0 B11R0.6 CC(=O)\C=C(/C)CCC=C(C)C Amb17594144 [0,0,0,0,0,0|1,0,0]=1 1 B11R0.6 CC(=O)\C=C(C)\C=C\C=C(C)C Amb27970177 [0,0,0,0,0,0|1,0,2]=3 2 B11R0.6 CC(=O)\C=C(O)\C=C/C=C(C)C Amb27190798 [0,0,0,0,0,0|2,0,2]=4 3 B11R0.6 CC(C)=CCCC(C)CC(=O)O Amb2720520 [0,0,0,0,0,0|0,0,2]=2 4 B11R0.6 CC(C)=CCC\C(C)=C/C(=O)O Amb30666639 [0,0,0,0,0,0|0,0,0]=0 5 B11R0.6 CC(C)CCCC(C)CC(=O)O Amb32412878 [0,0,0,0,0,0|0,0,4]=4 6 B10R0.3 C=C(C)CCC\C(C)=C/C=O Amb533699 [1,0,0,0,0,0|0,0,2]=3 7 B10R0.3 C=C\C=C(/C)CCC=C(C)C Amb32693432 [1,0,0,0,0,0|1,0,0]=2 8 B10R0.3 CC(C)=CC#C\C(C)=C/C=O Amb27209107 [1,0,0,0,0,0|0,0,2]=3 9 B10R0.3 CC(C)=CC#C\C(C)=C\CO Amb27642124 [1,0,0,0,0,0|0,0,3]=4 10 B10R0.3 CC(C)=CCCC(=O)\C=C\O Amb27673797 [1,0,0,0,0,0|1,0,0]=2 11 B10R0.3 CC(C)=CCCC(=O)\C=N\O Amb28080258 [1,0,0,0,0,0|2,0,0]=3 12 B10R0.3 CC(C)=CCCC(C)CC=O Amb4004570 [1,0,0,0,0,0|0,0,2]=3 13 B10R0.3 CC(C)=CCCC(C)CCO Amb532963 [1,0,0,0,0,0|0,0,3]=4 14 B10R0.3 CC(C)=CCCC(C)NC=O Amb539281 [1,0,0,0,0,0|1,0,1]=3 15 B10R0.3 CC(C)=CCC[C@@H](C)CCO Amb571421 [1,0,0,0,0,0|0,0,3]=4 16 B10R0.3 CC(C)=CCC[C@H](C)CCO Amb17611216 [1,0,0,0,0,0|0,0,3]=4 17 B10R0.3 CC(C)=CCC\C(C)=C/CO Amb8384575 [1,0,0,0,0,0|0,0,1]=2 18 B10R0.3 CC(C)=CCC\C(C)=C\C#N Amb534859 [1,0,0,0,0,0|1,0,1]=3 19 B10R0.3 CC(C)=CCC\C(C)=C\C=O Amb2719644 [1,0,0,0,0,0|0,0,0]=1 20 B10R0.3 CC(C)=CCC\C(C)=C\CBr Amb3940212 [1,0,0,0,0,0|1,0,1]=3 21 B10R0.3 CC(C)=CCC\C(C)=C\CCl Amb26992970 [1,0,0,0,0,0|1,0,1]=3 22 B10R0.3 CC(C)=CCC\C(C)=C\CN Amb3941440 [1,0,0,0,0,0|1,0,1]=3 23 B10R0.3 CC(C)=CCC\C(C)=C\CO Amb26656122 [1,0,0,0,0,0|0,0,1]=2 24 B10R0.3 CC(C)=CCC\C(C)=C\CS Amb22168517 [1,0,0,0,0,0|0,1,1]=3 25 B10R0.3 CC(C)=CCC\C(Cl)=C\CO Amb28080028 [1,0,0,0,0,0|1,0,1]=3 26 B10R0.3 CC(C)=CC\C=C(/C)CC=O Amb25384468 [1,0,0,0,0,0|0,0,2]=3 27 B10R0.3 CC(C)=C\C=C\C(C)=C\C=O Amb18125167 [1,0,0,0,0,0|0,0,2]=3 28 B10R0.3 CO\N=C(\C)CCC=C(C)C Amb27988825 [1,0,0,0,0,0|3,0,0]=4 29 B10R0.3 C\C(=C\CO)C\C=C\C(C)C Amb28079970 [1,0,0,0,0,0|0,0,3]=4 30 B10R0.3 C\C=C/C(=O)CCC=C(C)C Amb27672391 [1,0,0,0,0,0|2,0,0]=3 31 B10R0.3 C\C=C\C(=O)CCC=C(C)C Amb27673578 [1,0,0,0,0,0|2,0,0]=3 32 B10R0.6 CC#CCC\C(C)=C/C(=O)O Amb27666778 [1,0,0,0,0,0|0,0,2]=3 33 B10R0.6 C\C=C/CC\C(O)=C\C(C)=O Amb27673601 [1,0,0,0,0,0|2,0,0]=3 34 B10R0.6 C\C=C\C=C\C(C)=C\C(C)=O Amb27256364 [1,0,0,0,0,0|1,0,2]=4 35 B10R0.6 C\C=C\CNC(=O)CC(=O)O Amb28387913 [1,0,0,0,0,0|2,0,1]=4 36 B10R0.97 CC(=O)C\C=C/CC=C(C)C Amb27672672 [1,0,0,0,0,0|1,0,2]=4 37 B10R0.97 CC(=O)C\C=C\CC=C(C)C Amb27672619 [1,0,0,0,0,0|1,0,2]=4 38 B10R0.97 CC(=O)\C=C/CCC=C(C)C Amb27672366 [1,0,0,0,0,0|1,0,0]=2 39 B10R0.97 CC(C)=CCCC#CC(=O)O Amb27760375 [1,0,0,0,0,0|0,0,2]=3 40 B10R0.97 CC(C)=CCC\C=C\C(=O)O Amb18125771 [1,0,0,0,0,0|0,0,0]=1 41 B10R0.97 CC(C)=CCC\C=C\C(C)O Amb27989623 [1,0,0,0,0,0|1,0,1]=3 42 B10R0.97 CC(C)=CCN\C=C\C(=O)O Amb28365686 [1,0,0,0,0,0|1,0,0]=2 43 B10R0.97 CC(C)=C\C=C\C=C\C(=O)O Amb28396656 [1,0,0,0,0,0|0,0,2]=3 44 B10R0.97 CC(C)=NOC\C=C\C(=O)O Amb27988402 [1,0,0,0,0,0|2,0,0]=3 45 B10R0.97 O=C(O)\C=C\NCC=C(Cl)Cl Amb35683851 [1,0,0,0,0,0|3,0,0]=4 46 B12R1.101 CC(=O)CC1CC(O)=CC(=O)O1 Amb27164625 [0,0,0,1,0,0|2,0,1]=4 47 B12R1.101 CC(C)=CC1=CC(C)=CC(=O)O1 Amb19133179 [0,0,0,1,0,0|0,0,2]=3 48 B12R1.105 CC(C)=CCCC1=CC(Cl)CC1 Amb35744298 [0,0,0,1,0,0|2,0,1]=4 49 B12R1.105 CC(C)=CCCC1=CC(N)CC1 Amb35738216 [0,0,0,1,0,0|2,0,1]=4 50 B12R1.105 CC(C)=CCCC1=CC(O)CC1 Amb35738240 [0,0,0,1,0,0|1,0,1]=3 51 B12R1.105 CC(C)=CCCC1CCC(=O)C1 Amb35738459 [0,0,0,1,0,0|1,0,2]=4 52 B12R1.105 CC(C)=CCCN1CCC(=O)C1 Amb27235998 [0,0,0,1,0,0|2,0,1]=4 53 B12R1.105 CC(C)=CCCc1cc(C)ns1 Amb30023877 [0,0,0,1,0,0|3,0,0]=4 54 B12R1.105 CC(C)=CCCc1cc(N)no1 Amb25337621 [0,0,0,1,0,0|3,0,0]=4 55 B12R1.105 CC(C)=CCCc1csc(C)c1 Amb35582923 [0,0,0,1,0,0|1,1,1]=4 56 B12R1.389 CC(C)=C1CCC(CC(=O)O)C1 Amb27178211 [0,0,0,1,0,0|0,0,2]=3 57 B12R1.389 CC(C)C1C\C(=C\C(=O)O)CO1 Amb35607387 [0,0,0,1,0,0|1,0,2]=4 58 B12R1.389 CC(C)N1CC\C(=C/C(=O)O)C1 Amb28256159 [0,0,0,1,0,0|1,0,1]=3 59 B12R1.498 C=C(C)C1CCC(C)=C1C(C)=O Amb27614498 [0,0,0,1,0,0|1,0,2]=4 60 B12R1.498 C=C(C)[C@@H]1CCC(C)=C1C(C)=O Amb24471700 [0,0,0,1,0,0|1,0,2]=4 61 B12R1.498 CC(=O)C1=C(C(C)=O)C(=O)CC1 Amb28321928 [0,0,0,1,0,0|3,0,0]=4 62 B12R1.498 CC(=O)[C@H]1C(=C(C)C)CC[C@@H]1C Amb28321903 [0,0,0,1,0,0|1,0,2]=4 63 B12R1.498 CC(=O)c1onc(C)c1C(=O)O Amb28351423 [0,0,0,1,0,0|3,0,0]=4 64 B12R1.498 CC(C)=C1CCC(C)C1C(=O)Cl Amb25951617 [0,0,0,1,0,0|1,0,2]=4 65 B12R1.498 CC(C)=C1CCC(C)C1C(=O)O Amb18647051 [0,0,0,1,0,0|0,0,2]=3 66 B12R1.498 CC(C)=C1CC[C@@H](C)C1C(=O)O Amb28396670 [0,0,0,1,0,0|0,0,2]=3 67 B12R1.498 CC(C)=C1CC[C@@H](C)[C@@H]1C(=O)Cl Amb27255413 [0,0,0,1,0,0|1,0,2]=4 68 B12R1.498 CC(C)=C1CC[C@@H](C)[C@@H]1C(=O)O Amb6360014 [0,0,0,1,0,0|0,0,2]=3 69 B12R1.498 CC(C)=C1CC[C@H](C)[C@H]1C(=O)O Amb10605331 [0,0,0,1,0,0|0,0,2]=3 70 B12R1.498 CC1=C(C(=O)O)C(C(=O)O)CC1 Amb4014265 [0,0,0,1,0,0|2,0,1]=4 71 B12R1.498 CC1=C(C(=O)O)C(C(C)C)CC1 Amb27597068 [0,0,0,1,0,0|0,0,2]=3 72 B12R1.498 CC1=C(C(=O)O)[C@@H](C(C)C)CC1 Amb27955115 [0,0,0,1,0,0|0,0,2]=3 73 B12R1.498 C[C@@H]1CCC(C(=O)O)=C1C(=O)O Amb27616943 [0,0,0,1,0,0|2,0,1]=4 74 B12R1.498 Cc1coc(C(C)C)c1C(=O)O Amb33152144 [0,0,0,1,0,0|1,0,2]=4 75 B12R1.498 Cc1noc(C(C)C)c1C(=O)O Amb440286 [0,0,0,1,0,0|2,0,1]=4 76 B12R1.498 Cc1nsc(C(C)C)c1C(=O)O Amb26970080 [0,0,0,1,0,0|2,0,1]=4 77 B12R1.498 Cc1onc(C(C)C)c1C(=O)O Amb5400515 [0,0,0,1,0,0|2,0,1]=4 78 B12R1.498 Cc1onc(N(C)C)c1C(=O)O Amb18825734 [0,0,0,1,0,0|3,0,0]=4 79 B12R1.861 CC(=O)OCC1CC(=O)C=C1C Amb28351575 [0,0,0,1,0,0|3,0,0]=4 80 B12R1.861 CC(C)=CCC1NC(=O)CC1C Amb27758065 [0,0,0,1,0,0|1,0,2]=4 81 B12R1.861 CC(C)=CC[C@@H]1NC(=O)C[C@@H]1C Amb28074167 [0,0,0,1,0,0|1,0,2]=4 82 B12R1.861 CC(C)=CC[C@H]1CC(=O)C[C@H]1C Amb28285846 [0,0,0,1,0,0|1,0,2]=4 83 B12R1.861 CC(C)=CCn1nc(C)cc1C Amb28367255 [0,0,0,1,0,0|3,0,0]=4 84 B12R1.861 CC(C)=CCn1nc(N)cc1C Amb24416198 [0,0,0,1,0,0|3,0,0]=4 85 B12R1.1020 CC1CCC\C(=C\C(=O)O)CC1 Amb33468165 [0,0,0,1,0,0|0,0,2]=3 86 B12R1.1020 CN1CCC\C(=C\C(=O)O)CC1 Amb33468659 [0,0,0,1,0,0|1,0,1]=3 87 B12R1.1061 C=C1CN(C\C(C)=C\C(=O)O)C1 Amb35605528 [0,0,0,1,0,0|1,0,2]=4 88 B12R1.1061 C\C(=C/C(=O)O)CN1CC(C)C1 Amb35582506 [0,0,0,1,0,0|1,0,2]=4 89 B12R1.1218 C=C(C)[C@@H]1CCC(C)=CC(=O)C1 Amb28202247 [0,0,0,1,0,0|1,0,2]=4 90 B12R1.1218 CC(C)=C1CCC(C)CC(=O)C1 Amb27164662 [0,0,0,1,0,0|1,0,2]=4 91 B12R1.1258 CC(=O)C1=C(C)CC=CC1(C)C Amb25837311 [0,0,0,1,0,0|1,0,2]=4 92 B12R1.1258 CC1=C(C(=O)Cl)C(C)(C)CCC1 Amb22358975 [0,0,0,1,0,0|1,0,2]=4 93 B12R1.1390 CC(=O)C[C@]1(C)C[C@H]1C=C(C)C Amb28142305 [0,0,0,1,0,0|1,0,2]=4 94 B12R1.1821 CC1(C)CCC\C(=C/C(=O)O)C1 Amb27174965 [0,0,0,1,0,0|0,0,2]=3 95 B12R1.1821 CC1(C)CCC\C(=C\C(=O)O)C1 Amb26371590 [0,0,0,1,0,0|0,0,2]=3 96 B12R1.1821 CC1(C)CSC\C(=C/C(=O)O)C1 Amb27268228 [0,0,0,1,0,0|1,0,2]=4 97 B12R1.1821 CC1(C)C\C(=C\C(N)=O)CCO1 Amb27865630 [0,0,0,1,0,0|2,0,1]=4 98 B10R0.96 C=C(C)C\C=C(\C)CC(=O)O Amb25386397 [0,0,0,0,1,0|0,0,3]=4 99 B10R0.96 CC(=C\C(=O)O)\C=C\C(N)=O Amb27666863 [0,0,0,0,1,0|2,0,1]=4 100 B10R0.96 CC(=C\C(N)=O)\C=C\C(C)C Amb28383210 [0,0,0,0,1,0|1,0,2]=4 101 B10R0.96 CC(=O)CCC(C)CC(=O)O Amb32668383 [0,0,0,0,1,0|1,0,2]=4 102 B10R0.96 CC(=O)\C=C(/C)OCC(C)C Amb27673807 [0,0,0,0,1,0|2,0,1]=4 103 B10R0.96 CC(=O)\C=C(\C)NCC(C)C Amb28351441 [0,0,0,0,1,0|2,0,1]=4 104 B10R0.96 CC(C)CCC(C)CC(=O)O Amb6749235 [0,0,0,0,1,0|0,0,3]=4 105 B10R0.96 CC(CCN(C)C)CC(=O)O Amb33473550 [0,0,0,0,1,0|1,0,2]=4 106 B10R0.96 CC(\C=C\C(C)C)=C/C(=O)O Amb28396597 [0,0,0,0,1,0|0,0,2]=3 107 B10R0.96 CC(\C=C\C(C)C)=C/C(N)=O Amb27653067 [0,0,0,0,1,0|1,0,2]=4 108 B10R0.96 C\C(=C/CC(C)C)CC(=O)O Amb27990212 [0,0,0,0,1,0|0,0,3]=4 109 B10R0.96 C\C(O)=C\C(=O)CCC(C)C Amb24766964 [0,0,0,0,1,0|2,0,1]=4 110 B10R0.98 C=C(CCC=C(C)C)[C@H](C)O Amb28079969 [0,0,0,0,1,0|1,0,2]=4 111 B10R0.98 C=C(CON=C(C)C)C(=O)O Amb27988407 [0,0,0,0,1,0|2,0,1]=4 112 B10R0.98 CC(=O)NCCC(C)C(=O)O Amb27270987 [0,0,0,0,1,0|2,0,1]=4 113 B10R0.98 CC(=O)NC\C=C(\C)C(=O)O Amb35584803 [0,0,0,0,1,0|2,0,1]=4 114 B10R0.98 CC(C)=CCCC(C)C(C)O Amb539918 [0,0,0,0,1,0|1,0,2]=4 115 B10R0.98 CC(C)=CCCC(N)C(=O)O Amb27001257 [0,0,0,0,1,0|1,0,1]=3 116 B10R0.98 CC(C)=CCCC(N)C(N)=O Amb33065941 [0,0,0,0,1,0|2,0,1]=4 117 B10R0.98 CC(C)=CCC[C@@H](N)C(=O)O Amb33065465 [0,0,0,0,1,0|1,0,1]=3 118 B10R0.98 CC(C)=CCC[C@H](N)C(=O)O Amb25383796 [0,0,0,0,1,0|1,0,1]=3 119 B10R0.98 CC(C)=CCNC(=O)C(=O)O Amb27780006 [0,0,0,0,1,0|2,0,0]=3 120 B10R0.98 CC(C)=CCNC(C)C(=O)O Amb9327033 [0,0,0,0,1,0|1,0,1]=3 121 B10R0.98 CC(C)=CCNC(C)C(N)=O Amb27271266 [0,0,0,0,1,0|2,0,1]=4 122 B10R0.98 CC(C)=CCN[C@@H](C)C(N)=O Amb28387009 [0,0,0,0,1,0|2,0,1]=4 123 B10R0.98 CC(C)=CCO[C@@H](C)C(=O)O Amb27986311 [0,0,0,0,1,0|1,0,1]=3 124 B10R0.98 CC(C)=CCO[C@H](C)C(=O)O Amb27986312 [0,0,0,0,1,0|1,0,1]=3 125 B10R0.98 CC(C)=CCSC(C)C(=O)O Amb6262866 [0,0,0,0,1,0|1,0,1]=3 126 B10R0.98 CC(C)=CC\C=C(/C)C(C)O Amb27602942 [0,0,0,0,1,0|1,0,2]=4 127 B10R0.98 CC(C)=CC\C=C(/C)[C@@H](C)O Amb26942029 [0,0,0,0,1,0|1,0,2]=4 128 B10R0.98 CC(C)=CC\C=C(/C)[C@H](C)O Amb25725447 [0,0,0,0,1,0|1,0,2]=4 129 B10R0.98 CC(C)=CSCC(N)C(=O)O Amb25386034 [0,0,0,0,1,0|2,0,1]=4 130 B10R0.98 CC(C)=C\C=C\C(C)C(=O)O Amb26493314 [0,0,0,0,1,0|0,0,3]=4 131 B10R0.98 CC(C)CCCC(=O)C(=O)O Amb18126138 [0,0,0,0,1,0|1,0,2]=4 132 B10R0.98 CC(C)CCCC(C)C(=O)O Amb33358621 [0,0,0,0,1,0|0,0,3]=4 133 B10R0.98 CC(C)CCC[C@@H](C)C(=O)O Amb33727257 [0,0,0,0,1,0|0,0,3]=4 134 B10R0.98 CC(C)CCC[C@H](C)C(=O)O Amb33744631 [0,0,0,0,1,0|0,0,3]=4 135 B10R0.98 CC(C)OCCC(=O)C(=O)O Amb33274846 [0,0,0,0,1,0|2,0,1]=4 136 B10R0.98 CC(C)OCCC(C)C(=O)O Amb18792223 [0,0,0,0,1,0|1,0,2]=4 137 B10R0.98 CC(CCCN(C)C)C(=O)O Amb33359292 [0,0,0,0,1,0|1,0,2]=4 138 B10R0.98 CN(C)CCCC(=O)C(=O)O Amb33273731 [0,0,0,0,1,0|2,0,1]=4 139 B10R0.98 C\C(=C\CNN(C)C)C(=O)O Amb28386738 [0,0,0,0,1,0|2,0,1]=4 140 B10R0.98 C\C(=C\COC(C)C)C(=O)O Amb28387090 [0,0,0,0,1,0|1,0,2]=4 141 B10R0.98 C\C(=C\CSC(C)C)C(=O)O Amb28387067 [0,0,0,0,1,0|1,0,2]=4 142 B12R0.44 CC(C)=CCC\C(C)=N\NC(N)=O Amb17843492 [0,0,0,0,0,1|2,0,0]=3 143 B9R0.1 C=C(CO)CCC=C(C)C Amb27839217 [2,0,0,0,0,0|0,0,2]=4 144 B9R0.1 C=CC(=C)CCC=C(C)C Amb3940941 [2,0,0,0,0,0|0,0,1]=3 145 B9R0.1 C=CC(O)CCC=C(C)C Amb27261714 [2,0,0,0,0,0|1,0,1]=4 146 B9R0.1 C=C[C@@H](C)CCC=C(C)C Amb22353105 [2,0,0,0,0,0|0,0,1]=3 147 B9R0.1 C=C[C@H](C)CCC=C(C)C Amb22353149 [2,0,0,0,0,0|0,0,1]=3 148 B9R0.1 C=C[C@H](O)CCC=C(C)C Amb27403008 [2,0,0,0,0,0|1,0,1]=4 149 B9R0.1 C=C\C(C)=C\CC=C(C)C Amb6366412 [2,0,0,0,0,0|0,0,1]=3 150 B9R0.1 CC(C)=CCCC(C)C=O Amb3940426 [2,0,0,0,0,0|0,0,1]=3 151 B9R0.1 CC(C)=CCC[C@H](C)C=O Amb27876463 [2,0,0,0,0,0|0,0,1]=3 152 B9R0.1 CC(C)=CCC[C@H](C)CO Amb27603484 [2,0,0,0,0,0|0,0,2]=4 153 B9R0.1 CC(C)=CCC\C(C)=C\Cl Amb27435214 [2,0,0,0,0,0|1,0,0]=3 154 B9R0.1 CC(C)=CCC\C(C)=C\O Amb28050727 [2,0,0,0,0,0|0,0,0]=2 155 B9R0.1 CC(C)=CC\C=C(/C)CO Amb27480674 [2,0,0,0,0,0|0,0,2]=4 156 B9R0.1 C\C=C(/C)CCC=C(C)C Amb29565318 [2,0,0,0,0,0|0,0,1]=3 157 B9R0.1 C\C=C(\C)CCC=C(C)C Amb26027238 [2,0,0,0,0,0|0,0,1]=3 158 B9R0.2 C=C(C)CCC\C=C\C=O Amb18643313 [2,0,0,0,0,0|0,0,2]=4 159 B9R0.2 CC(C)=CCCCCC=O Amb18643636 [2,0,0,0,0,0|0,0,2]=4 160 B9R0.2 CC(C)=CCCOCC=O Amb28290541 [2,0,0,0,0,0|1,0,1]=4 161 B9R0.2 CC(C)=CCC\C=C\C=O Amb18643301 [2,0,0,0,0,0|0,0,0]=2 162 B9R0.2 CC(C)=C\C=C\C=C\C=O Amb28287071 [2,0,0,0,0,0|0,0,2]=4 163 B9R0.2 C\C=C\C=C\C=C\C(=O)O Amb3987814 [2,0,0,0,0,0|0,0,2]=4 164 B9R0.2 C\C=C\CCCCC(=O)O Amb18643887 [2,0,0,0,0,0|0,0,2]=4 165 B9R0.2 C\C=C\CCOCC(=O)O Amb28340908 [2,0,0,0,0,0|1,0,1]=4 166 B9R0.5 C=CCCC\C(C)=C/C=O Amb27489044 [2,0,0,0,0,0|0,0,2]=4 167 B9R0.5 CC#CCC\C(C)=C\C=O Amb28129797 [2,0,0,0,0,0|0,0,2]=4 168 B9R0.5 CCCCC\C(C)=C\C=O Amb27841277 [2,0,0,0,0,0|0,0,2]=4 169 B9R0.5 C\C=C/CCC(C)CC=O Amb27751342 [2,0,0,0,0,0|0,0,2]=4 170 B9R0.5 C\C=C\CCC(C)CC=O Amb27849050 [2,0,0,0,0,0|0,0,2]=4 171 B9R0.5 C\C=C\CC\C(C)=C/C=O Amb27643406 [2,0,0,0,0,0|0,0,0]=2 172 B9R0.5 C\C=C\CC\C(C)=C\C=O Amb18643316 [2,0,0,0,0,0|0,0,0]=2 173 B9R0.5 C\C=C\CC\C(C)=C\CBr Amb27196181 [2,0,0,0,0,0|1,0,1]=4 174 B9R0.4 C=CCC[C@@H](C)CC(=O)O Amb27390713 [2,0,0,0,0,0|0,0,2]=4 175 B9R0.4 C=CCC\C(C)=C/C(=O)O Amb25242614 [2,0,0,0,0,0|0,0,0]=2 176 B9R0.4 C=CCC\C(C)=C\C(=O)O Amb18643565 [2,0,0,0,0,0|0,0,0]=2 177 B9R0.4 C=CCC\C(C)=C\C(C)=O Amb28321975 [2,0,0,0,0,0|1,0,0]=3 178 B9R0.4 C=CCC\C(O)=C\C(C)=O Amb28322008 [2,0,0,0,0,0|2,0,0]=4 179 B9R0.4 C=CCN\C(C)=C/C(C)=O Amb26993220 [2,0,0,0,0,0|2,0,0]=4 180 B9R0.4 C=CCO\C(C)=C/C(C)=O Amb27457510 [2,0,0,0,0,0|2,0,0]=4 181 B9R0.4 CC(\C=C\C=O)=C/C(=O)O Amb27663875 [2,0,0,0,0,0|1,0,1]=4 182 B9R0.4 CCCC\C(Br)=C/C(=O)O Amb27622154 [2,0,0,0,0,0|1,0,1]=4 183 B9R0.4 CCCC\C(C)=C\C(=O)O Amb25929028 [2,0,0,0,0,0|0,0,1]=3 184 B9R0.4 CC\C=C\C(C)=C\C(=O)O Amb35734787 [2,0,0,0,0,0|0,0,2]=4 185 B9R0.4 COCO\C(C)=C\C(=O)O Amb28203934 [2,0,0,0,0,0|2,0,0]=4 186 B9R0.4 CONC\C(C)=C\C(=O)O Amb27758465 [2,0,0,0,0,0|2,0,0]=4 187 B9R0.4 C\C(=C/C(=O)O)CCCBr Amb27801009 [2,0,0,0,0,0|1,0,1]=4 188 B9R0.4 C\C(=C\C(=O)O)CCCCl Amb18126354 [2,0,0,0,0,0|1,0,1]=4 189 B11R0.59 CC(C)=CCC(C)\C(C)=C\CO Amb32668490 [1,1,0,0,0,0|0,0,1]=3 190 B11R0.145 CC(C)=CCCC(C)C(C)C=O Amb32661016 [1,1,0,0,0,0|0,0,2]=4 191 B11R0.145 CC(C)=CCC\C(C)=C(/C)CO Amb32664142 [1,1,0,0,0,0|0,0,1]=3 192 B11R0.145 CC(C)=C\C=C\C(C)=C(\C)C=O Amb27433102 [1,1,0,0,0,0|0,0,2]=4 193 B11R0.147 COC\C=C(\C)CCC=C(C)C Amb22756893 [1,1,0,0,0,0|0,0,1]=3 194 B11R0.174 CC\C(C)=C\CC\C(C)=C\CO Amb32650227 [1,1,0,0,0,0|0,0,1]=3 195 B11R0.2 COCCOC\C(C)=C\C(=O)O Amb32664148 [1,1,0,0,0,0|1,0,1]=4 196 B11R0.154 CCCCC\C(C)=C\C(=O)OC Amb33472157 [1,1,0,0,0,0|0,0,2]=4 197 B11R0.29 CC(C)N(C)CC\C=C\C(=O)O Amb33273826 [1,1,0,0,0,0|1,0,1]=4 198 B11R0.33 CC(=O)\C(C)=C\C(C)=C\C(=O)O Amb35691762 [0,1,0,0,1,0|1,0,1]=4 199 B11R0.93 COC(=O)\C=C(/C)CCC(C)C Amb33472125 [0,1,0,0,1,0|0,0,1]=3 200 B11R0.337 CC(=C\C(=O)O)\C=C\C(C)(C)C Amb35691764 [0,1,0,0,1,0|0,0,2]=4 201 B11R0.337 CC(=C\C(=O)O)\C=C\[Si](C)(C)C Amb27983671 [0,1,0,0,1,0|0,1,1]=4 202 B11R0.150 CC(C)=C(C)CCC(N)C(=O)O Amb33308686 [0,1,0,0,1,0|1,0,1]=4 203 B11R0.150 CC(C)=C(C)CC[C@@H](N)C(=O)O Amb33066034 [0,1,0,0,1,0|1,0,1]=4 204 B11R0.150 CC(C)=C(C)CC[C@H](N)C(=O)O Amb33309186 [0,1,0,0,1,0|1,0,1]=4 205 B13R0.605 COC(\C=C(/C)CCC=C(C)C)OC Amb10071525 [0,2,0,0,0,0|0,0,2]=4 206 B11R1.64 C=C(C)[C@H]1CCC(C)=C1C=O Amb27176365 [1,0,0,1,0,0|0,0,2]=4 207 B11R1.64 CC(C)=C1CC[C@@H](C)[C@H]1C=O Amb26388583 [1,0,0,1,0,0|0,0,2]=4 208 B11R1.64 CC1=C(C=O)C(C(C)C)CC1 Amb18125483 [1,0,0,1,0,0|0,0,2]=4 209 B11R1.64 CC1=C(C=O)[C@@H](C(C)C)CC1 Amb28071201 [1,0,0,1,0,0|0,0,2]=4 210 B11R1.90 CC(C)=CCn1nccc1C Amb27622117 [1,0,0,1,0,0|2,0,0]=4 211 B11R1.145 CC1=CCNCC(C)=CCC1 Amb27476124 [1,0,0,1,0,0|1,0,1]=4 212 B11R1.157 CC(C)=CC1CC(C)=CCO1 Amb22733694 [1,0,0,1,0,0|0,0,1]=3 213 B11R1.166 C=C(C)C1CCC(C)=CC1=O Amb26062070 [1,0,0,1,0,0|0,0,2]=4 214 B11R1.166 C=C(C)[C@H]1CCC(C)=CC1=O Amb28461259 [1,0,0,1,0,0|0,0,2]=4 215 B11R1.166 CC(C)=C1CCC(C)CC1=O Amb2781516 [1,0,0,1,0,0|0,0,2]=4 216 B11R1.166 CC(C)=C1CC[C@@H](C)CC1=O Amb533074 [1,0,0,1,0,0|0,0,2]=4 217 B11R1.166 CC(C)=C1CC[C@H](C)CC1=O Amb6600345 [1,0,0,1,0,0|0,0,2]=4 218 B11R1.166 CC1=CC(=O)C(=C(C)C)CC1 Amb17593737 [1,0,0,1,0,0|0,0,0]=2 219 B11R1.166 CC1=CC(=O)C(C(C)C)CC1 Amb17593801 [1,0,0,1,0,0|0,0,2]=4 220 B11R1.166 CC1=CC(=O)[C@@H](C(C)C)CC1 Amb25768486 [1,0,0,1,0,0|0,0,2]=4 221 B11R1.166 CC1=CC(=O)[C@H](C(C)C)CC1 Amb22736504 [1,0,0,1,0,0|0,0,2]=4 222 B11R1.166 CC1=CC(=O)\C(=C(/C)O)CC1 Amb24740131 [1,0,0,1,0,0|1,0,0]=3 223 B11R1.172 CC(C)=CCCC1=COCC1 Amb30023887 [1,0,0,1,0,0|2,0,0]=4 224 B11R1.172 CC(C)=CCCc1ccco1 Amb35709490 [1,0,0,1,0,0|2,0,0]=4 225 B11R1.172 CC(C)=CCCc1cccs1 Amb30023890 [1,0,0,1,0,0|2,0,0]=4 226 B11R1.172 CC(C)=CCCc1ccns1 Amb35582863 [1,0,0,1,0,0|2,0,0]=4 227 B11R1.172 CC(C)=CCCc1ccsc1 Amb30023889 [1,0,0,1,0,0|0,1,1]=4 228 B11R1.172 CC(C)=CCCc1ccsn1 Amb30023891 [1,0,0,1,0,0|1,1,0]=4 229 B11R1.290 C\C(=C\CBr)CCC=C1CC1 Amb27672056 [1,0,0,1,0,0|1,0,1]=4 230 B11R1.342 CC1(C)CCC\C(=C/C=O)C1 Amb22731007 [1,0,0,1,0,0|0,0,2]=4 231 B11R1.342 CC1(C)CCC\C(=C\C=O)C1 Amb17593811 [1,0,0,1,0,0|0,0,2]=4 232 B11R1.424 CC1=C(C=O)C(C)(C)C=CC1 Amb26844986 [1,0,0,1,0,0|0,0,2]=4 233 B11R1.424 CC1=C(C=O)C(C)(C)CCC1 Amb3939526 [1,0,0,1,0,0|0,0,2]=4 234 B11R1.645 CC(=O)OC1CC(C)=CC1=O Amb27823424 [1,0,0,1,0,0|2,0,0]=4 235 B11R1.645 CC1=CC(=O)C(CC(C)C)C1 Amb27861201 [1,0,0,1,0,0|0,0,2]=4 236 B11R1.765 CC(C)=CC1CC1(C)CC=O Amb27948668 [1,0,0,1,0,0|0,0,2]=4 237 B11R1.765 CC(C)=C[C@H]1C[C@@]1(C)CC=O Amb27788114 [1,0,0,1,0,0|0,0,2]=4 238 B11R1.27 C\C=C\CCC1=CC(O)CC1 Amb27980461 [1,0,0,1,0,0|1,0,1]=4 239 B11R1.43 CCN1CC\C(=C/C(=O)O)C1 Amb31161565 [1,0,0,1,0,0|1,0,1]=4 240 B11R1.77 CC(CC(=O)O)C1CC=CC1 Amb27670122 [1,0,0,1,0,0|0,0,2]=4 241 B11R1.77 C\C(=C/C(=O)O)C1CCCC1 Amb17506859 [1,0,0,1,0,0|0,0,2]=4 242 B11R1.143 CC(=O)C1=C(C)CCC=CC1 Amb26511435 [1,0,0,1,0,0|1,0,0]=3 243 B11R1.156 CC1=CCCC(C)C1C(=O)O Amb24351203 [1,0,0,1,0,0|0,0,2]=4 244 B11R1.156 Cc1cccc(C)c1C(=O)O Amb2612269 [1,0,0,1,0,0|0,0,2]=4 245 B11R1.156 Cc1ccnc(C)c1C(=O)O Amb2695128 [1,0,0,1,0,0|1,0,1]=4 246 B11R1.156 Cc1ccnc(C)c1C(=O)O Amb8385362 [1,0,0,1,0,0|1,0,1]=4 247 B11R1.156 Cc1cncc(C)c1C(=O)O Amb10602201 [1,0,0,1,0,0|1,0,1]=4 248 B11R1.156 Cc1cncc(C)c1C(=O)O Amb33295197 [1,0,0,1,0,0|1,0,1]=4 249 B11R1.230 CC1=CC(=O)OC1CCC=O Amb27799786 [1,0,0,1,0,0|1,0,1]=4 250 B11R1.484 C\C(=C/C(=O)O)CC1CCC1 Amb27766925 [1,0,0,1,0,0|0,0,2]=4 251 B11R1.742 O=C(O)C=C1CCCCCC1 Amb6749176 [1,0,0,1,0,0|0,0,2]=4 252 B11R1.742 O=C(O)CC1CCC=CCC1 Amb26054605 [1,0,0,1,0,0|0,0,2]=4 253 B11R1.742 O=C(O)\C=C1\CCCOCC1 Amb28313065 [1,0,0,1,0,0|1,0,1]=4 254 B11R1.742 O=C(O)\C=C1\CCCSCC1 Amb35691471 [1,0,0,1,0,0|1,0,1]=4 255 B11R1.75 CC(C)=CC[C@@H]1C=CC(O)O1 Amb28206220 [1,0,0,1,0,0|0,0,2]=4 256 B11R1.178 CC(=O)N1CCC=C1C(=O)O Amb27249478 [1,0,0,1,0,0|2,0,0]=4 257 B11R1.178 CC(C)C1=C(C(=O)O)CCC1 Amb27471127 [1,0,0,1,0,0|0,0,2]=4 258 B11R1.234 CC1(C)OCC\C1=C\C(=O)O Amb33468667 [1,0,0,1,0,0|1,0,1]=4 259 B11R1.20 CC(=O)C=C1CCN(C)CC1 Amb28244688 [0,0,0,1,1,0|2,0,0]=4 260 B11R1.20 CC1CCC(=CC(=O)O)CC1 Amb4014442 [0,0,0,1,1,0|0,0,1]=3 261 B11R1.20 CC1CCC(=CC(N)=O)CC1 Amb27813945 [0,0,0,1,1,0|1,0,1]=4 262 B11R1.20 CC1CC\C(=C/C(=O)O)CO1 Amb29866054 [0,0,0,1,1,0|1,0,1]=4 263 B11R1.20 CC1CC\C(=C/C(=O)O)CS1 Amb35717570 [0,0,0,1,1,0|1,0,1]=4 264 B11R1.20 CN1CCC(=CC(=O)O)CC1 Amb33068967 [0,0,0,1,1,0|1,0,0]=3 265 B11R1.20 CN1CCC(=CC(=O)O)CC1 Amb5400512 [0,0,0,1,1,0|1,0,0]=3 266 B11R1.20 O=C(O)C=C1CCC(F)CC1 Amb26929658 [0,0,0,1,1,0|1,0,1]=4 267 B11R1.20 O=C(O)C=C1CCC(O)CC1 Amb28239820 [0,0,0,1,1,0|1,0,1]=4 268 B11R1.74 CC1=CC(=O)OC(C(C)C)=C1 Amb27223385 [0,0,0,1,1,0|0,0,2]=4 269 B11R1.167 CC(=O)C1=C(C)CCN(C)C1 Amb24646642 [0,0,0,1,1,0|2,0,0]=4 270 B11R1.167 CC1=C(C(=O)O)C[C@@H](O)CC1 Amb27409054 [0,0,0,1,1,0|1,0,1]=4 271 B11R1.167 CC1=C(C(N)=O)CN(C)CC1 Amb28066802 [0,0,0,1,1,0|2,0,0]=4 272 B11R1.167 CC1=NNC(C)=C(C(=O)O)C1 Amb27860481 [0,0,0,1,1,0|2,0,0]=4 273 B11R1.167 CC1CCC(Cl)=C(C(=O)O)C1 Amb8844856 [0,0,0,1,1,0|1,0,1]=4 274 B11R1.167 Cc1ccc(C)c(C(=O)O)c1 Amb6335835 [0,0,0,1,1,0|0,0,2]=4 275 B11R1.167 Cc1ccc(C)c(C(=O)O)n1 Amb18125241 [0,0,0,1,1,0|1,0,1]=4 276 B11R1.167 Cc1ccc(C)c(C(=O)O)n1 Amb33482660 [0,0,0,1,1,0|1,0,1]=4 277 B11R1.167 Cc1cnc(C)c(C(=O)O)c1 Amb18201737 [0,0,0,1,1,0|1,0,1]=4 278 B11R1.167 Cc1cnc(C)c(C(=O)O)n1 Amb21963728 [0,0,0,1,1,0|2,0,0]=4 279 B11R1.518 CC(C)=C[C@@H]1[C@H](C)[C@@H]1C(=O)O Amb27238005 [0,0,0,1,1,0|0,0,2]=4 280 B11R1.518 CC(C)=C[C@H]1[C@H](C)[C@H]1C(=O)O Amb24711211 [0,0,0,1,1,0|0,0,2]=4 281 B11R1.650 CC1=CC(=O)CCC(C)CC1 Amb27802499 [0,0,0,1,1,0|1,0,1]=4 282 B11R1.710 CC(=O)\C=C1\CCC(C)(C)C1 Amb27174297 [0,0,0,1,1,0|1,0,1]=4 283 B11R1.710 CC1(C)CC\C(=C\C(=O)O)C1 Amb33468661 [0,0,0,1,1,0|0,0,1]=3 284 B11R1.710 CC1(C)C\C(=C\C(=O)O)CO1 Amb33468668 [0,0,0,1,1,0|1,0,1]=4 285 B11R1.1040 CC(=O)C1=C(C)CCC1(C)C Amb24422541 [0,0,0,1,1,0|1,0,1]=4 286 B11R1.1040 CC1=C(C(=O)O)C(C)(C)CC1 Amb26434259 [0,0,0,1,1,0|0,0,1]=3 287 B11R1.1263 CC(=O)\C=C(\C)C1CC1(C)C Amb27204645 [0,0,0,1,1,0|1,0,1]=4 288 B11R1.21 CC1=CCC(=C(C)C)CC1=O Amb24706787 [0,0,0,1,1,0|1,0,1]=4 289 B11R1.667 CC(=O)C1(C)CCC=C(C)C1 Amb25142639 [0,0,0,1,1,0|1,0,1]=4 290 B11R1.667 CC1=CCCC(C)(C(=O)O)C1 Amb18125780 [0,0,0,1,1,0|0,0,1]=3 291 B11R1.667 CC1=CCCC(C)(C(=O)O)O1 Amb28245231 [0,0,0,1,1,0|1,0,1]=4 292 B13R1.513 CC(C)=CCCc1ccc(O)cc1 Amb28202351 [0,0,0,1,0,1|1,0,1]=4 293 B13R1.844 CC1=C(CC(=O)O)C(C)(C)CCC1 Amb18129125 [0,0,0,1,0,1|0,0,2]=4 294 B13R1.7745 CC(C)=CCCC1=CCS(=O)(=O)C1 Amb28184334 [0,0,0,1,0,1|1,0,1]=4 295 B13R1.147 CC1=CCCN(C(=O)CC(=O)O)C1 Amb27254658 [0,0,0,1,0,1|1,0,1]=4 296 B13R1.583 CC(C)CN1CC\C(=C/C(=O)O)C1 Amb27755246 [0,0,0,1,0,1|0,0,2]=4 297 B13R1.587 CC(C)C1CCC\C(=C/C(=O)O)C1 Amb28317131 [0,0,0,1,0,1|0,0,2]=4 298 B13R1.587 CC(C)C1CCC\C(=C\C(=O)O)C1 Amb33468660 [0,0,0,1,0,1|0,0,2]=4 299 B13R1.587 CC(C)N1CCC\C(=C/C(=O)O)C1 Amb27977795 [0,0,0,1,0,1|0,0,2]=4 300 B13R1.3424 C=C1CCN(C\C(C)=C\C(=O)O)C1 Amb35637483 [0,0,0,1,0,1|0,0,2]=4 301 B13R1.3485 CC(C)=CCCn1nc(C)cc1C Amb35582825 [0,0,0,1,0,1|2,0,0]=4 302 B13R1.3485 CC(C)=CCCn1nc(N)cc1C Amb32705953 [0,0,0,1,0,1|2,0,0]=4 303 B13R1.8374 CC1C\C(=C\C(=O)O)CC(C)(C)C1 Amb33468651 [0,1,0,1,0,0|0,0,2]=4 304 B13R1.584 CC(C)(C)N1CC\C(=C/C(=O)O)C1 Amb31185785 [0,1,0,1,0,0|1,0,1]=4 305 B13R1.1018 CC(C)(C)OC1CC(=CC(=O)O)C1 Amb28141388 [0,1,0,1,0,0|1,0,1]=4 306 B13R1.7593 CC1CCC(C(C)(C)O)=C1C(=O)O Amb27657757 [0,1,0,1,0,0|0,0,2]=4 307 B13R1.8833 CC1(C)CCC\C(=C\C(=O)O)CC1 Amb33468664 [0,1,0,1,0,0|0,0,2]=4 308 B13R1.149 CC(C)=CCCC1=CC(=O)CCC1 Amb27409629 [0,1,0,1,0,0|1,0,0]=3 309 B13R1.149 CC(C)=CCCC1=CC(O)CCC1 Amb35738228 [0,1,0,1,0,0|1,0,1]=4 310 B13R1.149 CC(C)=CCCC1=CC(O)CNC1 Amb32989374 [0,1,0,1,0,0|1,0,1]=4 311 B13R1.164 CC(C)=CCC1CCC(=O)C=C1C Amb27828950 [0,1,0,1,0,0|1,0,0]=3 312 B13R1.1869 COC(=O)\C=C1/CCCC(C)CC1 Amb33504063 [0,1,0,1,0,0|0,0,2]=4 313 B13R1.1869 COC(=O)\C=C1/CCCN(C)CC1 Amb33504060 [0,1,0,1,0,0|1,0,1]=4 314 B13R1.1869 COC(=O)\C=C1\CCCC(C)CC1 Amb28042856 [0,1,0,1,0,0|0,0,2]=4 315 B13R1.1869 COC(=O)\C=C1\CCCN(C)CC1 Amb28137121 [0,1,0,1,0,0|1,0,1]=4 316 B13R1.2816 CC1=CC(=O)O[C@@H](CC(C)C)[C@@H]1O Amb27651793 [0,1,0,1,0,0|0,0,2]=4 317 B13R1.3443 CC(C)=CCCC1=CC(=O)C(C)C1 Amb27749806 [0,1,0,1,0,0|1,0,0]=3 318 B13R1.5628 COC(=O)\C=C1/CCCC(C)(C)C1 Amb32943322 [0,1,0,1,0,0|0,0,2]=4 319 B13R1.5628 COC(=O)\C=C1\CCCC(C)(C)C1 Amb28399653 [0,1,0,1,0,0|0,0,2]=4 320 B13R1.132 CC1=CCC(\C(C)=C/C(C)O)CC1 Amb27829903 [0,1,0,1,0,0|1,0,1]=4 321 B13R1.132 CC1=CCC(\C(C)=C\C(=O)O)CC1 Amb18648402 [0,1,0,1,0,0|0,0,0]=2 322 B13R1.132 CC1=CC[C@H](\C(C)=C\C(=O)O)CC1 Amb27401934 [0,1,0,1,0,0|0,0,0]=2 323 B13R1.533 CCC(C)N1CC\C(=C/C(=O)O)C1 Amb28205398 [0,1,0,1,0,0|1,0,1]=4 324 B13R1.2174 CCC1CCC\C(=C\C(=O)O)CC1 Amb33468663 [0,1,0,1,0,0|0,0,2]=4 325 B13R1.6004 CCC1(C)C\C(=C\C(=O)O)CCO1 Amb27807877 [0,1,0,1,0,0|1,0,1]=4 326 B13R1.585 CC(C)C1CCC(=CC(=O)O)CC1 Amb25041537 [0,1,0,1,0,0|0,0,2]=4 327 B13R1.585 CC(C)N1CCC(=CC(=O)O)CC1 Amb6749136 [0,1,0,1,0,0|1,0,1]=4 328 B13R1.585 CC(C)N1CCC(=CC(=O)O)CC1 Amb8503353 [0,1,0,1,0,0|1,0,1]=4 329 B13R1.1078 CC(C)N1CC\C(=C(\F)C(=O)O)C1 Amb27416020 [0,1,0,1,0,0|1,0,1]=4 330 B13R1.1078 C\C(C(=O)O)=C1\CCN(C(C)C)C1 Amb27801897 [0,1,0,1,0,0|1,0,1]=4 331 B13R1.3795 C\C(C(=O)O)=C1\CCCC(C)CC1 Amb27656907 [0,1,0,1,0,0|0,0,2]=4 332 B13R1.6181 CC1(C)C\C(=C(/F)C(=O)O)CCO1 Amb28207789 [0,1,0,1,0,0|1,0,1]=4 333 B13R1.6181 C\C(C(=O)O)=C1\CCOC(C)(C)C1 Amb27809693 [0,1,0,1,0,0|1,0,1]=4 334 B13R1.526 CN1CC\C(=C/C(=O)O)CC1(C)C Amb31112076 [0,1,0,1,0,0|1,0,1]=4 335 B13R1.5126 CC(C)=CCC1C(C(=O)O)C1(C)C Amb27875961 [0,1,0,1,0,0|0,0,2]=4 336 B13R1.8846 CC(C)=CC1CC(C)(C)C1C(=O)O Amb27755073 [0,1,0,1,0,0|0,0,2]=4 337 B13R1.8846 CC(C)=C[C@@H]1CC(C)(C)[C@@H]1C(=O)O Amb28131401 [0,1,0,1,0,0|0,0,2]=4 338 B13R2.542 O=C(O)\C=C1/CCN(C2CC2)C1 Amb31161621 [0,0,0,2,0,0|1,0,1]=4 339 B13R2.3307 CC1=C(C(=O)O)N2C(=O)CC2C1 Amb27490920 [0,0,0,2,0,0|2,0,0]=4 340 B9R0.48 C=C(C)CC\C(C)=C\C=O Amb18643300 [1,0,0,0,1,0|0,0,1]=3 341 B9R0.48 C=C(C)CC\C(C)=C\CO Amb28460692 [1,0,0,0,1,0|0,0,2]=4 342 B9R0.48 CC(=O)CC\C(C)=C/C=O Amb27643630 [1,0,0,0,1,0|1,0,0]=3 343 B9R0.48 CC(=O)CC\C(C)=C\C=O Amb27818040 [1,0,0,0,1,0|1,0,0]=3 344 B9R0.48 CC(=O)CN\C(C)=C\C=O Amb28326012 [1,0,0,0,1,0|2,0,0]=4 345 B9R0.48 CC(=O)OC\C(C)=C\C=O Amb28385065 [1,0,0,0,1,0|2,0,0]=4 346 B9R0.48 CC(=O)\C=C\C(C)=C\C=O Amb27445134 [1,0,0,0,1,0|1,0,1]=4 347 B9R0.48 CC(C)=CCC(C)CC=O Amb18643637 [1,0,0,0,1,0|0,0,2]=4 348 B9R0.48 CC(C)=CC\C(C)=C\C=O Amb27263893 [1,0,0,0,1,0|0,0,0]=2 349 B9R0.48 CC(\C=C\N(C)C)=C/C=O Amb27239569 [1,0,0,0,1,0|1,0,1]=4 350 B9R0.48 C\C(=C/C=O)CCC(C)C Amb27268552 [1,0,0,0,1,0|0,0,1]=3 351 B9R0.48 C\C=C\C(=O)CC=C(C)C Amb25878661 [1,0,0,0,1,0|2,0,0]=4 352 B9R0.47 C\C=C/CCC(=O)C(C)=O Amb27591550 [1,0,0,0,1,0|2,0,0]=4 353 B9R0.47 C\C=C\CCC(C)C(=O)O Amb27461427 [1,0,0,0,1,0|0,0,1]=3 354 B9R0.47 C\C=C\CCC(N)C(=O)O Amb27770583 [1,0,0,0,1,0|1,0,1]=4 355 B9R0.47 C\C=C\CN[C@@H](C)C(=O)O Amb27601181 [1,0,0,0,1,0|1,0,1]=4 356 B9R0.47 C\C=C\CN[C@H](C)C(=O)O Amb27440981 [1,0,0,0,1,0|1,0,1]=4 357 B9R0.47 C\C=C\CO[C@@H](C)C(=O)O Amb27426114 [1,0,0,0,1,0|1,0,1]=4 358 B9R0.47 C\C=C\CO[C@H](C)C(=O)O Amb28384040 [1,0,0,0,1,0|1,0,1]=4 359 B9R0.55 C=C(C)CC\C=C\C(=O)O Amb27253611 [1,0,0,0,1,0|0,0,1]=3 360 B9R0.55 C=C(C)CO\C=C\C(=O)O Amb18643826 [1,0,0,0,1,0|1,0,1]=4 361 B9R0.55 CC(=O)CCCC=C(C)C Amb28053965 [1,0,0,0,1,0|1,0,1]=4 362 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [1,0,0,0,1,0|1,0,0]=3 363 B9R0.55 CC(=O)NC\C=C\C(=O)O Amb27259093 [1,0,0,0,1,0|2,0,0]=4 364 B9R0.55 CC(=O)OC\C=C\C(=O)O Amb24454652 [1,0,0,0,1,0|2,0,0]=4 365 B9R0.55 CC(=O)\C=C\C=C\C(=O)O Amb27205327 [1,0,0,0,1,0|1,0,1]=4 366 B9R0.55 CC(=O)\C=C\CCC(C)C Amb25111718 [1,0,0,0,1,0|1,0,1]=4 367 B9R0.55 CC(=O)\C=C\CCN(C)C Amb33271941 [1,0,0,0,1,0|2,0,0]=4 368 B9R0.55 CC(C)=CCCCC(N)=O Amb27390535 [1,0,0,0,1,0|1,0,1]=4 369 B9R0.55 CC(C)=CCCNC(N)=O Amb27596311 [1,0,0,0,1,0|2,0,0]=4 370 B9R0.55 CC(C)=CCOCC(=O)O Amb18644115 [1,0,0,0,1,0|1,0,1]=4 371 B9R0.55 CC(C)=CC\C=C\[C@H](C)O Amb27197150 [1,0,0,0,1,0|1,0,1]=4 372 B9R0.55 CC(C)=C\C=C\CC(=O)O Amb27473342 [1,0,0,0,1,0|0,0,2]=4 373 B9R0.55 CC(C)CC\C=C\C(=O)O Amb17593603 [1,0,0,0,1,0|0,0,1]=3 374 B9R0.55 CC(C)NC\C=C\C(=O)O Amb27601688 [1,0,0,0,1,0|1,0,1]=4 375 B9R0.55 CC(C)OC\C=C\C(=O)O Amb33475206 [1,0,0,0,1,0|1,0,1]=4 376 B9R0.55 CC(C)SC\C=C\C(=O)O Amb19020662 [1,0,0,0,1,0|1,0,1]=4 377 B9R0.55 CC(C)\C=C\C=C\C(=O)O Amb25367977 [1,0,0,0,1,0|0,0,2]=4 378 B9R0.55 CN(C)CC\C=C/C(=O)O Amb27815066 [1,0,0,0,1,0|1,0,0]=3 379 B9R0.55 CN(C)CC\C=C\C(=O)O Amb32954654 [1,0,0,0,1,0|1,0,0]=3 380 B9R0.55 C\C(Br)=C/CCCC(=O)O Amb27798317 [1,0,0,0,1,0|1,0,1]=4 381 B9R0.55 O=C(O)\C=C\CCC(=O)O Amb20622952 [1,0,0,0,1,0|2,0,0]=4 382 B9R0.7 C=C(C)CCC(=C)C(=O)O Amb28047421 [0,0,0,0,2,0|0,0,2]=4 383 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [0,0,0,0,2,0|0,0,2]=4 384 B9R0.7 C=C(CCN(C)C)C(=O)O Amb28903893 [0,0,0,0,2,0|1,0,1]=4 385 B9R0.7 C=C(CCN(C)C)C(=O)O Amb32667385 [0,0,0,0,2,0|1,0,1]=4 386 B9R0.7 CC(C)=CCC(C)C(=O)O Amb18643879 [0,0,0,0,2,0|0,0,1]=3 387 B9R0.7 CC(C)=CCC(N)C(=O)O Amb6276273 [0,0,0,0,2,0|1,0,1]=4 388 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O Amb27254062 [0,0,0,0,2,0|1,0,1]=4 389 B9R0.7 CC(C)=CC[C@H](N)C(=O)O Amb25836895 [0,0,0,0,2,0|1,0,1]=4 390 B9R0.7 CC(C)=C\C=C(/C)C(=O)O Amb27210759 [0,0,0,0,2,0|0,0,1]=3 391 B9R0.7 CC(C)=C\C=C(/C)C(N)=O Amb4035443 [0,0,0,0,2,0|1,0,1]=4 392 B9R0.7 CC(C)=C\C=C(/F)C(=O)O Amb28050050 [0,0,0,0,2,0|1,0,1]=4 393 B9R0.7 CC(C)CCC(=O)C(=O)O Amb26508699 [0,0,0,0,2,0|1,0,1]=4 394 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [0,0,0,0,2,0|0,0,2]=4 395 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [0,0,0,0,2,0|0,0,2]=4 396 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [0,0,0,0,2,0|0,0,2]=4 397 B9R0.7 CC(CCN(C)C)C(=O)O Amb26502003 [0,0,0,0,2,0|1,0,1]=4 398 B9R0.7 CC(CCN(C)C)C(=O)O Amb32675008 [0,0,0,0,2,0|1,0,1]=4 399 B9R0.7 CN(C)CCC(=O)C(=O)O Amb33272647 [0,0,0,0,2,0|2,0,0]=4 400 B9R0.7 C\C(=C/CC(C)C)C(=O)O Amb27815070 [0,0,0,0,2,0|0,0,2]=4 401 B9R0.7 C\C(=C\CC(C)C)C(=O)O Amb27203321 [0,0,0,0,2,0|0,0,2]=4 402 B9R0.7 C\C(=N/CC(C)C)C(=O)O Amb27426682 [0,0,0,0,2,0|1,0,1]=4 403 B9R0.53 CC(=O)\C=C(/C)CC(C)=O Amb24647875 [0,0,0,0,2,0|2,0,0]=4 404 B9R0.53 CC(=O)\C=C(/C)CC(C)C Amb28063284 [0,0,0,0,2,0|1,0,1]=4 405 B9R0.53 CC(=O)\C=C(/C)CN(C)C Amb26872810 [0,0,0,0,2,0|2,0,0]=4 406 B9R0.53 CC(=O)\C=C(/O)C=C(C)C Amb28198590 [0,0,0,0,2,0|2,0,0]=4 407 B9R0.53 CC(=O)\C=C(\C)CC(C)=O Amb25719264 [0,0,0,0,2,0|2,0,0]=4 408 B9R0.53 CC(C)=C\C(C)=C\C(=O)O Amb27422044 [0,0,0,0,2,0|0,0,0]=2 409 B9R0.53 C\C(=C/C(=O)O)CC(=O)O Amb24556420 [0,0,0,0,2,0|2,0,0]=4 410 B9R0.53 C\C(=C/C(=O)O)CN(C)O Amb27459209 [0,0,0,0,2,0|2,0,0]=4 411 B9R0.53 C\C(=C\C(=O)O)CC(=O)O Amb26421861 [0,0,0,0,2,0|2,0,0]=4 412 B9R0.53 C\C(=C\C(=O)O)CC(C)C Amb26947874 [0,0,0,0,2,0|0,0,1]=3 413 B9R0.53 C\C(=C\C(C)C)CC(=O)O Amb27784871 [0,0,0,0,2,0|0,0,2]=4 414 B13R0.1398 CC(=O)CC\C=C(/C)CCC=C(C)C Amb533145 [0,0,0,0,0,2|1,0,0]=3 415 B13R0.1398 CC(=O)CC\C=C(\C)CCC=C(C)C Amb6365483 [0,0,0,0,0,2|1,0,0]=3 416 B13R0.1398 CC(=O)OC\C=C(/C)CCC=C(C)C Amb1953840 [0,0,0,0,0,2|1,0,0]=3 417 B13R0.1398 CC(=O)\C=C\C=C(/C)CCC=C(C)C Amb541870 [0,0,0,0,0,2|1,0,0]=3 418 B13R0.1398 CC(C)=CCC\C(C)=C\C#CC(=O)O Amb27477724 [0,0,0,0,0,2|0,0,0]=2