0 B6R0.6 BrCCOCCBr HY-W013458 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.6 C#CCOCCN HY-116069 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.6 C#CCOCCO HY-43614 [0,0,0,0,0,0|2,0,1]=3 3 B6R0.6 C(CO)=CCCC HY-W015936 [0,0,0,0,0,0|1,0,2]=3 4 B6R0.6 C=CCCCCO HY-W012995 [0,0,0,0,0,0|1,0,1]=2 5 B6R0.6 C=CCSSSC HY-134900 [0,0,0,0,0,0|3,0,1]=4 6 B6R0.6 CCCCCCO HY-W032022 [0,0,0,0,0,0|1,0,0]=1 7 B6R0.6 CC\C=C/CCO HY-W010607 [0,0,0,0,0,0|1,0,2]=3 8 B6R0.6 C\C=C\C=C\CO HY-W017690 [0,0,0,0,0,0|1,0,3]=4 9 B6R0.6 ClCCNCCCl HY-Y0881 [0,0,0,0,0,0|4,0,0]=4 10 B6R0.6 NCCCCCN HY-W016750 [0,0,0,0,0,0|3,0,0]=3 11 B6R0.6 NCCCCCO HY-W012971 [0,0,0,0,0,0|2,0,0]=2 12 B6R0.6 NCCOCCN HY-140208 [0,0,0,0,0,0|4,0,0]=4 13 B6R0.6 NCCOCCN HY-140648 [0,0,0,0,0,0|4,0,0]=4 14 B6R0.6 OCCOCCBr HY-141213 [0,0,0,0,0,0|3,0,0]=3 15 B6R0.6 OCCOCCO HY-B1952 [0,0,0,0,0,0|3,0,0]=3 16 B6R0.6 SCCOCCS HY-145485 [0,0,0,0,0,0|3,1,0]=4 17 B6R0.6 [N-]=[N+]=NCCCN HY-151862 [0,0,0,0,0,0|4,0,0]=4 18 B5R0.2 C#CCCCO HY-W010642 [1,0,0,0,0,0|0,0,2]=3 19 B5R0.2 CCCSSC HY-N7436 [1,0,0,0,0,0|1,0,0]=2 20 B5R0.2 CCSCCCl HY-W199190 [1,0,0,0,0,0|2,0,0]=3 21 B5R0.2 CC\C=C/CO HY-W030347 [1,0,0,0,0,0|0,0,2]=3 22 B5R0.2 NCCCCO HY-W002041 [1,0,0,0,0,0|1,0,0]=2 23 B5R0.2 OC\C=C/CO HY-W027631 [1,0,0,0,0,0|0,1,2]=4 24 B5R0.2 [N-]=[N+]=NCCO HY-138461 [1,0,0,0,0,0|3,0,0]=4 25 B7R0.1 C#CCCCCCBr HY-W459522 [0,1,0,0,0,0|2,0,1]=4 26 B7R0.1 C#CCOCCON HY-140056 [0,1,0,0,0,0|2,0,1]=4 27 B7R0.1 CCCCCCCO HY-W099504 [0,1,0,0,0,0|1,0,0]=2 28 B7R0.1 CCCSSCCC HY-W196803 [0,1,0,0,0,0|3,0,0]=4 29 B7R0.1 COCCOCCN HY-140675 [0,1,0,0,0,0|1,1,0]=3 30 B7R0.1 COCCOCCN HY-140676 [0,1,0,0,0,0|1,1,0]=3 31 B7R0.1 COCCOCCN HY-140677 [0,1,0,0,0,0|1,1,0]=3 32 B7R0.1 COCCOCCN HY-140678 [0,1,0,0,0,0|1,1,0]=3 33 B7R0.1 COCCOCCN HY-140679 [0,1,0,0,0,0|1,1,0]=3 34 B7R0.1 COCCOCCN HY-155881 [0,1,0,0,0,0|1,1,0]=3 35 B7R0.1 COCCOCCN HY-155882 [0,1,0,0,0,0|1,1,0]=3 36 B7R0.1 COCCOCCN HY-W008429 [0,1,0,0,0,0|1,1,0]=3 37 B7R0.1 COCCOCCN HY-W598230A [0,1,0,0,0,0|1,1,0]=3 38 B7R0.1 COCCOCCO HY-140696 [0,1,0,0,0,0|0,1,0]=2 39 B7R0.1 COCCOCCO HY-140696B [0,1,0,0,0,0|0,1,0]=2 40 B7R0.1 COCCOCCO HY-140696D [0,1,0,0,0,0|0,1,0]=2 41 B7R0.1 COCCOCCO HY-140696E [0,1,0,0,0,0|0,1,0]=2 42 B7R0.1 COCCOCCO HY-W012862 [0,1,0,0,0,0|0,1,0]=2 43 B7R0.1 COCCOCCS HY-140706 [0,1,0,0,0,0|0,2,0]=3 44 B7R0.1 COCCOCCS HY-140708 [0,1,0,0,0,0|0,2,0]=3 45 B7R0.1 COCCOCCS HY-W591476 [0,1,0,0,0,0|0,2,0]=3 46 B7R0.1 COCCOCCS HY-W591476B [0,1,0,0,0,0|0,2,0]=3 47 B7R0.1 COCCOCCS HY-W591476C [0,1,0,0,0,0|0,2,0]=3 48 B7R0.1 CSCCCN=C=S HY-121204 [0,1,0,0,0,0|0,1,1]=3 49 B7R0.1 ClCCCCCCBr HY-W009787 [0,1,0,0,0,0|2,0,0]=3 50 B7R0.1 NCCCCCCO HY-W007957 [0,1,0,0,0,0|1,0,0]=2 51 B7R0.1 NCCCNCCS HY-103640 [0,1,0,0,0,0|2,1,0]=4 52 B7R0.1 NCCCNCCS HY-137864 [0,1,0,0,0,0|2,1,0]=4 53 B7R0.1 NCCOCCON HY-W451406A [0,1,0,0,0,0|2,1,0]=4 54 B7R0.1 NCCOCCON HY-W451406C [0,1,0,0,0,0|2,1,0]=4 55 B7R0.1 NOCCOCCO HY-126951 [0,1,0,0,0,0|1,1,0]=3 56 B7R0.1 OCCCCCCBr HY-W016455 [0,1,0,0,0,0|1,0,0]=2 57 B7R0.1 OCCCCCCCl HY-41681 [0,1,0,0,0,0|1,0,0]=2 58 B7R0.1 OCCCCCCO HY-W010505 [0,1,0,0,0,0|1,0,0]=2 59 B7R0.1 OCCSSCCO HY-W076898A [0,1,0,0,0,0|3,0,0]=4 60 B7R0.3 COC(=O)CCCBr HY-W004701 [0,1,0,0,0,0|1,1,1]=4 61 B7R0.3 COC(=O)CCCN HY-79594 [0,1,0,0,0,0|1,1,1]=4 62 B7R0.4 C#CCCCC(=O)O HY-Y0925 [0,1,0,0,0,0|1,0,2]=4 63 B7R0.4 CCCCCC(C)N HY-B0952 [0,1,0,0,0,0|2,0,0]=3 64 B7R0.4 CCCCCC(C)O HY-W015879 [0,1,0,0,0,0|1,0,0]=2 65 B7R0.4 NCCCCC(=O)O HY-W015878 [0,1,0,0,0,0|2,0,1]=4 66 B7R0.4 O=C(Cl)CCCCBr HY-43538 [0,1,0,0,0,0|3,0,0]=4 67 B7R0.4 O=C(O)CCCCBr HY-W016456 [0,1,0,0,0,0|2,0,1]=4 68 B7R0.4 O=[N+]([O-])OCCCO HY-139566 [0,1,0,0,0,0|3,0,0]=4 69 B7R1.1 NC[C@@H]1CCCO1 HY-W010600 [0,0,0,1,0,0|2,0,0]=3 70 B7R1.1 OC[C@@H]1CCCN1 HY-Y1126 [0,0,0,1,0,0|2,0,0]=3 71 B7R1.1 OC[C@@H]1CCNC1 HY-60263 [0,0,0,1,0,0|1,0,0]=2 72 B7R1.3 BrC1CCOCC1 HY-W003396 [0,0,0,1,0,0|3,0,0]=4 73 B7R1.3 CC1CCOCO1 HY-W111914 [0,0,0,1,0,0|2,0,0]=3 74 B7R1.3 C[C@@H]1CNCCN1 HY-34767 [0,0,0,1,0,0|3,0,0]=4 75 B7R1.3 O=C1CCCCN1 HY-W042193 [0,0,0,1,0,0|3,0,0]=4 76 B7R1.3 O=C1CCCCO1 HY-W012997 [0,0,0,1,0,0|2,0,0]=3 77 B7R1.3 OC1CCCCC1 HY-Y1217 [0,0,0,1,0,0|1,0,0]=2 78 B7R1.4 CN1CCCC1=O HY-Y1275 [0,0,0,1,0,0|1,0,2]=4 79 B7R1.4 O[C@@H]1CNC[C@H]1F HY-W062336 [0,0,0,1,0,0|3,0,0]=4 80 B7R1.7 C=CCC[C@@H]1CO1 HY-46575 [0,0,0,1,0,0|1,0,1]=3 81 B4R0.2 BrCCCBr HY-Y1806 [2,0,0,0,0,0|2,0,0]=4 82 B4R0.2 C#CCCO HY-W001947 [2,0,0,0,0,0|0,0,2]=4 83 B4R0.2 C=CCSC HY-128447 [2,0,0,0,0,0|0,0,2]=4 84 B4R0.2 CNCCO HY-Y1783 [2,0,0,0,0,0|1,0,0]=3 85 B4R0.2 COCCO HY-139415 [2,0,0,0,0,0|0,1,0]=3 86 B4R0.2 CSSSC HY-128454 [2,0,0,0,0,0|2,0,0]=4 87 B4R0.2 NCCCO HY-Y0139 [2,0,0,0,0,0|1,0,0]=3 88 B4R0.2 O=CCCO HY-N8461 [2,0,0,0,0,0|0,1,1]=4 89 B4R0.2 OCCCBr HY-W007337 [2,0,0,0,0,0|1,0,0]=3 90 B4R0.2 OCCCO HY-W017758 [2,0,0,0,0,0|0,1,0]=3 91 B4R0.2 OCCCS HY-W090210 [2,0,0,0,0,0|0,0,0]=2 92 B6R0.1 COC(=O)CCO HY-42569 [1,1,0,0,0,0|0,1,1]=4 93 B6R0.4 CC(C)CCCO HY-W007511 [1,1,0,0,0,0|0,0,0]=2 94 B6R0.4 CCCCB(O)O HY-W000932 [1,1,0,0,0,0|1,0,0]=3 95 B6R0.4 CCCCC(N)=O HY-W144037 [1,1,0,0,0,0|0,0,2]=4 96 B6R0.4 CCNCC(=O)O HY-W141879 [1,1,0,0,0,0|1,0,1]=4 97 B6R0.4 CCOCC(=O)O HY-W027555 [1,1,0,0,0,0|1,0,1]=4 98 B6R0.4 CN(C)CCCCl HY-W018789 [1,1,0,0,0,0|2,0,0]=4 99 B6R0.4 CSCCC(=O)O HY-101401 [1,1,0,0,0,0|0,0,1]=3 100 B6R0.4 NCCCC(=O)O HY-N0067 [1,1,0,0,0,0|1,0,1]=4 101 B6R0.4 NCCCC(=O)O HY-N0067R [1,1,0,0,0,0|1,0,1]=4 102 B8R0.4 C#CCCCCCCO HY-W008554 [0,2,0,0,0,0|1,0,0]=3 103 B8R0.4 C=CCCCCCCO HY-W127366 [0,2,0,0,0,0|1,0,0]=3 104 B8R0.4 CCCCCCCC=O HY-N8015 [0,2,0,0,0,0|1,0,1]=4 105 B8R0.4 CCCCCCCCBr HY-W032015 [0,2,0,0,0,0|2,0,0]=4 106 B8R0.4 CCCCCCCCN HY-W032014 [0,2,0,0,0,0|2,0,0]=4 107 B8R0.4 CCCCCCCCO HY-W032013 [0,2,0,0,0,0|1,0,0]=3 108 B8R0.4 CCCCSCCCC HY-W250123 [0,2,0,0,0,0|2,0,0]=4 109 B8R0.4 CC\C=C/CCCCO HY-W101301 [0,2,0,0,0,0|1,0,0]=3 110 B8R0.4 COCCOCCC=O HY-W1049075C [0,2,0,0,0,0|0,1,1]=4 111 B8R0.4 NCCCCCCCN HY-W008821 [0,2,0,0,0,0|2,0,0]=4 112 B8R0.4 OCCCCCCCBr HY-W008425 [0,2,0,0,0,0|1,0,0]=3 113 B8R0.4 [N-]=[N+]=NCCOCCO HY-140797 [0,2,0,0,0,0|2,0,0]=4 114 B8R0.6 C=CC(O)CCCCC HY-W010410 [0,2,0,0,0,0|1,0,0]=3 115 B8R0.6 CCCCCC(=O)O[Na] HY-W099696 [0,2,0,0,0,0|1,0,1]=4 116 B8R0.6 CCCCCC(O)CC HY-W099689 [0,2,0,0,0,0|1,0,0]=3 117 B8R0.7 CC(=O)NCCCCN HY-113100 [0,2,0,0,0,0|2,0,0]=4 118 B8R0.7 CC(=O)NCCCCN HY-W342604 [0,2,0,0,0,0|2,0,0]=4 119 B8R0.7 CCCCCCC(C)=O HY-W010409 [0,2,0,0,0,0|1,0,1]=4 120 B8R0.7 COCCOCC(=O)O HY-W1048558A [0,2,0,0,0,0|0,1,1]=4 121 B8R0.7 O=C(O)CCOCCO HY-116655 [0,2,0,0,0,0|2,0,0]=4 122 B8R0.3 O=CC[C@H](O)[C@H](O)CO HY-77956 [0,2,0,0,0,0|2,0,0]=4 123 B8R0.8 CCCCC(C)C(=O)O HY-128371 [0,2,0,0,0,0|1,0,1]=4 124 B8R0.8 CCCCC(N)C(=O)O HY-W012709 [0,2,0,0,0,0|1,0,1]=4 125 B8R0.8 CCCCC(O)C(=O)O HY-75954 [0,2,0,0,0,0|1,0,1]=4 126 B8R0.8 CCCC[C@@H](N)C(=O)O HY-41912A [0,2,0,0,0,0|1,0,1]=4 127 B8R0.8 CCCC[C@H](N)C(=O)O HY-Y0017 [0,2,0,0,0,0|1,0,1]=4 128 B8R0.8 CSCCC(N)C(=O)O HY-N0325 [0,2,0,0,0,0|0,0,1]=3 129 B8R0.8 CSCCC(O)C(=O)O HY-116688 [0,2,0,0,0,0|0,0,1]=3 130 B8R0.8 CSCC[C@@H](N)C(=O)O HY-13694 [0,2,0,0,0,0|0,0,1]=3 131 B8R0.8 CSCC[C@H](N)C(=O)O HY-N0326 [0,2,0,0,0,0|0,0,1]=3 132 B8R0.8 CSCC[C@H](N)C(=O)O HY-N0326R [0,2,0,0,0,0|0,0,1]=3 133 B8R0.8 CSCC[C@H](N)C(N)=O HY-W016256 [0,2,0,0,0,0|0,0,2]=4 134 B8R0.8 CSCC[C@H](N)[13C](=O)O HY-N0326S4 [0,2,0,0,0,0|0,0,1]=3 135 B8R0.8 CSCC[C@H]([15NH2])C(=O)O HY-N0326S [0,2,0,0,0,0|0,0,1]=3 136 B8R0.8 C[Se]CCC(N)C(=O)O HY-B1000 [0,2,0,0,0,0|0,1,1]=4 137 B8R0.8 C[Se]CCC(N)C(=O)O HY-B1000R [0,2,0,0,0,0|0,1,1]=4 138 B8R0.8 C[Se]CC[C@H](N)C(=O)O HY-B1000A [0,2,0,0,0,0|0,1,1]=4 139 B8R0.11 CCN(CC)CCCO HY-W010383 [0,2,0,0,0,0|2,0,0]=4 140 B8R0.5 CCCC(O)CC(=O)O HY-113836 [0,2,0,0,0,0|1,0,1]=4 141 B8R0.28 CC(=O)CCCC(=O)O HY-W001957 [0,2,0,0,0,0|1,0,1]=4 142 B8R0.28 CC(C)CCCC(C)N HY-B1233 [0,2,0,0,0,0|2,0,0]=4 143 B8R0.28 CC(C)CCCC(C)N HY-B1233A [0,2,0,0,0,0|2,0,0]=4 144 B6R1.1 C1CSCCN1 HY-W007359 [1,0,0,1,0,0|1,0,0]=3 145 B6R1.1 C1CSCSC1 HY-W001189 [1,0,0,1,0,0|0,1,0]=3 146 B6R1.2 CN1CCCC1 HY-128383 [1,0,0,1,0,0|1,0,0]=3 147 B6R1.2 F[C@@H]1CCNC1 HY-40421 [1,0,0,1,0,0|2,0,0]=4 148 B6R1.2 N=C1CCCS1 HY-W015798 [1,0,0,1,0,0|1,0,1]=4 149 B6R1.2 O=C1CCSC1 HY-W010594 [1,0,0,1,0,0|0,0,2]=4 150 B6R1.2 O[C@H]1CCOC1 HY-76476 [1,0,0,1,0,0|0,1,0]=3 151 B6R1.3 COC[C@H]1CO1 HY-Z1630 [1,0,0,1,0,0|0,1,0]=3 152 B6R1.6 OCC1CNC1 HY-21336 [1,0,0,1,0,0|1,0,0]=3 153 B6R1.6 OCC1COC1 HY-W004925 [1,0,0,1,0,0|0,1,0]=3 154 B8R1.2 OCC1CCC=CO1 HY-34692 [0,1,0,1,0,0|1,0,1]=4 155 B8R1.2 OCC1CCCCO1 HY-115051 [0,1,0,1,0,0|1,0,0]=3 156 B8R1.2 OCC1CCOCC1 HY-79631 [0,1,0,1,0,0|0,1,0]=3 157 B8R1.5 CC1CCCCC1=O HY-W010549 [0,1,0,1,0,0|1,0,1]=4 158 B8R1.5 N[C@@H]1CCCC[C@H]1N HY-41957 [0,1,0,1,0,0|2,0,0]=4 159 B8R1.5 O[C@@H]1CCCC[C@H]1O HY-W010514 [0,1,0,1,0,0|1,0,0]=3 160 B8R1.8 OCCN1CCCC1 HY-W010519 [0,1,0,1,0,0|1,0,0]=3 161 B8R1.11 CN1CCC[C@H]1CO HY-W019679 [0,1,0,1,0,0|1,0,0]=3 162 B8R1.22 O=C1CCCCCO1 HY-W015891 [0,1,0,1,0,0|1,0,1]=4 163 B8R1.22 O=C1CCCCCO1 HY-W392100B [0,1,0,1,0,0|1,0,1]=4 164 B8R1.1 CCC1CCC(=O)O1 HY-W015892 [0,1,0,1,0,0|1,0,1]=4 165 B8R1.3 CN1CCC(O)CC1 HY-W018626 [0,1,0,1,0,0|2,0,0]=4 166 B8R1.3 C[C@H]1CC[C@H](N)CC1 HY-W010538 [0,1,0,1,0,0|2,0,0]=4 167 B8R1.3 NC1CCC(N)CC1 HY-W007732B [0,1,0,1,0,0|2,0,0]=4 168 B8R1.3 N[C@H]1CC[C@H](O)CC1 HY-79722 [0,1,0,1,0,0|1,0,0]=3 169 B8R1.3 OC1COC(O)CO1 HY-W004661 [0,1,0,1,0,0|1,1,0]=4 170 B8R1.4 CC1CCCC(C)N1 HY-B1191 [0,1,0,1,0,0|2,0,0]=4 171 B8R1.7 O=C(O)C1CSCN1 HY-B1169 [0,1,0,1,0,0|1,0,1]=4 172 B8R1.7 O=C(O)C1CSSC1 HY-50730 [0,1,0,1,0,0|1,0,1]=4 173 B8R1.7 O=C(O)[C@@H]1CCNC1 HY-60256 [0,1,0,1,0,0|1,0,1]=4 174 B8R1.7 O=C(O)[C@@H]1CSCN1 HY-W012676 [0,1,0,1,0,0|1,0,1]=4 175 B8R1.7 O=C(O)[C@H]1CCCO1 HY-W005223 [0,1,0,1,0,0|2,0,0]=4 176 B8R1.7 OB(O)C1CCCC1 HY-W000955 [0,1,0,1,0,0|2,0,0]=4 177 B8R1.72 C[N+]1(C)CCCCC1 HY-W017448 [0,1,0,1,0,0|2,0,0]=4