0 B10R0.71 C(C=O)=CCCCCCCC HY-W015551 [0,0,0,0,0,0|0,0,2]=2 1 B10R0.71 C=CCCCCCCCCO HY-W105359 [0,0,0,0,0,0|2,0,0]=2 2 B10R0.71 CCCCCCCCCC=O HY-W012570 [0,0,0,0,0,0|0,0,0]=0 3 B10R0.71 CCCCCCCCCCC HY-N8593 [0,0,0,0,0,0|1,0,1]=2 4 B10R0.71 CCCCCCCCCCO HY-Y1004 [0,0,0,0,0,0|0,0,2]=2 5 B10R0.71 CCCCC\C=C\C=C\C=O HY-W013627 [0,0,0,0,0,0|0,0,4]=4 6 B10R0.71 CCCCC\C=C\C=C\C=O HY-W760733 [0,0,0,0,0,0|0,0,4]=4 7 B10R0.71 CSCCCCCCN=C=S HY-W714137 [0,0,0,0,0,0|2,1,1]=4 8 B10R0.71 OCCCCCCCCCBr HY-32083 [0,0,0,0,0,0|1,0,2]=3 9 B9R0.45 C(CC)=CCCCCCO HY-W017558 [1,0,0,0,0,0|0,0,3]=4 10 B9R0.45 C=CCCCCCCCO HY-W127362 [1,0,0,0,0,0|1,0,1]=3 11 B9R0.45 CCCCCCCCC=O HY-N8016 [1,0,0,0,0,0|0,0,0]=1 12 B9R0.45 CCCCCCCCCO HY-W008816 [1,0,0,0,0,0|0,0,1]=2 13 B9R0.45 CCCCCC\C=C\C=O HY-W089800 [1,0,0,0,0,0|0,0,2]=3 14 B9R0.45 CCCCCC\C=C\C=O HY-W089800R [1,0,0,0,0,0|0,0,2]=3 15 B9R0.45 CCCCC\C=C/CCO HY-W127320 [1,0,0,0,0,0|0,0,3]=4 16 B9R0.45 NCCCCNCCCN HY-B1776 [1,0,0,0,0,0|3,0,0]=4 17 B9R0.45 NCCCCNCCCN HY-B1776A [1,0,0,0,0,0|3,0,0]=4 18 B9R0.45 NCCCCNCCCN HY-B1776R [1,0,0,0,0,0|3,0,0]=4 19 B9R0.45 OCCCCCCCCO HY-W017508 [1,0,0,0,0,0|1,0,1]=3 20 B11R0.3 C=CCCCCCCCCC=O HY-W018829 [0,1,0,0,0,0|0,0,1]=2 21 B11R0.3 C=CCCCCCCCCCC HY-W017072 [0,1,0,0,0,0|1,0,0]=2 22 B11R0.3 CCCCCCCCCCCBr HY-122426 [0,1,0,0,0,0|1,0,1]=3 23 B11R0.3 CCCCCCCCCCCC HY-W099602 [0,1,0,0,0,0|1,0,1]=3 24 B11R0.3 CCCCCCCCCCCN HY-W110698 [0,1,0,0,0,0|1,0,1]=3 25 B11R0.3 CCCCCCCCCCCO HY-W004292 [0,1,0,0,0,0|0,0,2]=3 26 B11R0.3 COCCOCCOCCC=O HY-124011 [0,1,0,0,0,0|2,0,0]=3 27 B11R0.3 OCCCCCCCCCCO HY-W016773 [0,1,0,0,0,0|0,0,2]=3 28 B11R0.40 CCCCCCCCC(=O)OC HY-W015308 [0,1,0,0,0,0|2,0,1]=4 29 B11R0.40 CCCCCCCCC(=O)O[Na] HY-W127375 [0,1,0,0,0,0|2,0,1]=4 30 B11R0.81 C=CCOC(=O)CCCCCC HY-W016976 [0,1,0,0,0,0|2,0,1]=4 31 B11R0.148 CCCCCCCCCC(=O)O HY-135087 [0,1,0,0,0,0|0,0,0]=1 32 B11R0.148 CCCCCCCCCC(=O)O HY-W015309 [0,1,0,0,0,0|0,0,0]=1 33 B11R0.148 CCCCCCCCCC(C)=O HY-W016969 [0,1,0,0,0,0|0,0,0]=1 34 B11R0.148 CCCCCCCCCC(C)O HY-115684 [0,1,0,0,0,0|0,0,2]=3 35 B11R0.148 CCCCCCCCOC(C)=O HY-N0308 [0,1,0,0,0,0|1,0,0]=2 36 B11R0.148 CCCCCCC\C=C/C(=O)O HY-13212 [0,1,0,0,0,0|0,0,2]=3 37 B11R0.148 CCCCCCC\C=C\C(=O)O HY-13211 [0,1,0,0,0,0|0,0,2]=3 38 B11R0.148 NCCOCCOCCC(=O)O HY-W040168 [0,1,0,0,0,0|3,0,0]=4 39 B11R0.148 O=C(O)CCCCCCCCBr HY-W007587 [0,1,0,0,0,0|1,0,0]=2 40 B11R0.148 O=C(O)CCOCCOCCBr HY-141362 [0,1,0,0,0,0|3,0,0]=4 41 B11R0.148 O=C(O)CCOCCOCCO HY-124380 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.28 NCCCNC1CCCCC1 HY-W015514 [0,0,0,1,0,0|2,0,1]=4 43 B11R1.99 CCCCCCCCC1CO1 HY-W142702 [0,0,0,1,0,0|0,0,2]=3 44 B8R0.4 C=CCCCCCCO HY-W127366 [2,0,0,0,0,0|1,0,1]=4 45 B8R0.4 CCCCCCCC=O HY-N8015 [2,0,0,0,0,0|0,0,0]=2 46 B8R0.4 CCCCCCCCBr HY-W032015 [2,0,0,0,0,0|1,0,0]=3 47 B8R0.4 CCCCCCCCN HY-W032014 [2,0,0,0,0,0|1,0,0]=3 48 B8R0.4 CCCCCCCCO HY-W032013 [2,0,0,0,0,0|0,0,1]=3 49 B8R0.4 CCCCSCCCC HY-W250123 [2,0,0,0,0,0|1,0,0]=3 50 B8R0.4 COCCOCCC=O HY-W1049075C [2,0,0,0,0,0|2,0,0]=4 51 B8R0.4 NCCCCCCCN HY-W008821 [2,0,0,0,0,0|2,0,0]=4 52 B8R0.4 OCCCCCCCBr HY-W008425 [2,0,0,0,0,0|1,0,1]=4 53 B10R0.1 CCCCCCC(O)CCC HY-W275553 [1,1,0,0,0,0|0,0,1]=3 54 B10R0.4 CCCCCCCCC(=O)O HY-N7057 [1,1,0,0,0,0|0,0,0]=2 55 B10R0.4 CCCCCCCOC(C)=O HY-W099503 [1,1,0,0,0,0|1,0,0]=3 56 B10R0.4 NCCCCCCCC(=O)O HY-W018678 [1,1,0,0,0,0|1,0,0]=3 57 B12R0.5 C#CCCCCCCCCCCO HY-W007273 [0,2,0,0,0,0|0,0,2]=4 58 B12R0.5 CCCCCCCCCCCC=O HY-W004301 [0,2,0,0,0,0|0,0,0]=2 59 B12R0.5 CCCCCCCCCCCCBr HY-W008758 [0,2,0,0,0,0|1,0,1]=4 60 B12R0.5 CCCCCCCCCCCCC HY-W088037 [0,2,0,0,0,0|1,0,1]=4 61 B12R0.5 CCCCCCCCCCCCO HY-Y0289 [0,2,0,0,0,0|0,0,2]=4 62 B12R0.5 CCCCCCCCCCCCO HY-Y0289R [0,2,0,0,0,0|0,0,2]=4 63 B12R0.5 CCCCCCOCCOCCO HY-W133950 [0,2,0,0,0,0|0,0,2]=4 64 B12R0.5 CCC\C=C/CCCCCCCO HY-W108418 [0,2,0,0,0,0|0,0,2]=4 65 B12R0.234 C=CCCCCCCCCC(=O)O HY-B0914R [0,2,0,0,0,0|0,0,1]=3 66 B12R0.234 C=CCCCCCCCCC(=O)[O-] HY-B0914A [0,2,0,0,0,0|0,0,1]=3 67 B12R0.234 CC(=O)NCCCCNCCCN HY-113253A [0,2,0,0,0,0|2,0,0]=4 68 B12R0.234 CCCCCCCCCCC(=O)O HY-W004282 [0,2,0,0,0,0|0,0,0]=2 69 B12R0.234 CCCCCCCCCCC(=O)O HY-W004282R [0,2,0,0,0,0|0,0,0]=2 70 B12R0.234 CCCCCCCC\C=C\C(=O)O HY-133022 [0,2,0,0,0,0|0,0,1]=3 71 B12R0.234 COCCOCCOCCC(=O)O HY-W043725 [0,2,0,0,0,0|2,0,0]=4 72 B12R0.234 NCCCCCCCCCC(=O)O HY-W105744 [0,2,0,0,0,0|0,0,0]=2 73 B12R0.234 NCCOCCOCCCC(=O)O HY-140190 [0,2,0,0,0,0|2,0,0]=4 74 B12R0.234 O=C(O)CCCCCCCCCBr HY-W013381 [0,2,0,0,0,0|0,0,0]=2 75 B12R0.234 O=C(O)CCCCCCCCCO HY-Y0148 [0,2,0,0,0,0|0,0,0]=2 76 B12R0.234 O=C(O)\C=C\CCCCCCCO HY-N1363 [0,2,0,0,0,0|0,0,2]=4 77 B12R0.234 O=C(O)\C=C\CCCCCCCO HY-W592871 [0,2,0,0,0,0|0,0,2]=4 78 B12R0.248 CCCCCCCCCC(=O)OC HY-W016172 [0,2,0,0,0,0|0,0,0]=2 79 B12R0.248 CCCCCCCCCC(=O)O[Na] HY-115340 [0,2,0,0,0,0|0,0,0]=2 80 B12R0.4 CCCCCCCC(O)CC(=O)O HY-113057 [0,2,0,0,0,0|0,0,0]=2 81 B12R0.277 CCOC(=O)CCCCCC(=O)O HY-W016087 [0,2,0,0,0,0|1,0,1]=4 82 B12R0.184 COC(=O)CCCCCCC(=O)O HY-W001958 [0,2,0,0,0,0|1,0,1]=4 83 B12R0.268 O=C(O)CCCCCCCC(=O)O HY-B0704 [0,2,0,0,0,0|1,0,1]=4 84 B10R1.17 BrCCOC1CCCCC1 HY-W092895 [1,0,0,1,0,0|2,0,0]=4 85 B12R1.28 CCCCCC1CC=CC(=O)O1 HY-N7435 [0,1,0,1,0,0|0,0,2]=4 86 B12R1.28 CCCCCC1CCCC(=O)O1 HY-W016979 [0,1,0,1,0,0|0,0,0]=2 87 B12R1.308 CCOC(=O)C1CCCCC1=O HY-75062 [0,1,0,1,0,0|1,0,1]=4 88 B12R1.7 CCCCCCC1CCC(=O)O1 HY-N7105 [0,1,0,1,0,0|0,0,0]=2 89 B12R1.567 CCCCCC1=C(C)CCC1=O HY-N7098 [0,1,0,1,0,0|0,0,2]=4 90 B12R1.255 NC(=O)CCCCC1CCSS1 HY-B1142 [0,1,0,1,0,0|2,0,0]=4 91 B12R1.255 O=C(O)CCCCC1CCSS1 HY-N0492 [0,1,0,1,0,0|2,0,0]=4 92 B12R1.255 O=C(O)CCCC[C@@H]1CCSS1 HY-18733 [0,1,0,1,0,0|2,0,0]=4 93 B12R1.255 O=C(O)CCCC[C@@H]1CCSS1 HY-18733R [0,1,0,1,0,0|2,0,0]=4 94 B12R1.255 O=C(O)CCCC[C@H]1CCSS1 HY-W014590 [0,1,0,1,0,0|2,0,0]=4 95 B12R2.41 C1CCC2=NCCCN2CC1 HY-20556 [0,0,0,2,0,0|2,0,0]=4