0 B9R0.45 BrCCCCCCCCBr AK-48263 [0,0,0,0,0,0|2,0,2]=4 1 B9R0.45 C#CCCCCCCCO AK117239 [0,0,0,0,0,0|0,0,4]=4 2 B9R0.45 CCCCCCCCCBr AK164444 [0,0,0,0,0,0|1,0,2]=3 3 B9R0.45 ClCCOCCOCCO AK113441 [0,0,0,0,0,0|3,0,1]=4 4 B9R0.45 NCCOCCOCCO AK105247 [0,0,0,0,0,0|3,0,1]=4 5 B9R0.45 OCCCCCCCCBr AK113930 [0,0,0,0,0,0|1,0,2]=3 6 B9R0.45 OCCOCCOCCO AK-72565 [0,0,0,0,0,0|3,0,1]=4 7 B8R0.4 BrCCCCCCCBr AK109234 [1,0,0,0,0,0|2,0,1]=4 8 B8R0.4 C(CCCCO)CCBr AK-41195 [1,0,0,0,0,0|1,0,1]=3 9 B8R0.4 OCCCCCCC#C AK-48557 [1,0,0,0,0,0|0,0,3]=4 10 B8R0.4 OCCCCCCCO AK-44723 [1,0,0,0,0,0|1,0,1]=3 11 B8R0.4 OCCCNCCCO AK-33226 [1,0,0,0,0,0|2,0,1]=4 12 B10R0.4 CCCCCCCCB(O)O AK-84208 [0,1,0,0,0,0|1,0,2]=4 13 B10R0.71 C(CCCCBr)CCCCBr AK-48264 [0,1,0,0,0,0|1,0,2]=4 14 B10R0.71 ClCCCCCCCCCCl AK-48518 [0,1,0,0,0,0|1,0,2]=4 15 B10R0.71 OCCCCCCCCCBr AK-77024 [0,1,0,0,0,0|0,0,2]=3 16 B10R0.71 OCCCCCCCCCO AK117066 [0,1,0,0,0,0|0,0,2]=3 17 B10R1.17 OCCCN1CCOCC1 AK-48252 [0,0,0,1,0,0|2,0,1]=4 18 B10R1.20 OCC1C(CO)CCCC1 AK342703 [0,0,0,1,0,0|1,0,2]=4 19 B10R1.20 OC[C@@H]1[C@@H](CO)CCCC1 AK134190 [0,0,0,1,0,0|1,0,2]=4 20 B10R1.20 OC[C@H]1[C@H](CO)CCCC1 AK-79086 [0,0,0,1,0,0|1,0,2]=4 21 B10R1.21 CCCCCC1=CC=CS1 AK117060 [0,0,0,1,0,0|0,1,2]=4 22 B10R1.21 ClCCCCC1OCCO1 AK163242 [0,0,0,1,0,0|2,0,1]=4 23 B10R1.85 ClCCN1CCCCCC1 AK-81569 [0,0,0,1,0,0|2,0,1]=4 24 B7R0.1 C(CCCBr)CCBr AK-48407 [2,0,0,0,0,0|2,0,0]=4 25 B7R0.1 C(CCCCC#C)O AK-30082 [2,0,0,0,0,0|0,0,2]=4 26 B7R0.1 ICCCCCCI AK165087 [2,0,0,0,0,0|2,0,0]=4 27 B7R0.1 NCCCCCCN AK129024 [2,0,0,0,0,0|2,0,0]=4 28 B7R0.1 NCCCNCCO AK-50569 [2,0,0,0,0,0|2,0,0]=4 29 B7R0.1 OCCCCCCBr AK110830 [2,0,0,0,0,0|1,0,0]=3 30 B7R0.1 OCCCCCCCl AK-47999 [2,0,0,0,0,0|1,0,0]=3 31 B7R0.1 OCCCCCCN AK-84482 [2,0,0,0,0,0|1,0,0]=3 32 B9R0.2 CCCCCCCB(O)O AK145619 [1,1,0,0,0,0|1,0,1]=4 33 B9R0.5 C(C(OCC)=O)CCCBr AK-46515 [1,1,0,0,0,0|2,0,0]=4 34 B9R0.5 NCCCCC(=O)OCC AK-41723 [1,1,0,0,0,0|2,0,0]=4 35 B9R0.46 CCC(C)CCCCCO AK-82137 [1,1,0,0,0,0|0,0,1]=3 36 B9R0.46 CCCCCCC(C)CO AK158822 [1,1,0,0,0,0|0,0,1]=3 37 B11R0.3 OCCCCCCCCCCBr AK-35534 [0,2,0,0,0,0|0,0,2]=4 38 B9R1.8 BrCCN1CCCCC1 AK110576 [1,0,0,1,0,0|2,0,0]=4 39 B9R1.8 C(CN1CCNCC1)O AK-47366 [1,0,0,1,0,0|2,0,0]=4 40 B9R1.8 C1CCN[C@H](C1)CCO AK-39809 [1,0,0,1,0,0|1,0,1]=4 41 B9R1.8 CCCC1CCNCC1 AK135014 [1,0,0,1,0,0|1,0,1]=4 42 B9R1.8 CCC[C@@H]1NCCCC1 AK608023 [1,0,0,1,0,0|1,0,1]=4 43 B9R1.8 COCC1CNCCO1 AK119603 [1,0,0,1,0,0|2,0,0]=4 44 B9R1.8 COC[C@@H]1CNCCO1 AK108372 [1,0,0,1,0,0|2,0,0]=4 45 B9R1.8 COC[C@H]1CNCCO1 AK108397 [1,0,0,1,0,0|2,0,0]=4 46 B9R1.8 NCCC1CCCCC1 AK-25118 [1,0,0,1,0,0|1,0,1]=4 47 B9R1.8 NCCN1CCCCC1 AK-45168 [1,0,0,1,0,0|2,0,0]=4 48 B9R1.8 NCCN1CCCCC1 AK-93384 [1,0,0,1,0,0|2,0,0]=4 49 B9R1.8 OCCN1CCOCC1 AK-72501 [1,0,0,1,0,0|2,0,0]=4 50 B9R1.8 OCC[C@@H]1NCCCC1 AK-97234 [1,0,0,1,0,0|1,0,1]=4 51 B9R1.8 OCC[C@@H]1NCCCC1 AK164123 [1,0,0,1,0,0|1,0,1]=4 52 B9R1.8 OCC[C@H]1NCCCC1 AK-41773 [1,0,0,1,0,0|1,0,1]=4 53 B9R1.12 ClCCCC1OCCO1 AK-60697 [1,0,0,1,0,0|2,0,0]=4 54 B9R1.12 N#C\C=C\C1CCCC1 AK175284 [1,0,0,1,0,0|1,0,1]=4 55 B9R1.12 OCCCN1CCCC1 AK-87069 [1,0,0,1,0,0|1,0,1]=4 56 B9R1.15 C(C1N(CCCC1)C)O AK-34053 [1,0,0,1,0,0|1,0,1]=4 57 B9R1.33 OCCC1N(C)CCC1 AK-32182 [1,0,0,1,0,0|1,0,1]=4 58 B9R1.50 OC1CC\C=C/CCC1 AK-79871 [1,0,0,1,0,0|1,0,0]=3 59 B9R1.89 NCC1CCCCCC1 AK110620 [1,0,0,1,0,0|1,0,1]=4 60 B11R1.28 OCCCCC1CCNCC1 AK-83612 [0,1,0,1,0,0|0,0,2]=4 61 B11R1.40 OC[C@@H](N)CC1CCCCC1 AK-57591 [0,1,0,1,0,0|0,0,2]=4