+](C)(C)C SC-15132 [0,2,0,0,0,0|1,0,0]=3 58 B9R0.56 CC(C)(C)OCCC(=O)O SC-62531 [0,2,0,0,0,0|2,0,0]=4 59 B9R0.56 CC(F)(F)CCCC(=O)O SC-34273 [0,2,0,0,0,0|2,0,0]=4 60 B7R1.2 CC1CCC(=O)N1 SC-89347 [1,0,0,1,0,0|1,0,0]=3 61 B7R1.2 CC1CCC(N)C1 SC-50487 [1,0,0,1,0,0|1,0,1]=4 62 B7R1.2 CC1CNC(=O)N1 SC-65644 [1,0,0,1,0,0|2,0,0]=4 63 B7R1.2 CC1CNC(=O)N1 SC-67475 [1,0,0,1,0,0|2,0,0]=4 64 B7R1.2 CC1CSC(=O)S1 SC-51669 [1,0,0,1,0,0|1,1,0]=4 65 B7R1.2 C[C@@H]1CCC(=O)O1 SC-65777 [1,0,0,1,0,0|1,0,0]=3 66 B7R1.2 C[C@@H]1COC(=O)C1 SC-45465 [1,0,0,1,0,0|0,0,0]=2 67 B7R1.2 C[C@@H]1COC(=O)N1 SC-43641 [1,0,0,1,0,0|1,0,0]=3 68 B7R1.2 C[C@@H]1COC(=O)N1 SC-51055 [1,0,0,1,0,0|1,0,0]=3 69 B7R1.2 C[C@H]1CCC(=O)O1 SC-86851 [1,0,0,1,0,0|1,0,0]=3 70 B7R1.2 NC1CNC(=O)C1 SC-68325 [1,0,0,1,0,0|2,0,0]=4 71 B7R1.2 N[C@H]1CNC(=O)C1 SC-52716 [1,0,0,1,0,0|2,0,0]=4 72 B7R1.2 O=C1CCC(Cl)O1 SC-69818 [1,0,0,1,0,0|2,0,0]=4 73 B7R1.2 O=C1C[C@@H](O)CO1 SC-49425 [1,0,0,1,0,0|1,0,0]=3 74 B7R1.2 O=C1OCC(F)O1 SC-19199 [1,0,0,1,0,0|2,0,0]=4 75 B7R1.3 CN1CC=CCC1 SC-20668 [1,0,0,1,0,0|2,0,0]=4 76 B7R1.3 CN1CC=CCC1 SC-43820 [1,0,0,1,0,0|2,0,0]=4 77 B7R1.3 CN1CCOCC1 SC-47177 [1,0,0,1,0,0|1,0,1]=4 78 B7R1.5 CC1CC1CNN SC-60063 [1,0,0,1,0,0|2,0,0]=4 79 B7R1.4 CC1CCCC1=S SC-42934 [1,0,0,1,0,0|1,1,0]=4 80 B7R1.4 CC1OCCC1=O SC-03396 [1,0,0,1,0,0|2,0,0]=4 81 B7R1.4 NC1CCNC1=O SC-48795 [1,0,0,1,0,0|2,0,0]=4 82 B7R1.4 NC1CCNC1=O SC-51089 [1,0,0,1,0,0|2,0,0]=4 83 B7R1.4 N[C@H]1CCOC1=O SC-51606 [1,0,0,1,0,0|1,0,0]=3 84 B7R1.4 O=C1NCC[C@@H]1O SC-21960 [1,0,0,1,0,0|2,0,0]=4 85 B7R1.4 O=C1OCC[C@H]1O SC-08904 [1,0,0,1,0,0|1,0,0]=3 86 B9R1.38 CC1(C)CC(=O)NC1=O SC-70560 [0,1,0,1,0,0|1,0,1]=4 87 B9R1.38 CC1(C)CC(=O)OC1=O SC-45366 [0,1,0,1,0,0|0,0,1]=3 88 B9R1.41 CC(Cl)N1CCCC1=O SC-68545 [0,1,0,1,0,0|2,0,0]=4 89 B9R1.2 O=C1CCCC(CCl)C1 SC-33730 [0,1,0,1,0,0|1,0,0]=3 90 B9R1.2 O=C1CCCN(CCl)C1 SC-41654 [0,1,0,1,0,0|2,0,0]=4 91 B9R1.3 CC1=C(C)C(=O)CCC1 SC-68706 [0,1,0,1,0,0|1,0,1]=4 92 B9R1.89 OCC1CCC=CCC1 SC-60823 [0,1,0,1,0,0|2,0,0]=4 93 B9R1.40 CC1(Cl)CCCCC1=O SC-69954 [0,1,0,1,0,0|2,0,0]=4 94 B9R1.35 CC(=O)N1CC[C@@H](O)C1 SC-53670 [0,1,0,1,0,0|2,0,0]=4 95 B9R1.69 CC1NC(=O)CCC1O SC-50315 [0,1,0,1,0,0|2,0,0]=4 96 B9R1.138 CC1(C)CNC(=O)C1=O SC-51640 [0,1,0,1,0,0|2,0,0]=4 97 B9R2.21 O=C1CCC2CC2C1 SC-68751 [0,0,0,2,0,0|1,0,0]=3 98 B9R2.109 O=C1CCCC2CC12 SC-68708 [0,0,0,2,0,0|1,0,0]=3