0 B8R1.2 OCC1CCC=CO1 HY-34692 [0,0,0,0,0,0|0,0,2]=2 1 B8R1.2 OCC1CCCCO1 HY-115051 [0,0,0,0,0,0|0,0,0]=0 2 B8R1.2 OCC1CCOCC1 HY-79631 [0,0,0,0,0,0|2,0,0]=2 3 B7R1.3 BrC1CCOCC1 HY-W003396 [1,0,0,0,0,0|3,0,0]=4 4 B7R1.3 CC1CCOCO1 HY-W111914 [1,0,0,0,0,0|1,0,0]=2 5 B7R1.3 C[C@@H]1CNCCN1 HY-34767 [1,0,0,0,0,0|2,0,0]=3 6 B7R1.3 O=C1CCCCN1 HY-W042193 [1,0,0,0,0,0|1,0,2]=4 7 B7R1.3 O=C1CCCCO1 HY-W012997 [1,0,0,0,0,0|0,0,2]=3 8 B7R1.3 OC1CCCCC1 HY-Y1217 [1,0,0,0,0,0|1,0,0]=2 9 B9R1.6 O=C(O)C1CCCCC1 HY-Y1373 [0,1,0,0,0,0|1,0,1]=3 10 B9R1.6 O=C(O)C1CCCCN1 HY-Y0669R [0,1,0,0,0,0|1,0,1]=3 11 B9R1.6 O=C(O)C1CCCNC1 HY-69359 [0,1,0,0,0,0|2,0,1]=4 12 B9R1.6 O=C(O)C1CCNCC1 HY-Y1176 [0,1,0,0,0,0|2,0,1]=4 13 B9R1.6 O=C(O)C1CCOCC1 HY-W002155 [0,1,0,0,0,0|2,0,1]=4 14 B9R1.6 O=C(O)[C@H]1CCCCN1 HY-Y0181 [0,1,0,0,0,0|1,0,1]=3 15 B9R1.6 [C@@H]1(C(=O)O)CCCCN1 HY-W012734 [0,1,0,0,0,0|1,0,1]=3 16 B9R1.6 [C@H]1(C(=O)O)CCCNC1 HY-W012735 [0,1,0,0,0,0|2,0,1]=4 17 B9R1.8 OCCN1CCCCC1 HY-W012728 [0,1,0,0,0,0|2,0,0]=3 18 B9R1.8 OCCN1CCNCC1 HY-41939 [0,1,0,0,0,0|3,0,0]=4 19 B7R0.1 C#CCCCCCBr HY-W459522 [0,0,1,0,0,0|2,0,1]=4 20 B7R0.1 CCCCCCCO HY-W099504 [0,0,1,0,0,0|1,0,0]=2 21 B7R0.1 CCCSSCCC HY-W196803 [0,0,1,0,0,0|2,1,0]=4 22 B7R0.1 COCCOCCN HY-140675 [0,0,1,0,0,0|2,0,0]=3 23 B7R0.1 COCCOCCN HY-140676 [0,0,1,0,0,0|2,0,0]=3 24 B7R0.1 COCCOCCN HY-140677 [0,0,1,0,0,0|2,0,0]=3 25 B7R0.1 COCCOCCN HY-140678 [0,0,1,0,0,0|2,0,0]=3 26 B7R0.1 COCCOCCN HY-140679 [0,0,1,0,0,0|2,0,0]=3 27 B7R0.1 COCCOCCN HY-155881 [0,0,1,0,0,0|2,0,0]=3 28 B7R0.1 COCCOCCN HY-155882 [0,0,1,0,0,0|2,0,0]=3 29 B7R0.1 COCCOCCN HY-W008429 [0,0,1,0,0,0|2,0,0]=3 30 B7R0.1 COCCOCCN HY-W598230A [0,0,1,0,0,0|2,0,0]=3 31 B7R0.1 COCCOCCO HY-140696 [0,0,1,0,0,0|1,0,0]=2 32 B7R0.1 COCCOCCO HY-140696B [0,0,1,0,0,0|1,0,0]=2 33 B7R0.1 COCCOCCO HY-140696D [0,0,1,0,0,0|1,0,0]=2 34 B7R0.1 COCCOCCO HY-140696E [0,0,1,0,0,0|1,0,0]=2 35 B7R0.1 COCCOCCO HY-W012862 [0,0,1,0,0,0|1,0,0]=2 36 B7R0.1 COCCOCCS HY-140706 [0,0,1,0,0,0|1,1,0]=3 37 B7R0.1 COCCOCCS HY-140708 [0,0,1,0,0,0|1,1,0]=3 38 B7R0.1 COCCOCCS HY-W591476 [0,0,1,0,0,0|1,1,0]=3 39 B7R0.1 COCCOCCS HY-W591476B [0,0,1,0,0,0|1,1,0]=3 40 B7R0.1 COCCOCCS HY-W591476C [0,0,1,0,0,0|1,1,0]=3 41 B7R0.1 ClCCCCCCBr HY-W009787 [0,0,1,0,0,0|2,0,0]=3 42 B7R0.1 NCCCCCCO HY-W007957 [0,0,1,0,0,0|1,0,0]=2 43 B7R0.1 NCCCNCCS HY-103640 [0,0,1,0,0,0|2,1,0]=4 44 B7R0.1 NCCCNCCS HY-137864 [0,0,1,0,0,0|2,1,0]=4 45 B7R0.1 NCCOCCON HY-W451406A [0,0,1,0,0,0|3,0,0]=4 46 B7R0.1 NCCOCCON HY-W451406C [0,0,1,0,0,0|3,0,0]=4 47 B7R0.1 NOCCOCCO HY-126951 [0,0,1,0,0,0|2,0,0]=3 48 B7R0.1 OCCCCCCBr HY-W016455 [0,0,1,0,0,0|1,0,0]=2 49 B7R0.1 OCCCCCCCl HY-41681 [0,0,1,0,0,0|1,0,0]=2 50 B7R0.1 OCCCCCCO HY-W010505 [0,0,1,0,0,0|0,0,0]=1 51 B7R0.1 OCCSSCCO HY-W076898A [0,0,1,0,0,0|2,0,0]=3 52 B7R1.1 NC[C@@H]1CCCO1 HY-W010600 [0,0,0,0,1,0|1,0,0]=2 53 B7R1.1 OC[C@@H]1CCCN1 HY-Y1126 [0,0,0,0,1,0|1,0,0]=2 54 B7R1.1 OC[C@@H]1CCNC1 HY-60263 [0,0,0,0,1,0|1,0,0]=2 55 B6R0.6 BrCCOCCBr HY-W013458 [1,0,1,0,0,0|2,0,0]=4 56 B6R0.6 C#CCOCCO HY-43614 [1,0,1,0,0,0|0,0,2]=4 57 B6R0.6 C(CO)=CCCC HY-W015936 [1,0,1,0,0,0|0,0,2]=4 58 B6R0.6 C=CCCCCO HY-W012995 [1,0,1,0,0,0|0,0,2]=4 59 B6R0.6 CCCCCCO HY-W032022 [1,0,1,0,0,0|0,0,0]=2 60 B6R0.6 CC\C=C/CCO HY-W010607 [1,0,1,0,0,0|0,0,2]=4 61 B6R0.6 NCCCCCN HY-W016750 [1,0,1,0,0,0|2,0,0]=4 62 B6R0.6 NCCCCCO HY-W012971 [1,0,1,0,0,0|1,0,0]=3 63 B6R0.6 NCCOCCN HY-140208 [1,0,1,0,0,0|2,0,0]=4 64 B6R0.6 NCCOCCN HY-140648 [1,0,1,0,0,0|2,0,0]=4 65 B6R0.6 OCCOCCBr HY-141213 [1,0,1,0,0,0|1,0,0]=3 66 B6R0.6 OCCOCCO HY-B1952 [1,0,1,0,0,0|1,0,0]=3 67 B6R0.6 SCCOCCS HY-145485 [1,0,1,0,0,0|1,1,0]=4 68 B6R0.4 CC(C)CCCO HY-W007511 [1,0,1,0,0,0|2,0,0]=4 69 B6R0.4 CCCCB(O)O HY-W000932 [1,0,1,0,0,0|1,0,0]=3 70 B6R1.1 C1CSCCN1 HY-W007359 [2,0,0,0,0,0|1,1,0]=4 71 B6R1.1 C1CSCSC1 HY-W001189 [2,0,0,0,0,0|1,1,0]=4 72 B8R0.4 C#CCCCCCCO HY-W008554 [0,1,1,0,0,0|1,0,0]=3 73 B8R0.4 C=CCCCCCCO HY-W127366 [0,1,1,0,0,0|1,0,0]=3 74 B8R0.4 CCCCCCCC=O HY-N8015 [0,1,1,0,0,0|1,0,1]=4 75 B8R0.4 CCCCCCCCBr HY-W032015 [0,1,1,0,0,0|2,0,0]=4 76 B8R0.4 CCCCCCCCN HY-W032014 [0,1,1,0,0,0|2,0,0]=4 77 B8R0.4 CCCCCCCCO HY-W032013 [0,1,1,0,0,0|1,0,0]=3 78 B8R0.4 CCCCSCCCC HY-W250123 [0,1,1,0,0,0|1,1,0]=4 79 B8R0.4 CC\C=C/CCCCO HY-W101301 [0,1,1,0,0,0|1,0,1]=4 80 B8R0.4 COCCOCCC=O HY-W1049075C [0,1,1,0,0,0|1,0,1]=4 81 B8R0.4 NCCCCCCCN HY-W008821 [0,1,1,0,0,0|2,0,0]=4 82 B8R0.4 OCCCCCCCBr HY-W008425 [0,1,1,0,0,0|1,0,0]=3 83 B8R0.4 [N-]=[N+]=NCCOCCO HY-140797 [0,1,1,0,0,0|2,0,0]=4 84 B8R0.6 CCCCCC(O)CC HY-W099689 [0,1,1,0,0,0|2,0,0]=4 85 B8R0.7 COCCOCC(=O)O HY-W1048558A [0,1,1,0,0,0|1,0,1]=4 86 B8R0.7 O=C(O)CCOCCO HY-116655 [0,1,1,0,0,0|1,0,1]=4 87 B8R0.3 O=CC[C@H](O)[C@H](O)CO HY-77956 [0,1,1,0,0,0|1,0,1]=4 88 B8R0.8 CCCCC(C)C(=O)O HY-128371 [0,1,1,0,0,0|1,0,1]=4 89 B8R0.8 CCCCC(N)C(=O)O HY-W012709 [0,1,1,0,0,0|1,0,1]=4 90 B8R0.8 CCCCC(O)C(=O)O HY-75954 [0,1,1,0,0,0|0,0,1]=3 91 B8R0.8 CCCC[C@@H](N)C(=O)O HY-41912A [0,1,1,0,0,0|1,0,1]=4 92 B8R0.8 CCCC[C@H](N)C(=O)O HY-Y0017 [0,1,1,0,0,0|1,0,1]=4 93 B8R0.8 CSCCC(O)C(=O)O HY-116688 [0,1,1,0,0,0|1,0,1]=4 94 B8R1.3 CN1CCC(O)CC1 HY-W018626 [1,1,0,0,0,0|2,0,0]=4 95 B8R1.3 C[C@H]1CC[C@H](N)CC1 HY-W010538 [1,1,0,0,0,0|1,0,0]=3 96 B8R1.3 NC1CCC(N)CC1 HY-W007732B [1,1,0,0,0,0|2,0,0]=4 97 B8R1.3 N[C@H]1CC[C@H](O)CC1 HY-79722 [1,1,0,0,0,0|1,0,0]=3 98 B8R1.3 OC1COC(O)CO1 HY-W004661 [1,1,0,0,0,0|1,0,0]=3 99 B8R1.4 CC1CCCC(C)N1 HY-B1191 [1,1,0,0,0,0|1,0,0]=3 100 B8R1.5 CC1CCCCC1=O HY-W010549 [1,1,0,0,0,0|1,0,0]=3 101 B8R1.5 N[C@@H]1CCCC[C@H]1N HY-41957 [1,1,0,0,0,0|2,0,0]=4 102 B8R1.5 O[C@@H]1CCCC[C@H]1O HY-W010514 [1,1,0,0,0,0|1,0,0]=3 103 B8R1.72 C[N+]1(C)CCCCC1 HY-W017448 [1,1,0,0,0,0|2,0,0]=4 104 B8R1.1 CCC1CCC(=O)O1 HY-W015892 [0,1,0,0,1,0|1,0,1]=4 105 B8R1.7 O=C(O)C1CCCN1 HY-W012908 [0,1,0,0,1,0|1,0,1]=4 106 B8R1.7 O=C(O)[C@@H]1CCCN1 HY-WAA0253 [0,1,0,0,1,0|1,0,1]=4 107 B8R1.7 O=C(O)[C@@H]1CCCN1 HY-Y0252 [0,1,0,0,1,0|1,0,1]=4 108 B8R1.7 O=C(O)[C@@H]1CCCN1 HY-Y0252R [0,1,0,0,1,0|1,0,1]=4 109 B8R1.7 O=C(O)[C@@H]1CCNC1 HY-60256 [0,1,0,0,1,0|1,0,1]=4 110 B8R1.7 O=C(O)[C@H]1CCCN1 HY-75087 [0,1,0,0,1,0|1,0,1]=4 111 B8R1.7 O=C(O)[C@H]1CCCO1 HY-W005223 [0,1,0,0,1,0|0,0,1]=3 112 B8R1.7 OB(O)C1CCCC1 HY-W000955 [0,1,0,0,1,0|1,0,0]=3 113 B8R1.8 OCCN1CCCC1 HY-W010519 [0,1,0,0,1,0|1,0,0]=3 114 B8R1.11 CN1CCC[C@H]1CO HY-W019679 [0,1,0,0,1,0|1,0,0]=3 115 B8R1.52 CC[N+]1(C)CCCC1 HY-W127700 [0,1,0,0,1,0|2,0,0]=4 116 B10R1.3 BrC[C@H]1CC[C@H](CBr)CC1 HY-47683 [0,2,0,0,0,0|2,0,0]=4 117 B10R1.13 O=C(O)C1CCC(O)CC1 HY-W015675 [0,2,0,0,0,0|1,0,1]=4 118 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CC1 HY-76199 [0,2,0,0,0,0|1,0,1]=4 119 B10R1.2 OC[C@H]1OC=C[C@@H](O)[C@@H]1O HY-W142618 [0,2,0,0,0,0|0,0,2]=4 120 B10R1.2 OC[C@H]1OC=C[C@@H](O)[C@H]1O HY-W047710 [0,2,0,0,0,0|0,0,2]=4 121 B10R1.15 CCC(=O)C1CCCCC1 HY-W026029 [0,2,0,0,0,0|2,0,0]=4 122 B10R1.15 COC(=O)C1CCCCC1 HY-W007704 [0,2,0,0,0,0|1,0,1]=4 123 B10R1.61 O=C(O)C1CCCCN1O HY-N7378 [0,2,0,0,0,0|1,0,1]=4 124 B10R1.17 BrCCOC1CCCCC1 HY-W092895 [0,2,0,0,0,0|2,0,0]=4 125 B10R1.17 OCCOC1CCCCO1 HY-W038771 [0,2,0,0,0,0|0,0,0]=2 126 B10R1.18 O=C(O)CC1CCCCC1 HY-W018653 [0,2,0,0,0,0|1,0,0]=3 127 B10R1.487 N#CC1(CO)CCOCC1 HY-X0017 [0,2,0,0,0,0|2,0,0]=4 128 B8R1.22 O=C1CCCCCO1 HY-W015891 [0,0,1,1,0,0|0,0,2]=4 129 B8R1.22 O=C1CCCCCO1 HY-W392100B [0,0,1,1,0,0|0,0,2]=4 130 B10R2.71 OC1CC2CCC(C1)N2 HY-W018601 [0,1,0,1,0,0|2,0,0]=4 131 B10R2.71 [C@H]12CC[C@H](C[C@H](O)C1)N2 HY-W066915 [0,1,0,1,0,0|2,0,0]=4 132 B10R2.7 C1CCC2CNCC2C1 HY-W017933 [0,1,0,1,0,0|2,0,0]=4 133 B6R1.2 CN1CCCC1 HY-128383 [1,0,0,0,1,0|1,0,0]=3 134 B6R1.2 F[C@@H]1CCNC1 HY-40421 [1,0,0,0,1,0|2,0,0]=4 135 B6R1.2 O[C@H]1CCOC1 HY-76476 [1,0,0,0,1,0|1,0,0]=3 136 B6R1.6 OCC1CNC1 HY-21336 [0,0,0,0,2,0|1,0,0]=3 137 B6R1.6 OCC1COC1 HY-W004925 [0,0,0,0,2,0|1,0,0]=3