0 B7R0.12 C#CCN(CC)CC LL2057 [0,0,0,0,0,0|1,0,1]=2 1 B7R0.12 C#CCN(CC)CC XJ2597 [0,0,0,0,0,0|1,0,1]=2 2 B7R0.12 CCCC(CO)CO LT1803 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.12 CCCN(CC)N=O RT17895 [0,0,0,0,0,0|3,0,0]=3 4 B7R0.12 CCN(CC)CC#N XJ2363 [0,0,0,0,0,0|1,0,1]=2 5 B7R0.12 CCN(CC)CCCl XJ1399 [0,0,0,0,0,0|1,0,0]=1 6 B7R0.12 CCN(CC)CCN HL1261 [0,0,0,0,0,0|1,0,0]=1 7 B7R0.12 CCN(CC)CCO HL1262 [0,0,0,0,0,0|0,0,0]=0 8 B7R0.12 CCN(CC)CCO LT5094 [0,0,0,0,0,0|0,0,0]=0 9 B7R0.12 CCN(CC)CCS LT6528 [0,0,0,0,0,0|0,1,0]=1 10 B6R0.1 CCC(C)CC=O JZ5060 [1,0,0,0,0,0|1,0,2]=4 11 B6R0.1 CCC(C)CCO HL0061 [1,0,0,0,0,0|1,0,0]=2 12 B6R0.1 CCC(C)CCO LL2797 [1,0,0,0,0,0|1,0,0]=2 13 B6R0.1 CCC(C)CCO LQ4221 [1,0,0,0,0,0|1,0,0]=2 14 B6R0.1 CCCC(=O)CC HL0062 [1,0,0,0,0,0|3,0,0]=4 15 B6R0.1 CCCC(C)CC HL0060 [1,0,0,0,0,0|2,0,0]=3 16 B6R0.1 OCC[C@@H](O)CO YH14636 [1,0,0,0,0,0|3,0,0]=4 17 B6R0.1 OCC[C@H](O)CO LQ5089 [1,0,0,0,0,0|3,0,0]=4 18 B6R0.9 CCC(CC)CN LQ1208 [1,0,0,0,0,0|2,0,0]=3 19 B6R0.9 CCN(C=O)CC LQ1209 [1,0,0,0,0,0|0,0,2]=3 20 B6R0.9 CCN(CC)CC JZ4026 [1,0,0,0,0,0|0,0,0]=1 21 B6R0.9 CCN(CC)CC XJ1326 [1,0,0,0,0,0|0,0,0]=1 22 B6R0.9 CCN(CC)CC YH28671 [1,0,0,0,0,0|0,0,0]=1 23 B6R0.9 CC[SiH](CC)CC LT6209 [1,0,0,0,0,0|1,0,0]=2 24 B6R0.9 OCC(CO)CO YH02578 [1,0,0,0,0,0|3,0,0]=4 25 B6R0.9 [BH-](CC)(CC)CC YH47632 [1,0,0,0,0,0|1,0,0]=2 26 B8R0.11 C=CCCC(CC)CO RT0530 [0,1,0,0,0,0|3,0,0]=4 27 B8R0.11 CC#CCN(CC)CC LQ3076 [0,1,0,0,0,0|1,0,1]=3 28 B8R0.11 CCCCC(CC)CBr LQ4127 [0,1,0,0,0,0|3,0,0]=4 29 B8R0.11 CCCCC(CC)CCl XJ0493 [0,1,0,0,0,0|3,0,0]=4 30 B8R0.11 CCCCC(CC)CN RT0570 [0,1,0,0,0,0|3,0,0]=4 31 B8R0.11 CCCCC(CC)CO XJ0289 [0,1,0,0,0,0|3,0,0]=4 32 B8R0.11 CCCCC(CC)CS LQ3275 [0,1,0,0,0,0|3,0,0]=4 33 B8R0.11 CCCCN(CC)N=O RT0217 [0,1,0,0,0,0|3,0,0]=4 34 B8R0.11 CCN(CC)CCCO LT6135 [0,1,0,0,0,0|0,0,0]=1 35 B8R0.11 COCCC(OC)OC XJ4077 [0,1,0,0,0,0|3,0,0]=4 36 B8R0.16 CCN(CC)CC(C)O JZ2532 [0,1,0,0,0,0|0,0,0]=1 37 B8R0.20 CCC(=O)N(CC)CC XJ1563 [0,1,0,0,0,0|1,0,1]=3 38 B8R0.20 CCN(CC)C(=O)SC RT19835 [0,1,0,0,0,0|2,0,1]=4 39 B8R0.20 CCN(CC)C(=S)SC RT0219 [0,1,0,0,0,0|2,0,1]=4 40 B8R0.22 CCCN(CCC)N=O RT1151 [0,1,0,0,0,0|3,0,0]=4 41 B8R0.22 CCN(CCO)CCO XJ0542 [0,1,0,0,0,0|0,0,0]=1 42 B8R0.22 O=NN(CCO)CCO RT4843 [0,1,0,0,0,0|2,0,0]=3 43 B8R0.31 CCCC(O)(CC)CC LQ1128 [0,1,0,0,0,0|2,0,0]=3 44 B8R1.2 CCC1CCCCC1 LQ1884 [0,0,0,1,0,0|2,0,0]=3 45 B8R1.2 CCC1CCCCN1 HL0893 [0,0,0,1,0,0|3,0,0]=4 46 B8R1.2 CCN1CCCCC1 JZ0120 [0,0,0,1,0,0|1,0,0]=2 47 B8R1.2 CCN1CCNCC1 JZ0119 [0,0,0,1,0,0|1,0,0]=2 48 B8R1.2 CNC1CCNCC1 YH02204 [0,0,0,1,0,0|3,0,0]=4 49 B8R1.2 CNC1CCOCC1 YH47081 [0,0,0,1,0,0|2,0,0]=3 50 B8R1.2 NCC1CCNCC1 LT0451 [0,0,0,1,0,0|3,0,0]=4 51 B8R1.2 NCC1CCOCC1 HL3392 [0,0,0,1,0,0|2,0,0]=3 52 B8R1.2 O=CN1CCCCC1 JZ2045 [0,0,0,1,0,0|2,0,1]=4 53 B8R1.2 O=CN1CCNCC1 JZ3205 [0,0,0,1,0,0|2,0,1]=4 54 B8R1.2 O=CN1CCOCC1 JZ2522 [0,0,0,1,0,0|1,0,1]=3 55 B8R1.2 O=NN1CCNCC1 RT15111 [0,0,0,1,0,0|3,0,0]=4 56 B8R1.2 O=NN1CCOCC1 RT17897 [0,0,0,1,0,0|2,0,0]=3 57 B8R1.2 OCC1CCCCC1 HL1270 [0,0,0,1,0,0|3,0,0]=4 58 B8R1.2 OCC1CCNCC1 LT0484 [0,0,0,1,0,0|3,0,0]=4 59 B8R1.2 OCC1CCOCC1 JZ4923 [0,0,0,1,0,0|2,0,0]=3 60 B8R1.8 BrCCN1CCCC1 LX2478 [0,0,0,1,0,0|1,0,0]=2 61 B8R1.8 BrCCN1CCCC1 YH06128 [0,0,0,1,0,0|1,0,0]=2 62 B8R1.8 C#CCC1CCCC1 HL3291 [0,0,0,1,0,0|2,0,1]=4 63 B8R1.8 ClCCN1CCCC1 HL2871 [0,0,0,1,0,0|1,0,0]=2 64 B8R1.8 ClCCN1CCCC1 LQ3213 [0,0,0,1,0,0|1,0,0]=2 65 B8R1.8 N#CCC1CCCC1 LQ1738 [0,0,0,1,0,0|2,0,1]=4 66 B8R1.8 O=CCC1CCCC1 RT17688 [0,0,0,1,0,0|1,0,2]=4 67 B8R1.8 OCCC1CCNC1 YH96359 [0,0,0,1,0,0|2,0,0]=3 68 B8R1.8 OCCN1CCCC1 JZ2200 [0,0,0,1,0,0|0,0,0]=1 69 B8R1.11 CCN1CCCC1=O YH50862 [0,0,0,1,0,0|2,0,1]=4 70 B5R0.1 C#CCN(C)C LQ3198 [2,0,0,0,0,0|1,0,1]=4 71 B5R0.1 C=CCN(C)C JZ1867 [2,0,0,0,0,0|1,0,1]=4 72 B5R0.1 CC(C)=CCO LT3091 [2,0,0,0,0,0|1,0,1]=4 73 B5R0.1 CC(C)CCCl HL1371 [2,0,0,0,0,0|2,0,0]=4 74 B5R0.1 CC(C)CCI XJ0935 [2,0,0,0,0,0|2,0,0]=4 75 B5R0.1 CCCC(C)C HL1370 [2,0,0,0,0,0|2,0,0]=4 76 B5R0.1 CCCC(C)C HL4500 [2,0,0,0,0,0|2,0,0]=4 77 B5R0.1 CN(C)CCCl HL2802 [2,0,0,0,0,0|1,0,0]=3 78 B5R0.1 CN(C)CCN HL1382 [2,0,0,0,0,0|1,0,0]=3 79 B5R0.1 CN(C)CCO HL1383 [2,0,0,0,0,0|0,0,0]=2 80 B5R0.1 CN(C)CCS LT4952 [2,0,0,0,0,0|0,1,0]=3 81 B5R0.1 C[C@@H](N)CCO RT0497 [2,0,0,0,0,0|2,0,0]=4 82 B5R0.1 C[C@@H](O)CCO SY0267 [2,0,0,0,0,0|2,0,0]=4 83 B5R0.2 CCCCCI HL0274 [2,0,0,0,0,0|2,0,0]=4 84 B5R0.2 CCCSCC LT5403 [2,0,0,0,0,0|2,0,0]=4 85 B5R0.2 CCNCCO LL0439 [2,0,0,0,0,0|0,0,0]=2 86 B5R0.2 CCNNCC LQ3339 [2,0,0,0,0,0|2,0,0]=4 87 B5R0.2 CCOCCBr HL0120 [2,0,0,0,0,0|2,0,0]=4 88 B5R0.2 CCOCCCl HL0279 [2,0,0,0,0,0|2,0,0]=4 89 B5R0.2 CCOCCO LL0444 [2,0,0,0,0,0|1,0,0]=3 90 B5R0.2 CSCCCO XJ0883 [2,0,0,0,0,0|2,0,0]=4 91 B5R0.2 NCCCCO XJ3835 [2,0,0,0,0,0|2,0,0]=4 92 B5R0.2 OCCCCCl LQ1521 [2,0,0,0,0,0|2,0,0]=4 93 B5R0.2 OCCCCF RT1165 [2,0,0,0,0,0|2,0,0]=4 94 B5R0.2 OCCOCCl RT1169 [2,0,0,0,0,0|2,0,0]=4 95 B5R0.3 C=C(CC)CC XJ1324 [2,0,0,0,0,0|1,0,1]=4 96 B5R0.3 CC(CO)CO JZ1881 [2,0,0,0,0,0|2,0,0]=4 97 B5R0.3 CCC(Br)CC XJ1961 [2,0,0,0,0,0|2,0,0]=4 98 B5R0.3 CCC(C)CBr LQ2987 [2,0,0,0,0,0|2,0,0]=4 99 B5R0.3 CCC(C)CBr LQ3410 [2,0,0,0,0,0|2,0,0]=4 100 B5R0.3 CCC(C)CC LL0223 [2,0,0,0,0,0|1,0,0]=3 101 B5R0.3 CCC(C)CCl LQ1182 [2,0,0,0,0,0|2,0,0]=4 102 B5R0.3 CCC(C)CO LL0587 [2,0,0,0,0,0|1,0,0]=3 103 B5R0.3 CCC(C)NC LQ3344 [2,0,0,0,0,0|2,0,0]=4 104 B5R0.3 CCC(N)CC LQ1186 [2,0,0,0,0,0|2,0,0]=4 105 B5R0.3 CCC(N)CO LL0227 [2,0,0,0,0,0|2,0,0]=4 106 B5R0.3 CCN(C)CC LQ1190 [2,0,0,0,0,0|0,0,0]=2 107 B5R0.3 CCN(C)N=O RT17894 [2,0,0,0,0,0|1,0,1]=4 108 B5R0.3 CCN(O)CC HL2577 [2,0,0,0,0,0|0,0,0]=2 109 B5R0.3 CC[C@@H](C)CO LQ1183 [2,0,0,0,0,0|1,0,0]=3 110 B5R0.3 CC[C@@H](O)CO LQ5013 [2,0,0,0,0,0|2,0,0]=4 111 B5R0.3 CC[C@H](C)CBr LL0949 [2,0,0,0,0,0|2,0,0]=4 112 B5R0.3 CC[C@H](O)CO HL4502 [2,0,0,0,0,0|2,0,0]=4 113 B5R0.3 CC\C(C)=N\O LL0233 [2,0,0,0,0,0|2,0,0]=4 114 B7R0.2 CCC(C)CC(C)C XJ0315 [1,1,0,0,0,0|2,0,0]=4 115 B7R0.2 CC[C@H](C)CC(=O)O LX2881 [1,1,0,0,0,0|1,0,1]=4 116 B7R0.2 CC[C@H](C)CC(=O)O YH39271 [1,1,0,0,0,0|1,0,1]=4 117 B7R0.3 CCCCC(C)CC HL0067 [1,1,0,0,0,0|2,0,0]=4 118 B7R0.3 CC\C(C)=C\CCBr JZ5314 [1,1,0,0,0,0|2,0,0]=4 119 B7R0.5 CN(CCO)C(=N)N XJ5535 [1,1,0,0,0,0|1,0,1]=4 120 B7R0.7 CC(CCBr)CCBr XJ2711 [1,1,0,0,0,0|2,0,0]=4 121 B7R0.7 CC(CCO)CCO XJ2710 [1,1,0,0,0,0|1,0,0]=3 122 B7R0.7 CCCN(C)CCC HL2547 [1,1,0,0,0,0|1,0,0]=3 123 B7R0.7 CN(CCCl)CCCl LQ0036 [1,1,0,0,0,0|1,0,0]=3 124 B7R0.7 CN(CCO)CCO RT1442 [1,1,0,0,0,0|0,0,0]=2 125 B7R0.7 CN(CCO)CCO XJ0326 [1,1,0,0,0,0|0,0,0]=2 126 B7R0.10 CCC(C)C(N)CO LT7578 [1,1,0,0,0,0|1,0,0]=3 127 B7R0.11 CCCC(C)(Cl)CC LQ5130 [1,1,0,0,0,0|2,0,0]=4 128 B7R0.11 CCCC(C)(O)CC LQ1129 [1,1,0,0,0,0|2,0,0]=4 129 B7R0.11 CCS(=O)(=O)CCO HL1909 [1,1,0,0,0,0|2,0,0]=4 130 B7R0.11 COC(C)(C)CCO HL4652 [1,1,0,0,0,0|2,0,0]=4 131 B7R0.15 CCN(CC)C(=S)S HL1611 [1,1,0,0,0,0|0,1,1]=4 132 B7R0.15 CCN(CC)C(=S)[S-] JZ1978 [1,1,0,0,0,0|0,1,1]=4 133 B7R0.15 CCN(CC)C(=S)[S-] JZ4819 [1,1,0,0,0,0|0,1,1]=4 134 B7R0.15 CCN(CC)C(=S)[S-] LQ1817 [1,1,0,0,0,0|0,1,1]=4 135 B7R0.15 CCN(CC)C(=S)[S-] XJ4041 [1,1,0,0,0,0|0,1,1]=4 136 B7R0.15 CCN(CC)C(C)=O HL0372 [1,1,0,0,0,0|0,0,1]=3 137 B7R0.15 CCN(CC)P(Cl)Cl LQ1632 [1,1,0,0,0,0|2,0,0]=4 138 B7R0.18 CCC(O)(CC)CC LQ1120 [1,1,0,0,0,0|1,0,0]=3 139 B7R0.18 CCP(=S)(CC)CC LQ1122 [1,1,0,0,0,0|0,1,0]=3 140 B7R0.18 CC[Ge](Cl)(CC)CC XJ1519 [1,1,0,0,0,0|1,0,0]=3 141 B7R0.18 CC[N+](C)(CC)CC XJ2256 [1,1,0,0,0,0|0,0,1]=3 142 B7R0.18 CC[Si](Br)(CC)CC XJ1553 [1,1,0,0,0,0|1,0,0]=3 143 B7R0.18 CC[Si](Cl)(CC)CC LT4501 [1,1,0,0,0,0|1,0,0]=3 144 B7R0.18 CC[Sn](Cl)(CC)CC XJ1521 [1,1,0,0,0,0|1,0,0]=3 145 B9R0.26 CCN(CC)CC(O)CO JZ3978 [0,2,0,0,0,0|0,0,0]=2 146 B9R0.37 CCN(CC)C(=O)CC#N LQ4508 [0,2,0,0,0,0|1,0,1]=4 147 B9R0.37 CCN(CC)C(=O)OCCl RT18612 [0,2,0,0,0,0|1,0,1]=4 148 B9R0.43 CCN(CC)CCC(C)=O YH66085 [0,2,0,0,0,0|0,0,1]=3 149 B9R0.50 CCN(CC)CC#CCO RT4689 [0,2,0,0,0,0|0,0,0]=2 150 B9R0.50 CCN(CC)CCCCN XJ4923 [0,2,0,0,0,0|1,0,0]=3 151 B9R0.50 CCNCCN(CC)CC XJ0303 [0,2,0,0,0,0|1,0,0]=3 152 B9R0.33 CC(C)N(CCN)C(C)C LL0497 [0,2,0,0,0,0|1,0,0]=3 153 B9R0.33 CC(C)N(CCO)C(C)C LL0253 [0,2,0,0,0,0|0,0,0]=2 154 B9R0.33 CC(C)N(CCO)C(C)C LT6155 [0,2,0,0,0,0|0,0,0]=2 155 B9R0.41 CCC(CC)C(N)C(=O)O RT4991 [0,2,0,0,0,0|1,0,1]=4 156 B9R0.36 CCN(CC)N(CC)CC RT4721 [0,2,0,0,0,0|2,0,0]=4 157 B9R0.17 CCCC(OCC)OCC LT4359 [0,2,0,0,0,0|2,0,0]=4 158 B9R0.17 CCCN(CCO)CCO RT3844 [0,2,0,0,0,0|0,0,0]=2 159 B9R0.17 CCC[SiH](CCC)CCC XJ1533 [0,2,0,0,0,0|2,0,0]=4 160 B9R0.17 CCC[SnH2+](CCC)CCC XJ2417 [0,2,0,0,0,0|2,0,0]=4 161 B9R0.17 CCOC(CCCl)OCC LT6767 [0,2,0,0,0,0|2,0,0]=4 162 B9R0.17 CCOC(CCN)OCC XJ5415 [0,2,0,0,0,0|2,0,0]=4 163 B9R0.17 NCCN(CCO)CCO LX2584 [0,2,0,0,0,0|0,0,0]=2 164 B9R0.17 OCCN(CCO)CCO JZ4041 [0,2,0,0,0,0|0,0,0]=2 165 B9R0.17 OCCN(CCO)CCO LQ0371 [0,2,0,0,0,0|0,0,0]=2 166 B9R0.59 CC[N+](C)(CCO)CCO RT0395 [0,2,0,0,0,0|0,0,1]=3 167 B7R1.1 CCN1CCCC1 LQ3265 [1,0,0,1,0,0|1,0,0]=3 168 B7R1.1 CNC1CCOC1 YH51455 [1,0,0,1,0,0|2,0,0]=4 169 B7R1.2 CN1CCC(=O)C1 XJ6122 [1,0,0,1,0,0|0,0,2]=4 170 B7R1.2 CN1CCC(O)C1 LX2405 [1,0,0,1,0,0|0,0,0]=2 171 B7R1.2 CN1CC[C@@H](N)C1 YH88427 [1,0,0,1,0,0|1,0,0]=3 172 B7R1.2 CN1CC[C@@H](O)C1 YH22686 [1,0,0,1,0,0|0,0,0]=2 173 B7R1.2 CN1CC[C@H](N)C1 YH66272 [1,0,0,1,0,0|1,0,0]=3 174 B7R1.2 CN1CC[C@H](O)C1 XJ6769 [1,0,0,1,0,0|0,0,0]=2 175 B7R1.2 N[C@@H]1CC[C@@H](O)C1 YH65478 [1,0,0,1,0,0|2,0,0]=4 176 B7R1.2 N[C@H]1CC[C@@H](O)C1 YH24807 [1,0,0,1,0,0|2,0,0]=4 177 B7R1.2 N[C@H]1CC[C@H](O)C1 YH65948 [1,0,0,1,0,0|2,0,0]=4 178 B7R1.3 BrC1CCOCC1 YH49891 [1,0,0,1,0,0|2,0,0]=4 179 B7R1.3 CC1CCCCC1 LQ0421 [1,0,0,1,0,0|2,0,0]=4 180 B7R1.3 CC1CCNCC1 HL0233 [1,0,0,1,0,0|2,0,0]=4 181 B7R1.3 CN1CCNCC1 JZ0117 [1,0,0,1,0,0|1,0,0]=3 182 B7R1.3 CN1CCNCC1 RT14568 [1,0,0,1,0,0|1,0,0]=3 183 B7R1.3 CN1CCOCC1 LT7334 [1,0,0,1,0,0|0,0,0]=2 184 B7R1.3 NC1CCOCC1 LT5833 [1,0,0,1,0,0|2,0,0]=4 185 B7R1.3 NC1CCOCC1 YH54791 [1,0,0,1,0,0|2,0,0]=4 186 B7R1.3 NN1CCCCC1 RT4329 [1,0,0,1,0,0|2,0,0]=4 187 B7R1.3 NN1CCCCC1 XJ2051 [1,0,0,1,0,0|2,0,0]=4 188 B7R1.3 O=C1CCOCC1 XJ5024 [1,0,0,1,0,0|2,0,0]=4 189 B7R1.3 OC1CCOCC1 HL2134 [1,0,0,1,0,0|2,0,0]=4 190 B7R1.3 OC1CCOCC1 YH45458 [1,0,0,1,0,0|2,0,0]=4 191 B7R1.3 ON1CCCCC1 LT0352 [1,0,0,1,0,0|2,0,0]=4 192 B7R1.4 CC1OCCC1=O LT1811 [1,0,0,1,0,0|2,0,0]=4 193 B7R1.4 CN1CCOC1=O LT3023 [1,0,0,1,0,0|1,0,1]=4 194 B7R1.6 ClCCN1CCC1 YH26565 [1,0,0,1,0,0|1,0,0]=3 195 B7R1.25 CC1(CO)CCO1 YH09979 [1,0,0,1,0,0|2,0,0]=4 196 B7R1.29 OCC1(CO)CC1 XJ5375 [1,0,0,1,0,0|2,0,0]=4 197 B9R1.1 CCN1CCC(=O)CC1 XJ2485 [0,1,0,1,0,0|0,0,1]=3 198 B9R1.1 CCN1CCC(N)CC1 LT0468 [0,1,0,1,0,0|1,0,0]=3 199 B9R1.1 CCN1CCC(O)CC1 LQ2519 [0,1,0,1,0,0|0,0,0]=2 200 B9R1.12 BrCCCN1CCCC1 YH25403 [0,1,0,1,0,0|1,0,0]=3 201 B9R1.12 BrCCCN1CCCC1 YH93306 [0,1,0,1,0,0|1,0,0]=3 202 B9R1.12 CCCCN1CCCC1 HL0386 [0,1,0,1,0,0|1,0,0]=3 203 B9R1.12 ClCCCN1CCCC1 LX2632 [0,1,0,1,0,0|1,0,0]=3 204 B9R1.12 ClCCCN1CCCC1 XJ5409 [0,1,0,1,0,0|1,0,0]=3 205 B9R1.12 OCCCC1CCCO1 RT15043 [0,1,0,1,0,0|2,0,0]=4 206 B9R1.12 OCCCN1CCCC1 YH43756 [0,1,0,1,0,0|0,0,0]=2 207 B9R1.21 OC[C@@H]1CC[C@H](CO)O1 RT17916 [0,1,0,1,0,0|2,0,0]=4 208 B9R1.6 CC(=O)C1CCOCC1 YH65687 [0,1,0,1,0,0|1,0,1]=4 209 B9R1.6 CC(=O)N1CCCCC1 LQ3683 [0,1,0,1,0,0|1,0,1]=4 210 B9R1.6 CC(C)C1CCCCC1 LQ1361 [0,1,0,1,0,0|2,0,0]=4 211 B9R1.6 CC(C)N1CCNCC1 LQ2673 [0,1,0,1,0,0|1,0,0]=3 212 B9R1.6 N=C(N)N1CCOCC1 YH39738 [0,1,0,1,0,0|1,0,1]=4 213 B9R1.6 NC(=S)N1CCOCC1 YH34467 [0,1,0,1,0,0|1,0,1]=4 214 B9R1.33 OCCN1CCNC1=S JZ4274 [0,1,0,1,0,0|1,0,1]=4 215 B9R1.13 O=C(O)CC1CCCC1 HL0662 [0,1,0,1,0,0|1,0,1]=4 216 B9R1.14 CCN1CCC[C@H]1CN RT3977 [0,1,0,1,0,0|1,0,0]=3 217 B9R1.8 BrCCC1CCCCC1 HL0957 [0,1,0,1,0,0|2,0,0]=4 218 B9R1.8 BrCCN1CCOCC1 LX3103 [0,1,0,1,0,0|0,0,0]=2 219 B9R1.8 CCCC1CCCCN1 LT0385 [0,1,0,1,0,0|2,0,0]=4 220 B9R1.8 CSCN1CCCCC1 LT0505 [0,1,0,1,0,0|1,0,0]=3 221 B9R1.8 ClCCN1CCCCC1 LQ1947 [0,1,0,1,0,0|1,0,0]=3 222 B9R1.8 ClCCN1CCCCC1 LT6058 [0,1,0,1,0,0|1,0,0]=3 223 B9R1.8 ClCCN1CCOCC1 JZ2290 [0,1,0,1,0,0|0,0,0]=2 224 B9R1.8 ClCCN1CCOCC1 XJ2523 [0,1,0,1,0,0|0,0,0]=2 225 B9R1.8 N#CCN1CCCCC1 LT0501 [0,1,0,1,0,0|1,0,1]=4 226 B9R1.8 NCCC1=CCCCC1 HL2542 [0,1,0,1,0,0|2,0,0]=4 227 B9R1.8 NCCC1CCOCC1 YH12238 [0,1,0,1,0,0|1,0,0]=3 228 B9R1.8 NCCN1CCNCC1 XJ0549 [0,1,0,1,0,0|1,0,0]=3 229 B9R1.8 NCCN1CCOCC1 XJ2031 [0,1,0,1,0,0|0,0,0]=2 230 B9R1.8 OCCC1CCCCC1 XJ2696 [0,1,0,1,0,0|1,0,0]=3 231 B9R1.8 OCCC1CCCCN1 HL0894 [0,1,0,1,0,0|1,0,0]=3 232 B9R1.8 OCCC1CCCNC1 HL4509 [0,1,0,1,0,0|1,0,0]=3 233 B9R1.8 OCCC1CCNCC1 JZ3997 [0,1,0,1,0,0|1,0,0]=3 234 B9R1.8 OCCC1CCOCC1 YH02520 [0,1,0,1,0,0|1,0,0]=3 235 B9R1.8 OCCC1CNCCN1 YH55395 [0,1,0,1,0,0|2,0,0]=4 236 B9R1.8 OCCN1CCCCC1 HL2424 [0,1,0,1,0,0|0,0,0]=2 237 B9R1.8 OCCN1CCNCC1 RT15528 [0,1,0,1,0,0|0,0,0]=2 238 B9R1.8 OCCN1CCOCC1 LT6885 [0,1,0,1,0,0|0,0,0]=2 239 B9R1.8 OCCN1CSCSC1 RT0037 [0,1,0,1,0,0|1,0,0]=3 240 B9R1.8 OCC[C@@H]1CCCCN1 YH18874 [0,1,0,1,0,0|1,0,0]=3 241 B9R1.8 OCC[C@H]1CCCCN1 RT3869 [0,1,0,1,0,0|1,0,0]=3 242 B9R1.134 CCC[N+]1(C)CCCC1 YH66659 [0,1,0,1,0,0|1,0,1]=4 243 B9R2.39 SC1CC2CCC1C2 RT11262 [0,0,0,2,0,0|1,1,0]=4 244 B9R2.49 C1CN2CCN1CC2 YH51644 [0,0,0,2,0,0|1,0,0]=3 245 B9R2.65 OCC1C2COCC12 YH66301 [0,0,0,2,0,0|2,0,0]=4 246 B9R2.174 C1CC2(CCN1)CC2 YH66285 [0,0,0,2,0,0|2,0,0]=4