0 B11R0.148 CCCCCCCCCC(=O)Cl SBB060015 [0,0,0,0,0,0|1,0,2]=3 1 B11R0.148 CCCCCCCCCC(=O)O SBB060022 [0,0,0,0,0,0|0,0,2]=2 2 B11R0.148 CCCCCCCCCC(C)=O SBB060389 [0,0,0,0,0,0|1,0,2]=3 3 B11R0.148 CCCCCCCCCC(N)=O SBB061052 [0,0,0,0,0,0|1,0,2]=3 4 B11R0.148 CCCCCCCCOC(C)=O SBB060585 [0,0,0,0,0,0|2,0,2]=4 5 B11R0.148 CCCCSCCCCC(=O)O SBB019267 [0,0,0,0,0,0|1,0,2]=3 6 B10R0.4 CCCCCCCCB(O)O SBB071319 [1,0,0,0,0,0|1,0,2]=4 7 B10R0.4 CCCCCCCCC(=O)Cl SBB060014 [1,0,0,0,0,0|1,0,1]=3 8 B10R0.4 CCCCCCCCC(=O)O SBB058693 [1,0,0,0,0,0|0,0,1]=2 9 B10R0.4 CCCCCCCCC(N)=O SBB061053 [1,0,0,0,0,0|1,0,1]=3 10 B10R0.4 CCCCCCCOC(C)=O SBB060307 [1,0,0,0,0,0|2,0,1]=4 11 B10R0.4 OC(=O)CCCCCCCN SBB006735 [1,0,0,0,0,0|1,0,0]=2 12 B10R0.71 C=CCCCCCCCCBr SBB059351 [1,0,0,0,0,0|1,0,1]=3 13 B10R0.71 C=CCCCCCCCCC SBB009051 [1,0,0,0,0,0|1,0,1]=3 14 B10R0.71 CCCCCCCCCC=O SBB058676 [1,0,0,0,0,0|0,0,2]=3 15 B10R0.71 CCCCCCCCCCO SBB059908 [1,0,0,0,0,0|0,0,3]=4 16 B10R0.71 CCCCCCCCNC=O SBB061176 [1,0,0,0,0,0|1,0,2]=4 17 B10R0.71 OCCCCCCCCCO SBB008482 [1,0,0,0,0,0|1,0,2]=4 18 B12R0.234 C#CCCCCCCCCC(=O)O SBB008483 [0,1,0,0,0,0|0,0,2]=3 19 B12R0.234 C=CCCCCCCCCC(=O)Cl SBB009003 [0,1,0,0,0,0|1,0,0]=2 20 B12R0.234 C=CCCCCCCCCC(=O)O SBB009049 [0,1,0,0,0,0|0,0,0]=1 21 B12R0.234 CCCCCCCCCCC(=O)Cl SBB060536 [0,1,0,0,0,0|1,0,2]=4 22 B12R0.234 CCCCCCCCCCC(=O)O SBB058709 [0,1,0,0,0,0|0,0,2]=3 23 B12R0.234 CCCCCCCCCOC(C)=O SBB060586 [0,1,0,0,0,0|1,0,2]=4 24 B12R0.248 CCCCCCCCCC(=O)NN SBB030321 [0,1,0,0,0,0|1,0,2]=4 25 B12R0.248 CCCCCCCCCC(=O)OC SBB060318 [0,1,0,0,0,0|0,0,2]=3 26 B12R0.268 O=C(O)CCCCCCCC(=O)O SBB060279 [0,1,0,0,0,0|1,0,0]=2 27 B12R0.268 O=C(O)CCSCSCCC(=O)O SBB096675 [0,1,0,0,0,0|3,0,0]=4 28 B12R1.75 CCC1CCCCN1CC(=O)O SBB111674 [0,0,0,1,0,0|1,0,2]=4 29 B12R1.125 CC1CCCCN1CCC(=O)O SBB010526 [0,0,0,1,0,0|1,0,2]=4 30 B12R1.125 O=C(O)CCC1CCCCC1=O SBB010511 [0,0,0,1,0,0|1,0,0]=2 31 B12R1.130 O=C(O)CCCN1CCCC1=O SBB010521 [0,0,0,1,0,0|2,0,0]=3 32 B12R1.210 O=C(O)CN1CCCCCC1=O SBB045206 [0,0,0,1,0,0|2,0,0]=3 33 B12R1.252 O=C(O)CCCC1CCCCN1 SBB014750 [0,0,0,1,0,0|1,0,1]=3 34 B12R1.252 O=C(O)CCCC1CCNCC1 SBB003471 [0,0,0,1,0,0|1,0,2]=4 35 B12R1.252 O=C(O)CCCC1CCNCC1 SBB014751 [0,0,0,1,0,0|1,0,2]=4 36 B12R1.252 O=C([O-])CCCC1CCCCC1 SBB008626 [0,0,0,1,0,0|0,0,3]=4 37 B12R1.255 OC(=O)CCCCC1CCSS1 SBB003484 [0,0,0,1,0,0|2,0,0]=3 38 B12R1.1343 O=C(O)CCN1CCCCCC1 SBB010525 [0,0,0,1,0,0|1,0,2]=4 39 B12R1.1343 O=C(O)CNC1CCCCCC1 SBB046505 [0,0,0,1,0,0|1,0,2]=4 40 B9R0.2 CCCCCCCC(=O)Cl SBB060013 [2,0,0,0,0,0|1,0,0]=3 41 B9R0.2 CCCCCCCC(=O)O SBB060020 [2,0,0,0,0,0|0,0,0]=2 42 B9R0.2 CCCCCCCC(C)=O SBB061540 [2,0,0,0,0,0|1,0,0]=3 43 B9R0.2 CCCCCCCC(C)O SBB008521 [2,0,0,0,0,0|1,0,1]=4 44 B9R0.2 CCCCCCCC(N)=O SBB061055 [2,0,0,0,0,0|1,0,0]=3 45 B9R0.2 CCCCCCOC(C)=O SBB060306 [2,0,0,0,0,0|2,0,0]=4 46 B9R0.2 CCCCSCCC(=O)O SBB001705 [2,0,0,0,0,0|1,0,0]=3 47 B9R0.2 NCCCCCCC(=O)O SBB072673 [2,0,0,0,0,0|1,0,0]=3 48 B9R0.2 O=C(O)CCCCCCO SBB059715 [2,0,0,0,0,0|1,0,0]=3 49 B9R0.45 C=CCCCCCCCC SBB058674 [2,0,0,0,0,0|0,0,1]=3 50 B9R0.45 CCCCCCCCC=O SBB059872 [2,0,0,0,0,0|0,0,1]=3 51 B9R0.45 CCCCCCCCCO SBB059907 [2,0,0,0,0,0|0,0,2]=4 52 B9R0.45 CCCCCCCOC=O SBB060303 [2,0,0,0,0,0|1,0,1]=4 53 B9R0.45 OCCCCCCCCO SBB060739 [2,0,0,0,0,0|1,0,1]=4 54 B11R0.30 CC(=O)NCCCCCC(=O)O SBB065849 [1,1,0,0,0,0|1,0,1]=4 55 B11R0.30 CC(C)CCCCCCC(=O)O SBB088692 [1,1,0,0,0,0|0,0,1]=3 56 B11R0.30 O=C(O)CCCCCCC(=O)O SBB060278 [1,1,0,0,0,0|1,0,0]=3 57 B11R0.40 CCCCCCCCC(=O)NN SBB030320 [1,1,0,0,0,0|1,0,1]=4 58 B11R0.40 CCCCCCCCC(=O)OC SBB060593 [1,1,0,0,0,0|0,0,1]=3 59 B11R0.3 C=CCCCCCCCCCBr SBB059242 [1,1,0,0,0,0|1,0,1]=4 60 B11R0.3 C=CCCCCCCCCCC SBB059886 [1,1,0,0,0,0|1,0,1]=4 61 B11R0.3 C=CCCCCCCCCCO SBB009050 [1,1,0,0,0,0|0,0,1]=3 62 B11R0.3 CCCCCCCCCCC=O SBB059873 [1,1,0,0,0,0|0,0,2]=4 63 B11R0.3 CCCCCCCCCOC=O SBB060304 [1,1,0,0,0,0|0,0,2]=4 64 B13R0.54 CCCCCCCCCCCC(=O)O SBB060023 [0,2,0,0,0,0|0,0,2]=4 65 B13R0.54 CCCCCCCCSCCC(=O)O SBB000583 [0,2,0,0,0,0|0,0,2]=4 66 B13R0.54 CCCCSCCCCCCC(=O)O SBB001713 [0,2,0,0,0,0|0,0,2]=4 67 B13R0.54 NCCCCCCCCCCC(=O)O SBB058716 [0,2,0,0,0,0|0,0,2]=4 68 B13R0.54 O=C(O)CCCCCCCCCCBr SBB061375 [0,2,0,0,0,0|0,0,2]=4 69 B13R0.147 CCCCCCCCCCC(=O)OC SBB060594 [0,2,0,0,0,0|0,0,2]=4 70 B13R0.147 COC(=O)CCCCCCCCC=O SBB061580 [0,2,0,0,0,0|0,0,1]=3 71 B13R0.179 NC(=O)CCCCCCCCC(N)=O SBB060753 [0,2,0,0,0,0|1,0,1]=4 72 B13R0.179 O=C(Cl)CCCCCCCCC(=O)Cl SBB060018 [0,2,0,0,0,0|1,0,1]=4 73 B13R0.179 O=C(O)CCCCCCCCC(=O)O SBB060280 [0,2,0,0,0,0|0,0,1]=3 74 B13R0.2 CCCCCCCCCC(=O)OCC SBB061060 [0,2,0,0,0,0|0,0,2]=4 75 B11R1.86 CC1CCCCN1CC(=O)O SBB046596 [1,0,0,1,0,0|1,0,1]=4 76 B11R1.86 CN1CCCCC1CC(=O)O SBB010391 [1,0,0,1,0,0|1,0,1]=4 77 B11R1.90 O=C(O)CCC1CCOC1=O SBB051506 [1,0,0,1,0,0|2,0,0]=4 78 B11R1.90 O=C(O)CCN1CCCC1=O SBB046364 [1,0,0,1,0,0|2,0,0]=4 79 B11R1.91 O=C(Cl)CCC1CCCCC1 SBB005478 [1,0,0,1,0,0|1,0,1]=4 80 B11R1.91 O=C(O)CCC1CCCCN1 SBB018825 [1,0,0,1,0,0|1,0,0]=3 81 B11R1.91 O=C(O)CCC1CCCNC1 SBB014718 [1,0,0,1,0,0|1,0,1]=4 82 B11R1.172 O=C(O)CCCN1CCCC1 SBB077224 [1,0,0,1,0,0|1,0,1]=4 83 B11R1.172 O=C(O)COCC1CCCO1 SBB010420 [1,0,0,1,0,0|2,0,0]=4 84 B11R1.193 C=CCN1CCCC1C(=O)O SBB046628 [1,0,0,1,0,0|1,0,0]=3 85 B11R1.742 O=C(O)CN1CCCCCC1 SBB010389 [1,0,0,1,0,0|1,0,1]=4 86 B11R1.17 N#CCCC1CCCCC1=O SBB005853 [1,0,0,1,0,0|1,0,1]=4 87 B13R1.1988 O=C(O)CCCN1CCCCCC1 SBB077232 [0,1,0,1,0,0|0,0,2]=4 88 B13R1.167 O=C(O)COCCN1CCCC1=O SBB010753 [0,1,0,1,0,0|2,0,0]=4 89 B13R1.279 O=C1CCCCCCCCCCO1 SBB061611 [0,1,0,1,0,0|0,0,2]=4 90 B13R2.435 O=C(O)C1CC2CCCCC2N1 SBB066619 [0,0,0,2,0,0|1,0,1]=4