0 B4R0.2 BrCCCBr HY-Y1806 [0,0,0,0,0,0|4,0,0]=4 1 B4R0.2 C#CCCO HY-W001947 [0,0,0,0,0,0|3,0,1]=4 2 B4R0.2 C=CCCN HY-W019321 [0,0,0,0,0,0|3,0,1]=4 3 B4R0.2 C=CCSC HY-128447 [0,0,0,0,0,0|1,0,1]=2 4 B4R0.2 CNCCO HY-Y1783 [0,0,0,0,0,0|3,0,0]=3 5 B4R0.2 COCCO HY-139415 [0,0,0,0,0,0|2,1,0]=3 6 B4R0.2 CSSSC HY-128454 [0,0,0,0,0,0|1,0,0]=1 7 B4R0.2 NCCCO HY-Y0139 [0,0,0,0,0,0|4,0,0]=4 8 B4R0.2 O=CCCO HY-N8461 [0,0,0,0,0,0|4,0,0]=4 9 B4R0.2 OCCCBr HY-W007337 [0,0,0,0,0,0|4,0,0]=4 10 B4R0.2 OCCCO HY-W017758 [0,0,0,0,0,0|4,0,0]=4 11 B4R0.2 OCCCS HY-W090210 [0,0,0,0,0,0|4,0,0]=4 12 B3R0.1 CNNC HY-W460407 [1,0,0,0,0,0|2,0,0]=3 13 B3R0.1 CNOC HY-41074 [1,0,0,0,0,0|1,1,0]=3 14 B3R0.1 N#CS[Na] HY-23119 [1,0,0,0,0,0|2,0,1]=4 15 B3R0.1 NCCO HY-W035903 [1,0,0,0,0,0|2,1,0]=4 16 B3R0.1 NCCS HY-77591 [1,0,0,0,0,0|2,0,0]=3 17 B3R0.1 O=[13CH]CO HY-146995S [1,0,0,0,0,0|2,1,0]=4 18 B3R0.1 OCCO HY-Y0338 [1,0,0,0,0,0|2,1,0]=4 19 B3R0.1 OCCO HY-Y0873A [1,0,0,0,0,0|2,1,0]=4 20 B3R0.1 OCCO HY-Y0873A1 [1,0,0,0,0,0|2,1,0]=4 21 B3R0.1 OCCO HY-Y0873B [1,0,0,0,0,0|2,1,0]=4 22 B3R0.1 OCCO HY-Y0873C [1,0,0,0,0,0|2,1,0]=4 23 B3R0.1 OCCO HY-Y0873E [1,0,0,0,0,0|2,1,0]=4 24 B3R0.1 OCCO HY-Y0873F [1,0,0,0,0,0|2,1,0]=4 25 B3R0.1 OCCO HY-Y0873G [1,0,0,0,0,0|2,1,0]=4 26 B3R0.1 OCCO HY-Y0873H [1,0,0,0,0,0|2,1,0]=4 27 B3R0.1 OCCO HY-Y0873I [1,0,0,0,0,0|2,1,0]=4 28 B3R0.1 OCCO HY-Y0873J [1,0,0,0,0,0|2,1,0]=4 29 B3R0.1 OCCO HY-Y0873K [1,0,0,0,0,0|2,1,0]=4 30 B3R0.1 OCCO HY-Y0873L [1,0,0,0,0,0|2,1,0]=4 31 B3R0.1 OCCO HY-Y0873M [1,0,0,0,0,0|2,1,0]=4 32 B3R0.1 OCCO HY-Y0873N [1,0,0,0,0,0|2,1,0]=4 33 B3R0.1 OCCO HY-Y0873O [1,0,0,0,0,0|2,1,0]=4 34 B3R0.1 OCCO HY-Y0873P [1,0,0,0,0,0|2,1,0]=4 35 B3R0.1 OCCO HY-Y0873Q [1,0,0,0,0,0|2,1,0]=4 36 B5R0.1 CC(=O)CCO HY-W051287 [0,1,0,0,0,0|3,0,0]=4 37 B5R0.1 CC(N)CC#N HY-W018936 [0,1,0,0,0,0|3,0,0]=4 38 B5R0.1 CC(O)CCO HY-77490A [0,1,0,0,0,0|3,0,0]=4 39 B5R0.1 CCCB(O)O HY-W007470 [0,1,0,0,0,0|3,0,0]=4 40 B5R0.1 CCCC(N)=O HY-W088319 [0,1,0,0,0,0|3,0,0]=4 41 B5R0.1 CN(C)CC=O HY-100061A [0,1,0,0,0,0|3,0,0]=4 42 B5R0.1 CNCC(=O)O HY-101037 [0,1,0,0,0,0|3,0,0]=4 43 B5R0.1 CNCC(=O)O HY-101037R [0,1,0,0,0,0|3,0,0]=4 44 B5R0.1 COCC(=O)O HY-Y1009 [0,1,0,0,0,0|2,1,0]=4 45 B5R0.1 C[C@@H](O)CCO HY-77490 [0,1,0,0,0,0|3,0,0]=4 46 B5R0.2 C#CCCCO HY-W010642 [0,1,0,0,0,0|2,0,1]=4 47 B5R0.2 CCCSSC HY-N7436 [0,1,0,0,0,0|1,0,0]=2 48 B5R0.2 CCSCCCl HY-W199190 [0,1,0,0,0,0|2,0,0]=3 49 B5R0.2 CC\C=C/CO HY-W030347 [0,1,0,0,0,0|2,0,1]=4 50 B5R0.2 NCCCCO HY-W002041 [0,1,0,0,0,0|3,0,0]=4 51 B5R0.3 CCC(C)C=O HY-W020678 [0,1,0,0,0,0|3,0,0]=4 52 B5R0.3 CNC(=S)NC HY-W027951 [0,1,0,0,0,0|2,0,1]=4 53 B5R1.2 FC1CNC1 HY-W001606 [0,0,0,1,0,0|3,0,0]=4 54 B5R1.2 IC1COC1 HY-W016306 [0,0,0,1,0,0|2,1,0]=4 55 B5R1.2 O=C1COC1 HY-76440 [0,0,0,1,0,0|2,1,0]=4 56 B5R1.2 OC1CCC1 HY-W013042 [0,0,0,1,0,0|3,0,0]=4 57 B5R1.2 OC1CNC1 HY-40144 [0,0,0,1,0,0|3,0,0]=4 58 B5R1.3 BrCC1CC1 HY-Y1100 [0,0,0,1,0,0|3,0,0]=4 59 B5R1.3 OCC1CO1 HY-Y1010 [0,0,0,1,0,0|2,1,0]=4 60 B2R0.1 CON HY-Y0958 [2,0,0,0,0,0|1,1,0]=4 61 B2R0.1 C[Cu]C HY-Y1102A [2,0,0,0,0,0|1,0,0]=3 62 B2R0.1 C[Pd]C HY-W002072 [2,0,0,0,0,0|1,0,0]=3 63 B2R0.1 C[Zn]C HY-B1817 [2,0,0,0,0,0|1,0,0]=3 64 B2R0.1 C[Zn]C HY-B1817A [2,0,0,0,0,0|1,0,0]=3 65 B4R0.1 CC(=O)CO HY-Y1366 [1,1,0,0,0,0|1,1,0]=4 66 B4R0.1 CC(O)CN HY-W015969 [1,1,0,0,0,0|2,0,0]=4 67 B4R0.1 CC(O)CO HY-Y0921 [1,1,0,0,0,0|1,1,0]=4 68 B4R0.1 CC[C@@H](C)O HY-W087952 [1,1,0,0,0,0|1,0,0]=3 69 B4R0.1 C[C@@H](N)CO HY-W010646 [1,1,0,0,0,0|1,1,0]=4 70 B4R0.1 C[C@@H](O)CN HY-W002295 [1,1,0,0,0,0|2,0,0]=4 71 B4R0.1 C[C@@H](O)CO HY-Z0031 [1,1,0,0,0,0|1,1,0]=4 72 B6R0.2 CC(N)CN(C)C HY-32007 [0,2,0,0,0,0|2,0,0]=4 73 B6R0.2 CC(N)CN(C)C HY-32007A [0,2,0,0,0,0|2,0,0]=4 74 B6R0.4 CC(C)CCCO HY-W007511 [0,2,0,0,0,0|2,0,0]=4 75 B6R0.4 CN(C)CCCCl HY-W018789 [0,2,0,0,0,0|2,0,0]=4 76 B6R0.4 CSCCC(=O)O HY-101401 [0,2,0,0,0,0|1,0,1]=4 77 B6R0.5 CCC[N+](C)(C)C HY-W099930 [0,2,0,0,0,0|2,0,0]=4 78 B6R0.6 C(CO)=CCCC HY-W015936 [0,2,0,0,0,0|2,0,0]=4 79 B6R0.6 C=CCSSSC HY-134900 [0,2,0,0,0,0|1,0,0]=3 80 B6R0.6 CCCCCCO HY-W032022 [0,2,0,0,0,0|2,0,0]=4 81 B6R0.6 NCCCCCN HY-W016750 [0,2,0,0,0,0|2,0,0]=4 82 B6R0.6 NCCCCCO HY-W012971 [0,2,0,0,0,0|2,0,0]=4 83 B4R1.1 C1CNC1 HY-W010628 [1,0,0,1,0,0|1,0,0]=3 84 B6R1.2 CN1CCCC1 HY-128383 [0,1,0,1,0,0|2,0,0]=4 85 B6R1.2 F[C@@H]1CCNC1 HY-40421 [0,1,0,1,0,0|2,0,0]=4 86 B6R1.2 N=C1CCCS1 HY-W015798 [0,1,0,1,0,0|1,0,1]=4 87 B6R1.2 O=C1CCOC1 HY-33900 [0,1,0,1,0,0|1,1,0]=4 88 B6R1.2 O=C1CCSC1 HY-W010594 [0,1,0,1,0,0|1,0,0]=3 89 B6R1.2 O[C@H]1CCOC1 HY-76476 [0,1,0,1,0,0|1,1,0]=4 90 B6R1.3 COC[C@H]1CO1 HY-Z1630 [0,1,0,1,0,0|0,2,0]=4 91 B6R1.10 CC1(O)CNC1 HY-59333 [0,1,0,1,0,0|2,0,0]=4 92 B6R1.1 C1CSCCN1 HY-W007359 [0,1,0,1,0,0|1,0,0]=3 93 B6R1.1 C1CSCSC1 HY-W001189 [0,1,0,1,0,0|0,0,0]=2 94 B6R1.6 OCC1CNC1 HY-21336 [0,1,0,1,0,0|2,0,0]=4 95 B6R1.6 OCC1COC1 HY-W004925 [0,1,0,1,0,0|1,1,0]=4