0 B9R1.34 CC1=CC(C)CC(C)C1 Amb27448286 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.34 CC1=NC(C)SC(C)S1 Amb15691678 [0,0,0,0,0,0|1,2,1]=4 2 B9R1.34 CC1CC(=O)CC(C)O1 Amb10072038 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.34 CC1CC(Br)CC(C)O1 Amb27657066 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.34 CC1CC(C)CC(Br)C1 Amb25147183 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.34 CC1CC(C)CC(C)C1 Amb9787600 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.34 CC1CC(C)CC(I)C1 Amb25147177 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.34 CC1CC(C)CC(N)C1 Amb19514974 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.34 CC1CC(C)CC(O)C1 Amb19514923 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.34 CC1CC(C)CC(S)C1 Amb24539821 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.34 CC1CC(C)NC(C)C1 Amb6369922 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.34 CC1CC(C)OC(O)C1 Amb27805325 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.34 CC1CC(C)SC(Cl)S1 Amb27180214 [0,0,0,0,0,0|2,2,0]=4 13 B9R1.34 CC1CC(Cl)CC(C)O1 Amb24479940 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.34 CC1CC(Cl)OC(Cl)C1 Amb27485254 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.34 CC1CC(N)CC(C)N1 Amb23535949 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.34 CC1CC(N)CC(C)O1 Amb22059487 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.34 CC1CC(O)CC(C)N1 Amb2697842 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.34 CC1CC(O)CC(C)O1 Amb19892414 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.34 CC1CC(O)OC(C)O1 Amb27249475 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.34 CC1CC(S)CC(C)O1 Amb25276017 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.34 CC1CN(C)CC(C)N1 Amb18063106 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.34 CC1CN(C)CC(C)O1 Amb28895939 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.34 CC1CN(C)CC(C)O1 Amb32651323 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.34 CC1CN(C)C[C@@H](C)N1 Amb18832589 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.34 CC1CN(N)CC(C)O1 Amb18062022 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.34 CC1NC(C)NC(C)N1 Amb6357209 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.34 CC1NC(C)NC(C)N1 Amb9825556 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.34 CC1NC(C)SC(C)S1 Amb32667087 [0,0,0,0,0,0|1,2,0]=3 29 B9R1.34 CC1NC(C)SC(C)S1 Amb4011092 [0,0,0,0,0,0|1,2,0]=3 30 B9R1.34 CC1OC(C)OC(C)O1 Amb6608781 [0,0,0,0,0,0|0,0,0]=0 31 B9R1.34 CC1OC(O)C[C@@H](C)O1 Amb27981964 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.34 CC1OC(O)C[C@H](C)O1 Amb27956640 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.34 CC1SC(C)SC(C)S1 Amb4014446 [0,0,0,0,0,0|0,3,0]=3 34 B9R1.34 CC1S[C@@H](C)N[C@@H](C)S1 Amb28367202 [0,0,0,0,0,0|1,2,0]=3 35 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)O1 Amb24056554 [0,0,0,0,0,0|3,0,1]=4 36 B9R1.34 C[C@@H]1CC(N)C[C@@H](C)N1 Amb27630062 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.34 C[C@@H]1CC(O)C[C@@H](C)C1 Amb27211586 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.34 C[C@@H]1CC(O)C[C@@H](C)N1 Amb24580385 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.34 C[C@@H]1CC(O)C[C@@H](C)O1 Amb28435705 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.34 C[C@@H]1CC(O)C[C@H](C)C1 Amb27451589 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.34 C[C@@H]1CN(C)C[C@@H](C)N1 Amb26969656 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.34 C[C@@H]1C[C@@H](O)C[C@@H](O)O1 Amb27649020 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.34 C[C@@H]1C[C@@H](O)C[C@H](O)O1 Amb27784143 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.34 C[C@@H]1C[C@H](Cl)C[C@H](C)C1 Amb27483334 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)O1 Amb24620055 [0,0,0,0,0,0|3,0,1]=4 46 B9R1.34 C[C@H]1CC(Br)C[C@@H](C)O1 Amb27772090 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.34 C[C@H]1CC(N)C[C@@H](C)O1 Amb27481342 [0,0,0,0,0,0|3,0,0]=3 48 B9R1.34 C[C@H]1CC(S)C[C@@H](C)O1 Amb32788730 [0,0,0,0,0,0|3,0,0]=3 49 B9R1.34 C[C@H]1CN(C)C[C@@H](C)N1 Amb24411460 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.34 C[C@H]1CN(C)C[C@H](C)N1 Amb27780084 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.34 C[C@H]1CN(N)C[C@@H](C)O1 Amb836797 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.34 C[C@H]1C[C@@H](C)C[C@@H](C)N1 Amb25145967 [0,0,0,0,0,0|3,0,0]=3 53 B9R1.34 C[C@H]1C[C@@H](C)C[C@@H](C)N1 Amb31188261 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.34 C[C@H]1C[C@@H](C)C[C@H](Cl)C1 Amb28436905 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.34 C[C@H]1C[C@@H](C)C[C@H](N)C1 Amb28410627 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.34 C[C@H]1C[C@@H](C)SC(Cl)S1 Amb27401801 [0,0,0,0,0,0|2,2,0]=4 57 B9R1.34 C[C@H]1C[C@@H](Cl)C[C@@H](C)O1 Amb27984969 [0,0,0,0,0,0|3,0,0]=3 58 B9R1.34 C[C@H]1C[C@@H](N)C[C@@H](C)O1 Amb27838552 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.34 C[C@H]1C[C@@H](O)C[C@@H](C)N1 Amb27205445 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.34 C[C@H]1C[C@H](Br)C[C@@H](C)O1 Amb33338914 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.34 Cb1ob(C)ob(C)o1 Amb22732918 [0,0,0,0,0,0|3,0,0]=3 62 B8R1.4 CC1=CC(C)OCC1 Amb17689157 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.4 CC1CC(Br)CCO1 Amb25367234 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.4 CC1CC(C)NCN1 Amb27403076 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.4 CC1CC(Cl)CCO1 Amb26046391 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.4 CC1CC(N)CCO1 Amb22059408 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.4 CC1CC(N)CCO1 Amb33715162 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.4 CC1CC(O)CCO1 Amb22757197 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.4 CC1CC(S)CCO1 Amb26515745 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.4 CC1CCCC(C)C1 Amb4036439 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.4 CC1CCCC(C)N1 Amb2720338 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.4 CC1CCCC(C)N1 Amb6340189 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.4 CC1CCNC(C)C1 Amb19957920 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.4 CC1CCNC(C)C1 Amb2714084 [1,0,0,0,0,0|3,0,0]=4 75 B8R1.4 CC1CCNC(C)O1 Amb33193276 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [1,0,0,0,0,0|2,0,1]=4 77 B8R1.4 CC1CCOC(C)N1 Amb33194285 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.4 CC1CCOC(C)O1 Amb4017488 [1,0,0,0,0,0|1,0,0]=2 79 B8R1.4 CC1CCOC(I)C1 Amb32419164 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.4 CC1CCOS(=O)O1 Amb4010773 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.4 CC1CNCC(C)O1 Amb5716863 [1,0,0,0,0,0|3,0,0]=4 82 B8R1.4 CC1COCC(C)O1 Amb26515760 [1,0,0,0,0,0|3,0,0]=4 83 B8R1.4 CC1CSCC(C)O1 Amb4016354 [1,0,0,0,0,0|3,0,0]=4 84 B8R1.4 C[C@@H]1CCC[C@@H](C)N1 Amb26932464 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.4 C[C@@H]1CCC[C@@H](C)N1 Amb28719530 [1,0,0,0,0,0|3,0,0]=4 86 B8R1.4 C[C@@H]1CCN[C@H](C)C1 Amb24603758 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.4 C[C@@H]1CCN[C@H](C)C1 Amb28644774 [1,0,0,0,0,0|3,0,0]=4 88 B8R1.4 C[C@@H]1CCO[C@@H](O)C1 Amb27854200 [1,0,0,0,0,0|3,0,0]=4 89 B8R1.4 C[C@@H]1CCO[C@H](O)C1 Amb27484825 [1,0,0,0,0,0|3,0,0]=4 90 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22745550 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.4 C[C@@H]1C[C@@H](Br)CCO1 Amb25281129 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Amb24575458 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.4 C[C@H]1CCCC(O)O1 Amb28206458 [1,0,0,0,0,0|3,0,0]=4 94 B8R1.4 C[C@H]1CCC[C@@H](C)N1 Amb3941399 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.4 C[C@H]1CCC[C@H](C)N1 Amb33457277 [1,0,0,0,0,0|3,0,0]=4 96 B8R1.4 C[C@H]1CCC[C@H](C)N1 Amb8393083 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.4 C[C@H]1CCN[C@@H](C)C1 Amb22748742 [1,0,0,0,0,0|3,0,0]=4 98 B8R1.4 C[C@H]1CCN[C@@H](C)C1 Amb26017367 [1,0,0,0,0,0|3,0,0]=4 99 B8R1.4 C[C@H]1CCO[C@@H](O)C1 Amb28197437 [1,0,0,0,0,0|3,0,0]=4 100 B8R1.4 C[C@H]1CNC[C@@H](C)O1 Amb33719087 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.4 C[C@H]1CNC[C@@H](C)O1 Amb3939625 [1,0,0,0,0,0|3,0,0]=4 102 B8R1.4 C[C@H]1CNC[C@H](C)O1 Amb22406103 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.4 C[C@H]1C[C@@H](O)CCO1 Amb26549571 [1,0,0,0,0,0|3,0,0]=4 104 B8R1.4 C[C@H]1C[C@H](O)CCO1 Amb26891979 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.8 C#CC1OC(C)CC(C)O1 Amb26401847 [0,1,0,0,0,0|1,0,1]=3 106 B10R1.8 C#CC1O[C@H](C)C[C@@H](C)O1 Amb27234074 [0,1,0,0,0,0|1,0,1]=3 107 B10R1.8 C#C[C@H]1O[C@@H](C)C[C@@H](C)O1 Amb27864564 [0,1,0,0,0,0|1,0,1]=3 108 B10R1.8 CC1CC(C)CC(CBr)C1 Amb24571977 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.8 CC1CC(C)CC(CCl)C1 Amb26062797 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.8 CC1CC(C)CC(CN)C1 Amb25274571 [0,1,0,0,0,0|3,0,0]=4 111 B10R1.8 CC1CC(C)CC(CN)C1 Amb32666981 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.8 CC1CC(C)CC(CO)C1 Amb27839100 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.8 CC1CC(C)OC(CCl)O1 Amb27165154 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.8 CC1CC(C)OC(CO)C1 Amb27213605 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.8 CC1CC(C=O)CC(C)O1 Amb25128909 [0,1,0,0,0,0|2,0,1]=4 116 B10R1.8 CC1CC(CN)CC(C)O1 Amb26987135 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.8 CC1CC(CO)CC(C)N1 Amb23535940 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.8 CC1CC(CO)CC(C)O1 Amb28121883 [0,1,0,0,0,0|2,0,0]=3 119 B10R1.8 CC1CC(NN)CC(C)O1 Amb25774156 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.8 CC1CC(NN)CC(C)O1 Amb32686508 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.8 CC1CC(NN)CC(C)O1 Amb33072390 [0,1,0,0,0,0|3,0,0]=4 122 B10R1.8 CC1CC(NO)CC(C)O1 Amb27756747 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.8 CC1CC(O)CC(CO)O1 Amb27763776 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.8 CC1CN(C)CC(CN)O1 Amb18063827 [0,1,0,0,0,0|3,0,0]=4 125 B10R1.8 CCC1CC(C)CC(C)N1 Amb33275602 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.8 CCC1CC(C)NC(C)C1 Amb25839023 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.8 CCC1CC(C)OC(O)C1 Amb28050677 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.8 CCC1OC(C)OC(C)O1 Amb22229595 [0,1,0,0,0,0|0,0,0]=1 129 B10R1.8 CC[C@@H]1C[C@@H](O)C[C@H](C)O1 Amb27427798 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.8 CC[C@H]1C[C@H](O)C[C@@H](C)O1 Amb27199334 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.8 CCb1ob(C)ob(C)o1 Amb27423847 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.8 CNC1CC(C)CC(C)C1 Amb28138807 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.8 CNC1CC(C)OC(C)C1 Amb25853611 [0,1,0,0,0,0|2,0,0]=3 134 B10R1.8 COC1CC(O)CC(C)O1 Amb28065117 [0,1,0,0,0,0|3,0,0]=4 135 B10R1.8 CO[C@@H]1C[C@H](O)C[C@@H](C)O1 Amb27197212 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.8 CO[C@H]1C[C@@H](N)C[C@H](C)O1 Amb27430462 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.8 CO[C@H]1C[C@H](O)C[C@H](C)O1 Amb27662356 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.8 C[C@@H]1C[C@@H](CO)O[C@H](C)C1 Amb27202831 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.8 C[C@H]1CC(C#N)C[C@@H](C)O1 Amb25289312 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.8 C[C@H]1CC(C=O)C[C@@H](C)O1 Amb27956037 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.8 C[C@H]1CC(CCl)C[C@@H](C)O1 Amb33098962 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.8 C[C@H]1CC(CN)C[C@@H](C)O1 Amb27621649 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.8 C[C@H]1CC(CO)C[C@@H](C)O1 Amb32680761 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.8 C[C@H]1C[C@@H](CBr)C[C@@H](C)O1 Amb32686614 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.8 C[C@H]1C[C@@H](CO)C[C@@H](C)O1 Amb32687517 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.22 CC1CC(C)C(C)C(C)C1 Amb27392468 [0,1,0,0,0,0|3,0,0]=4 147 B10R1.22 CC1CC(Cl)C(C)C(C)O1 Amb28137988 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.22 CC1CC(O)C(O)C(C)O1 Amb28050692 [0,1,0,0,0,0|3,0,0]=4 149 B10R1.22 CC1CN(C)C(C)C(C)O1 Amb28126770 [0,1,0,0,0,0|3,0,0]=4 150 B10R1.22 CC1OC(O)OC(C)C1O Amb27602934 [0,1,0,0,0,0|2,0,0]=3 151 B10R1.22 CC1OS(=O)O[C@@H](C)[C@@H]1Cl Amb27788472 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.22 C[C@@H]1OC(O)O[C@H](C)[C@H]1O Amb27651837 [0,1,0,0,0,0|2,0,0]=3 153 B10R1.22 C[C@@H]1OS(=O)O[C@@H](C)C1Cl Amb27477915 [0,1,0,0,0,0|3,0,0]=4 154 B10R1.22 C[C@@H]1OS(=O)O[C@H](C)[C@H]1Cl Amb27645469 [0,1,0,0,0,0|3,0,0]=4 155 B10R1.22 C[C@@H]1O[C@@H](C)O[C@H](C)[C@H]1Cl Amb28051831 [0,1,0,0,0,0|1,0,0]=2 156 B10R1.22 C[C@@H]1O[C@H](C)N[C@H](C)[C@@H]1C Amb27960317 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.22 C[C@@H]1O[C@H](C)O[C@@H](C)[C@H]1Cl Amb28458558 [0,1,0,0,0,0|1,0,0]=2 158 B10R1.22 C[C@H]1C[C@@H](C)C[C@@H](C)[C@H]1O Amb27662118 [0,1,0,0,0,0|3,0,0]=4 159 B10R1.329 CC1=NC(C)(C)CC(C)O1 Amb6356508 [0,1,0,0,0,0|2,0,1]=4 160 B10R1.329 CC1CC(C)(C)CC(O)O1 Amb28206454 [0,1,0,0,0,0|3,0,0]=4 161 B10R1.329 CC1CC(C)(C)OC(C)N1 Amb26003672 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.329 CC1CC(C)(N)CC(C)O1 Amb27625045 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.329 CC1CC(C)(O)CC(C)O1 Amb27490456 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.329 CC1CC(C)CC(C)(C)C1 Amb22227676 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.329 CC1CC(C)CC(C)(N)C1 Amb24633178 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.329 CC1CC(C)CC(C)(O)C1 Amb27881672 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.329 CC1CC(C)OC(C)(C)N1 Amb28240355 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.329 CC1CC(C)OS(=O)(=O)O1 Amb33621263 [0,1,0,0,0,0|3,0,0]=4 169 B10R1.329 CC1CC(C)O[Rh](C)(C)O1 Amb35825058 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.329 CC1C[C@@H](C)CC(C)(N)C1 Amb27978039 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.329 C[C@@H]1C[C@@H](C)CC(C)(C)C1 Amb25163880 [0,1,0,0,0,0|3,0,0]=4 172 B10R1.329 C[C@H]1CC(C)(N)C[C@@H](C)O1 Amb32654931 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.329 C[C@H]1C[C@@H](C)C[C@@](C)(N)C1 Amb28456636 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.329 C[C@H]1NC(C)(C)C[C@@H](C)O1 Amb28457245 [0,1,0,0,0,0|2,0,0]=3 175 B8R0.5 CC(C)CC(C)OCCl Amb27861803 [0,0,1,0,0,0|3,0,0]=4 176 B8R0.5 CC(O)CC(C)CCO Amb27970261 [0,0,1,0,0,0|3,0,0]=4 177 B8R0.5 CC(O)OC(C)CC=O Amb27827462 [0,0,1,0,0,0|2,0,1]=4 178 B8R0.5 CCCC(C)CC(C)Br Amb27779289 [0,0,1,0,0,0|3,0,0]=4 179 B8R0.5 CCCC(C)CC(C)C Amb22228271 [0,0,1,0,0,0|3,0,0]=4 180 B8R0.5 CCCC(C)CC(C)O Amb22229840 [0,0,1,0,0,0|2,0,0]=3 181 B8R0.5 CCCC(C)CN(C)O Amb33322352 [0,0,1,0,0,0|3,0,0]=4 182 B8R0.5 CCCC(C)C[C@@H](C)N Amb33321142 [0,0,1,0,0,0|3,0,0]=4 183 B8R0.5 CCCC(C)C[C@@H](C)O Amb33321139 [0,0,1,0,0,0|2,0,0]=3 184 B8R0.5 CCCC(C)C[C@H](C)N Amb33321141 [0,0,1,0,0,0|3,0,0]=4 185 B8R0.5 CCCC(C)C[C@H](C)O Amb33321088 [0,0,1,0,0,0|2,0,0]=3 186 B8R0.5 CCCC(C)NC(C)C Amb6685546 [0,0,1,0,0,0|3,0,0]=4 187 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,0,1,0,0,0|1,0,2]=4 188 B8R0.5 CCCC(O)CC(C)O Amb27484551 [0,0,1,0,0,0|3,0,0]=4 189 B8R0.5 CCCN(C)CC(C)O Amb17334132 [0,0,1,0,0,0|3,0,0]=4 190 B8R0.5 CCC[C@H](O)C[C@H](C)O Amb27653094 [0,0,1,0,0,0|3,0,0]=4 191 B8R0.5 CCC[C@H](S)C[C@H](C)O Amb28049110 [0,0,1,0,0,0|3,0,0]=4 192 B8R0.5 CCOC(=N)CC(C)O Amb27985370 [0,0,1,0,0,0|2,0,1]=4 193 B8R0.5 CCOC(=O)CC(C)O Amb3940380 [0,0,1,0,0,0|2,0,1]=4 194 B8R0.5 CCOC(=O)C[C@@H](C)O Amb4166314 [0,0,1,0,0,0|2,0,1]=4 195 B8R0.5 CCOC(=O)C[C@H](C)O Amb4166317 [0,0,1,0,0,0|2,0,1]=4 196 B8R0.5 CCOC(=O)OC(C)Br Amb27461313 [0,0,1,0,0,0|2,0,1]=4 197 B8R0.5 CCOC(=O)OC(C)Cl Amb8385744 [0,0,1,0,0,0|2,0,1]=4 198 B8R0.5 CCOC(C)CC(=O)O Amb9397849 [0,0,1,0,0,0|2,0,1]=4 199 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,0,1,0,0,0|1,0,2]=4 200 B8R0.5 CCOC(C)CC(C)Br Amb26064110 [0,0,1,0,0,0|2,0,0]=3 201 B8R0.5 CCOC(C)CC(C)O Amb26629604 [0,0,1,0,0,0|1,0,0]=2 202 B8R0.5 CCOC(C)CN(C)O Amb33425716 [0,0,1,0,0,0|2,0,0]=3 203 B8R0.5 CCOC(C)C[C@@H](C)N Amb33425065 [0,0,1,0,0,0|2,0,0]=3 204 B8R0.5 CCOC(C)C[C@@H](C)O Amb33425062 [0,0,1,0,0,0|1,0,0]=2 205 B8R0.5 CCOC(C)C[C@H](C)N Amb33425064 [0,0,1,0,0,0|2,0,0]=3 206 B8R0.5 CCOC(C)C[C@H](C)O Amb33225080 [0,0,1,0,0,0|1,0,0]=2 207 B8R0.5 CCOC(C)OC(C)=O Amb17689197 [0,0,1,0,0,0|0,0,2]=3 208 B8R0.5 CCOC(C)OC(C)O Amb27836029 [0,0,1,0,0,0|0,0,0]=1 209 B8R0.5 CCOC(Cl)CC(C)Cl Amb27658952 [0,0,1,0,0,0|3,0,0]=4 210 B8R0.5 CCOC(Cl)OC(C)=O Amb28145161 [0,0,1,0,0,0|1,0,2]=4 211 B8R0.5 CCON(C)CC(C)N Amb27467750 [0,0,1,0,0,0|3,0,0]=4 212 B8R0.5 CCO[C@@H](C)CC(C)=O Amb27424691 [0,0,1,0,0,0|1,0,2]=4 213 B8R0.5 CCO[C@@H](C)C[C@@H](C)O Amb27481375 [0,0,1,0,0,0|1,0,0]=2 214 B8R0.5 CCO[C@@H](C)C[C@H](C)O Amb27424949 [0,0,1,0,0,0|1,0,0]=2 215 B8R0.5 CNCC(C)CC(C)O Amb27786755 [0,0,1,0,0,0|3,0,0]=4 216 B8R0.5 CNCC(C)OC(C)C Amb19024882 [0,0,1,0,0,0|3,0,0]=4 217 B8R0.5 COCC(C)CC(C)O Amb27796096 [0,0,1,0,0,0|3,0,0]=4 218 B8R0.5 C[C@@H](O)C[C@H](C)CCO Amb27766934 [0,0,1,0,0,0|3,0,0]=4 219 B8R0.5 C[C@H](O)C[C@@H](C)CCO Amb27598607 [0,0,1,0,0,0|3,0,0]=4 220 B10R2.71 CC1CC2CCC(C1)N2 Amb23598232 [0,0,0,1,0,0|3,0,0]=4 221 B10R2.71 CC1CC2CCC(C2)N1 Amb25146114 [0,0,0,1,0,0|3,0,0]=4 222 B10R2.71 NC1CC2CCC(C1)O2 Amb23439385 [0,0,0,1,0,0|3,0,0]=4 223 B10R2.71 NC1CC2CCC(C1)O2 Amb24480354 [0,0,0,1,0,0|3,0,0]=4 224 B10R2.71 NC1C[C@H]2CC[C@H](C1)O2 Amb27203961 [0,0,0,1,0,0|3,0,0]=4 225 B10R2.71 N[C@@H]1C[C@@H]2CC[C@H](C1)O2 Amb26902259 [0,0,0,1,0,0|3,0,0]=4 226 B10R2.71 N[C@H]1C[C@@H]2CC[C@H](C1)O2 Amb23439386 [0,0,0,1,0,0|3,0,0]=4 227 B10R2.71 OC1CC2CCC(C1)O2 Amb22365313 [0,0,0,1,0,0|3,0,0]=4 228 B10R2.71 OC1C[C@@H]2CC[C@H](C1)O2 Amb28049250 [0,0,0,1,0,0|3,0,0]=4 229 B10R2.71 OC1C[C@H]2CC[C@H](C1)O2 Amb27853756 [0,0,0,1,0,0|3,0,0]=4 230 B10R2.71 O[C@@H]1C[C@@H]2CC[C@H](C1)O2 Amb24183499 [0,0,0,1,0,0|3,0,0]=4 231 B10R2.71 O[C@H]1C[C@@H]2CC[C@H](C1)O2 Amb24183471 [0,0,0,1,0,0|3,0,0]=4 232 B8R1.18 CC1=NC(C)C(C)N1 Amb30021239 [0,0,0,0,1,0|2,0,1]=4 233 B8R1.18 CC1=NC(C)OC1C Amb20242408 [0,0,0,0,1,0|1,0,1]=3 234 B8R1.18 CC1=NC(C)SC1C Amb26353202 [0,0,0,0,1,0|1,1,1]=4 235 B8R1.18 CC1CC(=O)C(C)O1 Amb26869093 [0,0,0,0,1,0|2,0,1]=4 236 B8R1.18 CC1CC(=O)OC1C Amb27873473 [0,0,0,0,1,0|2,0,1]=4 237 B8R1.18 CC1CC(Br)C(C)O1 Amb27476404 [0,0,0,0,1,0|2,0,0]=3 238 B8R1.18 CC1CC(C)C(=O)O1 Amb4017434 [0,0,0,0,1,0|2,0,1]=4 239 B8R1.18 CC1CC(C)C(C)C1 Amb4019560 [0,0,0,0,1,0|2,0,0]=3 240 B8R1.18 CC1CC(N)C(C)N1 Amb27808331 [0,0,0,0,1,0|3,0,0]=4 241 B8R1.18 CC1CC(N)C(C)O1 Amb24619349 [0,0,0,0,1,0|2,0,0]=3 242 B8R1.18 CC1CC(N)C(C)O1 Amb30585143 [0,0,0,0,1,0|2,0,0]=3 243 B8R1.18 CC1CC(O)C(C)N1 Amb23453938 [0,0,0,0,1,0|3,0,0]=4 244 B8R1.18 CC1CC(O)CC1C Amb28350247 [0,0,0,0,1,0|3,0,0]=4 245 B8R1.18 CC1CC(O)C[C@H]1C Amb27485056 [0,0,0,0,1,0|3,0,0]=4 246 B8R1.18 CC1CC(O)ON1C Amb27472587 [0,0,0,0,1,0|3,0,0]=4 247 B8R1.18 CC1CC(S)C(C)O1 Amb22234723 [0,0,0,0,1,0|2,0,0]=3 248 B8R1.18 CC1C[C@H](C)[C@@H](C)C1 Amb26966244 [0,0,0,0,1,0|2,0,0]=3 249 B8R1.18 CC1C[C@H](O)[C@H](C)O1 Amb27855467 [0,0,0,0,1,0|2,0,0]=3 250 B8R1.18 CC1NC(=O)OC1C Amb25747248 [0,0,0,0,1,0|2,0,1]=4 251 B8R1.18 CC1NC(=S)OC1C Amb28123435 [0,0,0,0,1,0|2,0,1]=4 252 B8R1.18 CC1OC(=O)OC1C Amb27485944 [0,0,0,0,1,0|1,0,1]=3 253 B8R1.18 CC1OS(=O)OC1C Amb25997586 [0,0,0,0,1,0|2,0,0]=3 254 B8R1.18 C[C@@H]1C[C@@H](C)C(O)O1 Amb27430981 [0,0,0,0,1,0|2,0,0]=3 255 B8R1.18 C[C@@H]1NC(=O)O[C@@H]1C Amb28132650 [0,0,0,0,1,0|2,0,1]=4 256 B8R1.18 C[C@@H]1OC(O)C[C@H]1C Amb27432218 [0,0,0,0,1,0|2,0,0]=3 257 B8R1.18 C[C@@H]1O[C@H](O)C[C@H]1C Amb27215270 [0,0,0,0,1,0|2,0,0]=3 258 B8R1.18 C[C@H]1CC(=O)O[C@H]1C Amb27471867 [0,0,0,0,1,0|2,0,1]=4 259 B8R1.18 C[C@H]1CC(=O)[C@H](C)O1 Amb28246509 [0,0,0,0,1,0|2,0,1]=4 260 B8R1.18 C[C@H]1CC(O)O[C@H]1C Amb28321291 [0,0,0,0,1,0|2,0,0]=3 261 B8R1.18 C[C@H]1C[C@@H](C)C(=O)O1 Amb28060142 [0,0,0,0,1,0|2,0,1]=4 262 B8R1.18 C[C@H]1C[C@@H](O)C[C@H]1C Amb27659843 [0,0,0,0,1,0|3,0,0]=4 263 B8R1.18 C[C@H]1C[C@H](C)[C@H](C)C1 Amb27254053 [0,0,0,0,1,0|2,0,0]=3 264 B8R1.18 C[C@H]1C[C@H](O)C[C@H]1C Amb27946955 [0,0,0,0,1,0|3,0,0]=4 265 B8R1.18 C[C@H]1NC(=N)O[C@@H]1C Amb27420136 [0,0,0,0,1,0|2,0,1]=4 266 B7R0.2 CC(C)OC(C)CN Amb18992799 [1,0,1,0,0,0|2,0,0]=4 267 B7R0.2 CC(O)CC(C)CN Amb19337142 [1,0,1,0,0,0|2,0,0]=4 268 B7R0.2 CC(O)C[C@H](C)CO Amb27394893 [1,0,1,0,0,0|2,0,0]=4 269 B7R0.2 CCC(C)CC(C)Br Amb24757470 [1,0,1,0,0,0|2,0,0]=4 270 B7R0.2 CCC(C)CC(C)C Amb22228298 [1,0,1,0,0,0|2,0,0]=4 271 B7R0.2 CCC(C)CC(C)Cl Amb27639190 [1,0,1,0,0,0|2,0,0]=4 272 B7R0.2 CCC(C)CC(C)N Amb10069423 [1,0,1,0,0,0|2,0,0]=4 273 B7R0.2 CCC(C)CC(C)N Amb3940647 [1,0,1,0,0,0|2,0,0]=4 274 B7R0.2 CCC(C)CC(C)O Amb4035421 [1,0,1,0,0,0|1,0,0]=3 275 B7R0.2 CCC(C)CN(C)O Amb33373890 [1,0,1,0,0,0|2,0,0]=4 276 B7R0.2 CCC(C)C[C@@H](C)N Amb29854163 [1,0,1,0,0,0|2,0,0]=4 277 B7R0.2 CCC(C)C[C@@H](C)O Amb33318318 [1,0,1,0,0,0|1,0,0]=3 278 B7R0.2 CCC(C)C[C@H](C)N Amb29854162 [1,0,1,0,0,0|2,0,0]=4 279 B7R0.2 CCC(C)C[C@H](C)O Amb33318389 [1,0,1,0,0,0|1,0,0]=3 280 B7R0.2 CCC(C)NC(C)C Amb6685536 [1,0,1,0,0,0|2,0,0]=4 281 B7R0.2 CCC(Cl)OC(C)Cl Amb27984737 [1,0,1,0,0,0|2,0,0]=4 282 B7R0.2 CCC(N)CC(C)O Amb27604743 [1,0,1,0,0,0|2,0,0]=4 283 B7R0.2 CCC(O)CC(C)O Amb26515705 [1,0,1,0,0,0|2,0,0]=4 284 B7R0.2 CCN(C)CC(C)O Amb17334070 [1,0,1,0,0,0|2,0,0]=4 285 B7R0.2 CCN(C)C[C@@H](C)O Amb28316159 [1,0,1,0,0,0|2,0,0]=4 286 B7R0.2 CC[C@@H](O)C[C@@H](C)O Amb4166323 [1,0,1,0,0,0|2,0,0]=4 287 B7R0.2 CC[C@@H](O)C[C@H](C)O Amb27946301 [1,0,1,0,0,0|2,0,0]=4 288 B7R0.2 CC[C@H](C)CC(C)O Amb27437194 [1,0,1,0,0,0|1,0,0]=3 289 B7R0.2 CC[C@H](O)C[C@@H](C)O Amb27790287 [1,0,1,0,0,0|2,0,0]=4 290 B7R0.2 CC\C(C)=C\C(C)O Amb28128461 [1,0,1,0,0,0|1,0,1]=4 291 B7R0.2 CNC(C)CC(C)O Amb27230907 [1,0,1,0,0,0|2,0,0]=4 292 B7R0.2 COC(=O)OC(C)O Amb28207359 [1,0,1,0,0,0|1,0,1]=4 293 B7R0.2 COC(C)CC(C)Cl Amb27233539 [1,0,1,0,0,0|2,0,0]=4 294 B7R0.2 COC(C)CC(C)N Amb27194304 [1,0,1,0,0,0|2,0,0]=4 295 B7R0.2 COC(C)CC(C)O Amb22757067 [1,0,1,0,0,0|1,0,0]=3 296 B7R0.4 CCCCCC(C)O Amb8383668 [1,0,1,0,0,0|2,0,0]=4 297 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,0,1,0,0,0|2,0,0]=4 298 B7R0.4 CCCCC[C@H](C)O Amb8395591 [1,0,1,0,0,0|2,0,0]=4 299 B7R0.4 CCCCOC(C)Cl Amb17689402 [1,0,1,0,0,0|2,0,0]=4 300 B7R0.4 CCCCOC(C)O Amb26537694 [1,0,1,0,0,0|1,0,0]=3 301 B7R0.4 CCCCSC(C)O Amb27191967 [1,0,1,0,0,0|1,1,0]=4 302 B7R0.4 CCNCCC(C)O Amb27239293 [1,0,1,0,0,0|2,0,0]=4 303 B7R0.4 CCOCCC(C)Cl Amb28422675 [1,0,1,0,0,0|2,0,0]=4 304 B7R0.4 CCOCCC(C)N Amb7772189 [1,0,1,0,0,0|2,0,0]=4 305 B7R0.4 CCOCCC(C)O Amb27852957 [1,0,1,0,0,0|1,0,0]=3 306 B7R0.4 CCOCC[C@H](C)N Amb24439507 [1,0,1,0,0,0|2,0,0]=4 307 B7R0.4 CCOCC[C@H](C)O Amb27946039 [1,0,1,0,0,0|1,0,0]=3 308 B7R0.4 CCSCCC(C)O Amb28048927 [1,0,1,0,0,0|1,1,0]=4 309 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [1,0,1,0,0,0|1,1,0]=4 310 B7R0.4 CCSCC[C@H](C)O Amb33323733 [1,0,1,0,0,0|1,1,0]=4 311 B7R0.7 CCCC(C)CCC Amb22229829 [1,0,1,0,0,0|2,0,0]=4 312 B7R0.7 CCCC(C)CCO Amb22733616 [1,0,1,0,0,0|2,0,0]=4 313 B7R0.7 CCCC(C)NCC Amb22586730 [1,0,1,0,0,0|2,0,0]=4 314 B7R0.7 CCCC(C)NCC Amb9726218 [1,0,1,0,0,0|2,0,0]=4 315 B7R0.7 CCCC(C)OCC Amb22733741 [1,0,1,0,0,0|1,0,0]=3 316 B7R0.7 CCNC(C)CCO Amb8428187 [1,0,1,0,0,0|2,0,0]=4 317 B7R0.7 CCOC(=N)OCC Amb26911602 [1,0,1,0,0,0|1,0,1]=4 318 B7R0.7 CCOC(=O)OCC Amb6608863 [1,0,1,0,0,0|1,0,1]=4 319 B7R0.7 CCOC(C)CCBr Amb28123922 [1,0,1,0,0,0|2,0,0]=4 320 B7R0.7 CCOC(C)CCN Amb19022809 [1,0,1,0,0,0|2,0,0]=4 321 B7R0.7 CCOC(C)CCO Amb4017406 [1,0,1,0,0,0|1,0,0]=3 322 B7R0.7 CCOC(C)CCS Amb33424966 [1,0,1,0,0,0|1,1,0]=4 323 B7R0.7 CCOC(C)CNC Amb10608191 [1,0,1,0,0,0|2,0,0]=4 324 B7R0.7 CCOC(C)CNO Amb33425739 [1,0,1,0,0,0|2,0,0]=4 325 B7R0.7 CCOC(C)OCC Amb6891962 [1,0,1,0,0,0|0,0,0]=2 326 B7R0.7 CCOC(Cl)OCC Amb27750361 [1,0,1,0,0,0|1,0,0]=3 327 B7R0.7 CCOC(O)SCC Amb27653105 [1,0,1,0,0,0|1,1,0]=4 328 B7R0.7 CCOP(C)OCC Amb33544404 [1,0,1,0,0,0|1,0,0]=3 329 B7R0.7 CCOP(Cl)OCC Amb4297342 [1,0,1,0,0,0|2,0,0]=4 330 B7R0.7 CCOP(O)OCC Amb17938598 [1,0,1,0,0,0|2,0,0]=4 331 B7R0.7 CCOS(=O)OCC Amb8514410 [1,0,1,0,0,0|2,0,0]=4 332 B7R0.7 CCO[PH](=O)OCC Amb8513123 [1,0,1,0,0,0|2,0,0]=4 333 B7R0.7 CCO[PH](=S)OCC Amb4297286 [1,0,1,0,0,0|2,0,0]=4 334 B7R0.7 CCO[SiH](C)OCC Amb8517630 [1,0,1,0,0,0|0,1,0]=3 335 B7R0.7 CCO[SiH](Cl)OCC Amb27838961 [1,0,1,0,0,0|1,1,0]=4 336 B7R0.7 CCSC(C)CCO Amb26655908 [1,0,1,0,0,0|1,1,0]=4 337 B7R1.3 CC1CCCCO1 Amb4035049 [2,0,0,0,0,0|2,0,0]=4 338 B7R1.3 CC1CCOCC1 Amb22043825 [2,0,0,0,0,0|2,0,0]=4 339 B7R1.3 CC1CCOCN1 Amb32651825 [2,0,0,0,0,0|2,0,0]=4 340 B7R1.3 CC1CCOCO1 Amb17776591 [2,0,0,0,0,0|1,0,0]=3 341 B7R1.3 CC1NCCCO1 Amb17506191 [2,0,0,0,0,0|2,0,0]=4 342 B7R1.3 CC1OCCCO1 Amb26557606 [2,0,0,0,0,0|1,0,0]=3 343 B9R0.4 CC(O)CC(C)NCCO Amb27974890 [0,1,1,0,0,0|2,0,0]=4 344 B9R0.4 CCCCC(C)CC(C)O Amb27839043 [0,1,1,0,0,0|2,0,0]=4 345 B9R0.4 CCNCC(C)CC(C)O Amb27961754 [0,1,1,0,0,0|2,0,0]=4 346 B9R0.4 CCNCC(C)OC(C)C Amb27194259 [0,1,1,0,0,0|2,0,0]=4 347 B9R0.4 CCOCC(C)NC(C)C Amb27755002 [0,1,1,0,0,0|2,0,0]=4 348 B9R0.4 CCOCC(C)OC(C)=O Amb22732225 [0,1,1,0,0,0|0,0,2]=4 349 B9R0.4 COCCC(C)CC(C)O Amb27399300 [0,1,1,0,0,0|2,0,0]=4 350 B9R0.6 CCCC(C)C(C)C(C)O Amb28126833 [0,1,1,0,0,0|2,0,0]=4 351 B9R0.6 CCCC(C)C(O)C(C)O Amb28126834 [0,1,1,0,0,0|2,0,0]=4 352 B9R0.6 CCNC(C)C(C)C(C)O Amb32950250 [0,1,1,0,0,0|2,0,0]=4 353 B9R0.6 CCOC(C)C(=O)C(C)N Amb33425730 [0,1,1,0,0,0|2,0,0]=4 354 B9R0.6 CCOC(C)C(=O)C(O)O Amb25870960 [0,1,1,0,0,0|2,0,0]=4 355 B9R0.6 CCON(C)C(=O)C(C)O Amb27835865 [0,1,1,0,0,0|2,0,0]=4 356 B9R0.14 CCCC(CC)NC(C)O Amb27852114 [0,1,1,0,0,0|2,0,0]=4 357 B9R0.14 CCCC(CN)OC(C)C Amb26971866 [0,1,1,0,0,0|2,0,0]=4 358 B9R0.14 CCOC(CN)CC(C)C Amb24663898 [0,1,1,0,0,0|2,0,0]=4 359 B9R0.23 CCN(C)C(C)CC(C)O Amb27839041 [0,1,1,0,0,0|2,0,0]=4 360 B9R0.34 CCCC(C)CC(C)CO Amb27869680 [0,1,1,0,0,0|2,0,0]=4 361 B9R0.34 CCCC(C)CC(O)CC Amb27946318 [0,1,1,0,0,0|2,0,0]=4 362 B9R0.34 CCCC(C)CC(O)CN Amb24718688 [0,1,1,0,0,0|2,0,0]=4 363 B9R0.34 CCCC(C)N[C@@H](C)CO Amb27983372 [0,1,1,0,0,0|2,0,0]=4 364 B9R0.34 CCC[C@@H](C)C[C@@H](C)CO Amb26920680 [0,1,1,0,0,0|2,0,0]=4 365 B9R0.34 CCC[C@@H](C)C[C@H](C)CO Amb26632583 [0,1,1,0,0,0|2,0,0]=4 366 B9R0.34 CCOC(=O)OC(C)CO Amb28190260 [0,1,1,0,0,0|1,0,1]=4 367 B9R0.34 CCOC(C)CC(N)CO Amb33425390 [0,1,1,0,0,0|2,0,0]=4 368 B9R0.34 CCOC(C)CC(O)CN Amb33425019 [0,1,1,0,0,0|1,0,0]=3 369 B9R0.34 CCOC(C)OC(C)C#N Amb27961707 [0,1,1,0,0,0|1,0,0]=3 370 B9R0.34 CCOC(C)OC(C)CO Amb28436929 [0,1,1,0,0,0|0,0,0]=2 371 B9R0.34 CCOC(C)O[C@H](C)C=O Amb28123331 [0,1,1,0,0,0|0,0,1]=3 372 B9R0.34 CCOC(C)O[C@H](C)CO Amb22363059 [0,1,1,0,0,0|0,0,0]=2 373 B9R0.34 CCOC(O)CC(O)CCl Amb27618662 [0,1,1,0,0,0|2,0,0]=4 374 B9R0.34 CNCC(C)OC(C)CO Amb27465623 [0,1,1,0,0,0|2,0,0]=4 375 B9R0.34 COC(C)CC(C)OCO Amb27757417 [0,1,1,0,0,0|2,0,0]=4 376 B9R0.34 COCC(C)OC(C)CO Amb26959238 [0,1,1,0,0,0|2,0,0]=4 377 B9R0.34 CO[C@@H](C)O[C@H](C)CCO Amb28187818 [0,1,1,0,0,0|2,0,0]=4 378 B9R0.44 CCCC(C)CC(C)(C)O Amb27633139 [0,1,1,0,0,0|2,0,0]=4 379 B9R0.44 CCOC(C)CC(C)(C)N Amb33425736 [0,1,1,0,0,0|2,0,0]=4 380 B9R0.44 CCOC(C)CC(C)(C)O Amb33425397 [0,1,1,0,0,0|1,0,0]=3 381 B9R0.44 COCC(C)OC(C)(C)O Amb25865711 [0,1,1,0,0,0|2,0,0]=4 382 B9R0.53 BC(OC(C)C)OC(C)C Amb33512915 [0,1,1,0,0,0|2,0,0]=4 383 B9R0.53 CB(OC(C)C)OC(C)C Amb22338755 [0,1,1,0,0,0|2,0,0]=4 384 B9R0.53 CC(C)CC(C)CC(C)O Amb33546273 [0,1,1,0,0,0|2,0,0]=4 385 B9R0.53 CC(C[C@H](C)O)C[C@@H](C)O Amb28453488 [0,1,1,0,0,0|2,0,0]=4 386 B9R0.58 CCCC(C)(C)CC(C)O Amb27981022 [0,1,1,0,0,0|2,0,0]=4 387 B9R0.58 CCSC(C)(C)CC(C)O Amb28050739 [0,1,1,0,0,0|1,1,0]=4 388 B9R1.2 C#C[C@@H]1OCC[C@H](C)O1 Amb25248581 [1,1,0,0,0,0|1,0,1]=4 389 B9R1.2 CC1CC(CBr)CCO1 Amb28241202 [1,1,0,0,0,0|2,0,0]=4 390 B9R1.2 CC1CC(CN)CCO1 Amb22059410 [1,1,0,0,0,0|2,0,0]=4 391 B9R1.2 CC1CC(CN)CCO1 Amb33291314 [1,1,0,0,0,0|2,0,0]=4 392 B9R1.2 CC1CC(CO)CCO1 Amb24679585 [1,1,0,0,0,0|2,0,0]=4 393 B9R1.2 CC1CCCC(CBr)O1 Amb28341224 [1,1,0,0,0,0|2,0,0]=4 394 B9R1.2 CC1CCCC(CI)O1 Amb27236991 [1,1,0,0,0,0|2,0,0]=4 395 B9R1.2 CC1CCCC(CN)O1 Amb25940618 [1,1,0,0,0,0|2,0,0]=4 396 B9R1.2 CC1CCOC(CBr)O1 Amb25684844 [1,1,0,0,0,0|1,0,0]=3 397 B9R1.2 CC1CCOC(CCl)O1 Amb27751472 [1,1,0,0,0,0|1,0,0]=3 398 B9R1.2 CC1OCC[C@@H](C=O)O1 Amb27603449 [1,1,0,0,0,0|1,0,1]=4 399 B9R1.2 CCC1CCNC(C)O1 Amb33193375 [1,1,0,0,0,0|2,0,0]=4 400 B9R1.2 CCC1NC(C)CCO1 Amb33194316 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.2 CCC1NCCC(C)O1 Amb33193306 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.2 CNC1CCOC(C)C1 Amb26586090 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.2 CN[C@@H]1C[C@H](C)CCO1 Amb27964629 [1,1,0,0,0,0|2,0,0]=4 404 B9R1.2 C[C@@H]1CCC[C@@H](CO)O1 Amb27213296 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.2 C[C@@H]1CCO[C@@H](CBr)O1 Amb27444652 [1,1,0,0,0,0|1,0,0]=3 406 B9R1.2 C[C@@H]1CCO[C@@H](CO)C1 Amb28142359 [1,1,0,0,0,0|2,0,0]=4 407 B9R1.2 C[C@@H]1CCO[C@H](CBr)O1 Amb27794280 [1,1,0,0,0,0|1,0,0]=3 408 B9R1.2 C[C@@H]1C[C@@H](CO)CCO1 Amb33484246 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.2 C[C@@H]1C[C@H](C=O)OCO1 Amb28287271 [1,1,0,0,0,0|1,0,1]=4 410 B9R1.2 C[C@@H]1C[C@H](CO)OCO1 Amb27420526 [1,1,0,0,0,0|1,0,0]=3 411 B9R1.2 C[C@@H]1OCC[C@H](CO)O1 Amb27448605 [1,1,0,0,0,0|1,0,0]=3 412 B9R1.66 CC1CC(C)(C)NCO1 Amb28342312 [1,1,0,0,0,0|2,0,0]=4 413 B9R1.66 CC1CC(C)(C)OCN1 Amb27247368 [1,1,0,0,0,0|2,0,0]=4 414 B9R1.66 CC1CC(C)(N)CCO1 Amb32654929 [1,1,0,0,0,0|2,0,0]=4 415 B9R1.66 CC1CC(C)(N)CCO1 Amb32674661 [1,1,0,0,0,0|2,0,0]=4 416 B9R1.66 CC1CC(C)(O)CCO1 Amb26952131 [1,1,0,0,0,0|2,0,0]=4 417 B9R1.66 CC1CCCC(C)(C)O1 Amb24477890 [1,1,0,0,0,0|2,0,0]=4 418 B9R1.66 CC1CCNC(C)(C)O1 Amb27461422 [1,1,0,0,0,0|2,0,0]=4 419 B9R1.66 CC1CCOC(C)(C)N1 Amb33194284 [1,1,0,0,0,0|2,0,0]=4 420 B9R1.66 CC1CCOC(C)(C)O1 Amb27959633 [1,1,0,0,0,0|1,0,0]=3 421 B9R1.66 CC1NCCC(C)(C)O1 Amb33194423 [1,1,0,0,0,0|2,0,0]=4 422 B9R1.69 CC1OCC(N)C(C)O1 Amb27883486 [1,1,0,0,0,0|1,0,0]=3 423 B9R1.69 CC1OCC(O)C(C)O1 Amb27164355 [1,1,0,0,0,0|1,0,0]=3 424 B9R1.69 C[C@@H]1O[C@H](C)CC[C@@H]1N Amb27202482 [1,1,0,0,0,0|2,0,0]=4 425 B9R1.22 CC1CC(C#N)C(C)O1 Amb27630180 [0,1,0,0,1,0|1,0,1]=4 426 B9R1.22 CC1CC(C=O)C(C)O1 Amb27859589 [0,1,0,0,1,0|1,0,1]=4 427 B9R1.22 CC1CC(CBr)C(C)O1 Amb28254737 [0,1,0,0,1,0|1,0,0]=3 428 B9R1.22 CC1CC(CCl)C(C)O1 Amb26422417 [0,1,0,0,1,0|1,0,0]=3 429 B9R1.22 CC1CC(CN)C(C)O1 Amb25955729 [0,1,0,0,1,0|1,0,0]=3 430 B9R1.22 CC1CC(NO)C(C)O1 Amb28060465 [0,1,0,0,1,0|2,0,0]=4 431 B9R1.22 CC1OC(=O)OC1CBr Amb28366962 [0,1,0,0,1,0|1,0,1]=4 432 B9R1.22 CC1OC(=O)OC1CCl Amb26457359 [0,1,0,0,1,0|1,0,1]=4 433 B9R1.22 CC1OC(=O)OC1CO Amb28315510 [0,1,0,0,1,0|1,0,1]=4 434 B9R1.22 CCC1OC(O)CC1C Amb27792433 [0,1,0,0,1,0|2,0,0]=4 435 B9R1.22 CC[C@H]1OC(O)C[C@@H]1C Amb27775528 [0,1,0,0,1,0|2,0,0]=4 436 B9R1.22 COC1OC(C)CC1O Amb27853814 [0,1,0,0,1,0|2,0,0]=4 437 B9R1.22 COC1OC(C)C[C@H]1O Amb28049134 [0,1,0,0,1,0|2,0,0]=4 438 B9R1.22 CO[C@@H]1O[C@H](C)C[C@H]1O Amb27788137 [0,1,0,0,1,0|2,0,0]=4 439 B9R1.22 C[C@@H]1OC(=O)O[C@H]1CO Amb27204022 [0,1,0,0,1,0|1,0,1]=4 440 B9R1.22 C[C@H]1C[C@@H](C)CC1CO Amb28319916 [0,1,0,0,1,0|2,0,0]=4 441 B9R1.22 C[C@H]1C[C@H](O)[C@H](CBr)O1 Amb27204861 [0,1,0,0,1,0|2,0,0]=4 442 B9R1.23 C#CC1O[C@H](C)[C@@H](C)O1 Amb25213003 [0,1,0,0,1,0|0,0,1]=3 443 B9R1.23 CC1CC(CO)OC1C Amb27484655 [0,1,0,0,1,0|1,0,0]=3 444 B9R1.23 CC1OC(C=O)OC1C Amb27591702 [0,1,0,0,1,0|0,0,1]=3 445 B9R1.23 CC1OC(CBr)O[C@@H]1C Amb27458141 [0,1,0,0,1,0|0,0,0]=2 446 B9R1.23 CC1OC(CO)CC1O Amb27237511 [0,1,0,0,1,0|2,0,0]=4 447 B9R1.23 C[C@@H]1OC(CBr)O[C@H]1C Amb27984940 [0,1,0,0,1,0|0,0,0]=2 448 B9R1.23 C[C@@H]1O[C@@H](CBr)C[C@H]1O Amb27433950 [0,1,0,0,1,0|2,0,0]=4 449 B9R1.23 C[C@@H]1O[C@H](CBr)O[C@@H]1C Amb28125037 [0,1,0,0,1,0|0,0,0]=2 450 B9R1.23 C[C@@H]1O[C@H](CI)C[C@@H]1O Amb27871286 [0,1,0,0,1,0|2,0,0]=4 451 B9R1.23 C[C@@H]1O[C@H](CN)C[C@H]1O Amb27216694 [0,1,0,0,1,0|2,0,0]=4 452 B9R1.23 C[C@@H]1O[C@H](CO)C[C@@H]1O Amb26450794 [0,1,0,0,1,0|2,0,0]=4 453 B9R1.23 C[C@H]1OC(CBr)O[C@@H]1C Amb28051830 [0,1,0,0,1,0|0,0,0]=2 454 B9R1.23 C[C@H]1OC(CCl)O[C@@H]1C Amb27788139 [0,1,0,0,1,0|0,0,0]=2 455 B9R1.23 C[C@H]1O[C@H](CBr)C[C@@H]1O Amb28244721 [0,1,0,0,1,0|2,0,0]=4 456 B9R1.23 C[C@H]1O[C@H](CN)C[C@@H]1O Amb27629769 [0,1,0,0,1,0|2,0,0]=4 457 B9R1.23 C[C@H]1O[C@H](CO)C[C@@H]1O Amb27849652 [0,1,0,0,1,0|2,0,0]=4 458 B9R1.36 CC1(C)O[C@H](N)[C@@H](O)O1 Amb8390676 [0,1,0,0,1,0|2,0,0]=4 459 B9R1.36 CC1CC(C)(C)CC1C Amb22227642 [0,1,0,0,1,0|2,0,0]=4 460 B9R1.36 CC1CC(C)(O)CC1C Amb24477851 [0,1,0,0,1,0|2,0,0]=4 461 B9R1.36 CC1OC(C)(C)CC1O Amb27956476 [0,1,0,0,1,0|2,0,0]=4 462 B9R1.36 CC1OP(=O)(Cl)OC1C Amb26885575 [0,1,0,0,1,0|2,0,0]=4 463 B9R1.36 CC1OS(=O)(=O)OC1C Amb27956510 [0,1,0,0,1,0|2,0,0]=4 464 B9R1.36 C[C@H]1OP(=O)(Cl)O[C@@H]1C Amb22350643 [0,1,0,0,1,0|2,0,0]=4 465 B9R1.37 CC1CC(C)C(C)C1C Amb24584907 [0,1,0,0,1,0|2,0,0]=4 466 B9R1.37 CC1NC(C)C(C)C1C Amb27230498 [0,1,0,0,1,0|2,0,0]=4 467 B9R1.37 CC1OC(C)C(Br)C1C Amb32655341 [0,1,0,0,1,0|1,0,0]=3 468 B9R1.37 CC1OC(C)C(Cl)C1C Amb32655338 [0,1,0,0,1,0|1,0,0]=3 469 B9R1.37 CC1OC(C)C(N)C1C Amb26032854 [0,1,0,0,1,0|1,0,0]=3 470 B9R1.37 CC1OC(C)C(N)C1C Amb28555346 [0,1,0,0,1,0|1,0,0]=3 471 B9R1.37 CC1OC(C)C(O)C1C Amb28205963 [0,1,0,0,1,0|1,0,0]=3 472 B9R1.37 CC1OC(C)C(O)C1O Amb28049128 [0,1,0,0,1,0|2,0,0]=4 473 B9R1.37 CC1OC(O)C(O)C1C Amb27956542 [0,1,0,0,1,0|2,0,0]=4 474 B9R1.37 C[C@@H]1OC(O)[C@@H](O)[C@H]1C Amb27218953 [0,1,0,0,1,0|2,0,0]=4 475 B9R1.37 C[C@@H]1OC(O)[C@H](O)[C@@H]1C Amb27220600 [0,1,0,0,1,0|2,0,0]=4 476 B9R1.37 C[C@@H]1O[C@@H](C)[C@@H](O)[C@@H]1O Amb27196787 [0,1,0,0,1,0|2,0,0]=4 477 B9R1.37 C[C@@H]1O[C@H](C)[C@H](O)[C@H]1O Amb27631907 [0,1,0,0,1,0|2,0,0]=4 478 B9R1.37 C[C@H]1O[C@H](C)[C@@H](O)[C@@H]1O Amb27970482 [0,1,0,0,1,0|2,0,0]=4 479 B9R1.38 CC1CC(C)(N)C(C)O1 Amb32654935 [0,1,0,0,1,0|1,0,0]=3 480 B9R1.38 CC1CC(C)C(C)(C)C1 Amb26008978 [0,1,0,0,1,0|2,0,0]=4 481 B9R1.38 CC1CC(C)C(C)(O)C1 Amb27488714 [0,1,0,0,1,0|2,0,0]=4 482 B11R1.512 CC1CC(C)OC(C)(C)CN1 Amb27598881 [0,1,0,0,0,1|2,0,0]=4 483 B11R1.952 C[C@@H]1C[C@@H](C)O[C@@H](CO)CO1 Amb28079131 [0,1,0,0,0,1|1,0,0]=3 484 B11R1.9 CCC1OC(C)OC(CC)O1 Amb22228332 [0,2,0,0,0,0|0,0,0]=2 485 B11R1.9 COC1C[C@H](OC)C[C@H](C)O1 Amb28254667 [0,2,0,0,0,0|2,0,0]=4 486 B11R1.10 CC1CC(C)(C)OC(CCl)O1 Amb28076703 [0,2,0,0,0,0|1,0,0]=3 487 B11R1.10 CC1CC(C=O)OC(C)(C)O1 Amb25046686 [0,2,0,0,0,0|1,0,1]=4 488 B11R1.10 CC1CC(CO)OC(C)(C)O1 Amb27169842 [0,2,0,0,0,0|1,0,0]=3 489 B11R1.10 CCC1NC(C)(C)CC(C)O1 Amb27793139 [0,2,0,0,0,0|2,0,0]=4 490 B11R1.10 CCC1NC(C)CC(C)(C)O1 Amb26594194 [0,2,0,0,0,0|2,0,0]=4 491 B11R1.10 COB1OC(C)CC(C)(C)O1 Amb25064759 [0,2,0,0,0,0|2,0,0]=4 492 B11R1.10 C[C@@H]1C[C@@H](C=O)OC(C)(C)O1 Amb27437822 [0,2,0,0,0,0|1,0,1]=4 493 B11R1.10 C[C@@H]1C[C@H](C=O)OC(C)(C)O1 Amb27432673 [0,2,0,0,0,0|1,0,1]=4 494 B11R1.10 C[C@@H]1C[C@H](CO)OC(C)(C)O1 Amb27206108 [0,2,0,0,0,0|1,0,0]=3 495 B11R1.34 CC1CC(CCN)CC(C)O1 Amb25211220 [0,2,0,0,0,0|2,0,0]=4 496 B11R1.34 CC1CC(CCN)CC(C)O1 Amb33537358 [0,2,0,0,0,0|2,0,0]=4 497 B11R1.34 CC1CC(OCCl)CC(C)O1 Amb28388492 [0,2,0,0,0,0|2,0,0]=4 498 B11R1.34 CCNC1CC(C)OC(C)C1 Amb27859141 [0,2,0,0,0,0|2,0,0]=4 499 B11R1.34 CNCC1CC(C)OC(C)C1 Amb27433322 [0,2,0,0,0,0|2,0,0]=4 500 B11R1.34 CNCC1C[C@H](C)O[C@H](C)C1 Amb26896305 [0,2,0,0,0,0|2,0,0]=4 501 B11R1.34 CONC1C[C@H](C)O[C@H](C)C1 Amb28381404 [0,2,0,0,0,0|2,0,0]=4 502 B11R1.34 C[C@H]1CC(CC#N)C[C@@H](C)O1 Amb27224325 [0,2,0,0,0,0|2,0,0]=4 503 B11R1.34 C[C@H]1CC(CCN)C[C@@H](C)O1 Amb33098964 [0,2,0,0,0,0|2,0,0]=4 504 B11R1.1180 CC1CC(C)(C=O)CC(C)O1 Amb33495105 [0,2,0,0,0,0|2,0,0]=4 505 B11R1.1180 CC1CC(C)(CN)CC(C)O1 Amb32752750 [0,2,0,0,0,0|2,0,0]=4 506 B11R1.1180 CC1CC(C)OC(C)(CCl)O1 Amb27849811 [0,2,0,0,0,0|1,0,0]=3 507 B11R1.1180 CC1CC(N)(CO)CC(C)O1 Amb27646088 [0,2,0,0,0,0|2,0,0]=4 508 B11R1.1180 CCC1(O)CC(C)OC(C)C1 Amb28200626 [0,2,0,0,0,0|2,0,0]=4 509 B11R1.1180 CCP1(=S)OC(C)CC(C)O1 Amb32863656 [0,2,0,0,0,0|2,0,0]=4 510 B11R1.1180 C[C@H]1CC(C)(CN)C[C@@H](C)O1 Amb32654905 [0,2,0,0,0,0|2,0,0]=4 511 B11R1.325 CC1CC(C)(O)C(O)C(C)O1 Amb27970499 [0,2,0,0,0,0|2,0,0]=4 512 B11R1.1361 CC1OC(C)(C)OC(C)C1=O Amb27823662 [0,2,0,0,0,0|1,0,0]=3 513 B11R1.1361 CC1OC(C)(C)OC(C)C1Cl Amb27828144 [0,2,0,0,0,0|1,0,0]=3 514 B11R1.1361 CC1OC(C)(C)O[C@H](C)C1Cl Amb28252423 [0,2,0,0,0,0|1,0,0]=3 515 B11R1.1361 C[C@@H]1OC(C)(C)O[C@H](C)[C@@H]1O Amb27980439 [0,2,0,0,0,0|1,0,0]=3 516 B11R1.1361 C[C@@H]1OC(C)(C)O[C@H](C)[C@H]1O Amb27472513 [0,2,0,0,0,0|1,0,0]=3 517 B11R1.1362 CC1CC(C)(C)OC(C)(C)N1 Amb33193886 [0,2,0,0,0,0|2,0,0]=4 518 B11R1.1362 C[C@@H]1CC(C)(C)NC(C)(C)O1 Amb27408524 [0,2,0,0,0,0|2,0,0]=4 519 B9R1.7 CC1OC[C@H](CCO)O1 Amb27978209 [0,0,1,1,0,0|2,0,0]=4 520 B9R1.7 CCCC1CCC(Cl)O1 Amb27424623 [0,0,1,1,0,0|2,0,0]=4 521 B9R1.7 CCCC1CCC(O)O1 Amb27589536 [0,0,1,1,0,0|1,0,0]=3 522 B9R1.7 CCNC1COC(C)C1 Amb30011413 [0,0,1,1,0,0|2,0,0]=4 523 B9R1.7 CCOC1CCC(=O)O1 Amb24117269 [0,0,1,1,0,0|0,0,2]=4 524 B9R1.7 CCO[C@@H]1C=C[C@@H](O)O1 Amb28069688 [0,0,1,1,0,0|0,0,2]=4 525 B9R1.7 CCO[C@@H]1C=C[C@H](O)O1 Amb27430739 [0,0,1,1,0,0|0,0,2]=4 526 B9R1.7 CCO[C@H]1CC[C@@H](N)C1 Amb27445592 [0,0,1,1,0,0|2,0,0]=4 527 B9R1.7 C\C=C\C1CCC(O)O1 Amb28065178 [0,0,1,1,0,0|1,0,1]=4 528 B9R1.13 CC(=O)OC1CCCO1 Amb22270198 [0,0,1,1,0,0|0,0,2]=4 529 B9R1.13 CC(Br)CC1CCCO1 Amb29857136 [0,0,1,1,0,0|2,0,0]=4 530 B9R1.13 CC(Cl)CC1CCCO1 Amb29857074 [0,0,1,1,0,0|2,0,0]=4 531 B9R1.13 CC(N)CC1CCCO1 Amb13952622 [0,0,1,1,0,0|2,0,0]=4 532 B9R1.13 CC(O)CC1CCCC1 Amb26484484 [0,0,1,1,0,0|2,0,0]=4 533 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,0,1,1,0,0|2,0,0]=4 534 B9R1.13 CC(O)CC1CCCO1 Amb27979742 [0,0,1,1,0,0|1,0,0]=3 535 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,0,1,1,0,0|1,1,0]=4 536 B9R1.13 CC(S)CC1CCCO1 Amb29857287 [0,0,1,1,0,0|1,1,0]=4 537 B9R1.13 CN(O)CC1CCCO1 Amb33318754 [0,0,1,1,0,0|2,0,0]=4 538 B9R1.13 C[C@@H](N)CC1CCCO1 Amb25048917 [0,0,1,1,0,0|2,0,0]=4 539 B9R1.13 C[C@@H](O)CC1CCCC1 Amb33315749 [0,0,1,1,0,0|2,0,0]=4 540 B9R1.13 C[C@@H](O)CC1CCCO1 Amb33318696 [0,0,1,1,0,0|1,0,0]=3 541 B9R1.13 C[C@@H](O)CC1CCCS1 Amb33415844 [0,0,1,1,0,0|1,1,0]=4 542 B9R1.13 C[C@@H](O)C[C@@H]1CCCO1 Amb27196849 [0,0,1,1,0,0|1,0,0]=3 543 B9R1.13 C[C@H](N)CC1CCCO1 Amb27804405 [0,0,1,1,0,0|2,0,0]=4 544 B9R1.13 C[C@H](O)CC1CCCC1 Amb33315750 [0,0,1,1,0,0|2,0,0]=4 545 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,0,1,1,0,0|1,0,0]=3 546 B9R1.13 C[C@H](O)CC1CCCS1 Amb33415845 [0,0,1,1,0,0|1,1,0]=4 547 B9R1.13 C[C@H](O)C[C@@H]1CCCN1 Amb28428898 [0,0,1,1,0,0|2,0,0]=4 548 B9R1.13 C[C@H](O)C[C@H]1CCCN1 Amb27786187 [0,0,1,1,0,0|2,0,0]=4 549 B9R1.13 C[C@H](O)C[C@H]1CCCO1 Amb28206139 [0,0,1,1,0,0|1,0,0]=3 550 B9R1.41 CC(Br)C1CCOC1C Amb27175166 [0,0,1,1,0,0|2,0,0]=4 551 B9R1.41 CC(N)C1CCOC1C Amb28321677 [0,0,1,1,0,0|2,0,0]=4 552 B9R1.41 CC(O)C1CCNC1C Amb35584409 [0,0,1,1,0,0|2,0,0]=4 553 B9R1.41 CC(O)C1OCOC1C Amb27424646 [0,0,1,1,0,0|2,0,0]=4 554 B9R1.41 CC1CCCC1[C@@H](C)O Amb28322680 [0,0,1,1,0,0|2,0,0]=4 555 B9R1.41 CC1OCCC1[C@@H](C)N Amb33427658 [0,0,1,1,0,0|2,0,0]=4 556 B9R1.41 CC1OCCC1[C@@H](C)O Amb33427681 [0,0,1,1,0,0|1,0,0]=3 557 B9R1.41 CC1OCCC1[C@H](C)N Amb33427682 [0,0,1,1,0,0|2,0,0]=4 558 B9R1.41 CC1OCCC1[C@H](C)O Amb33225339 [0,0,1,1,0,0|1,0,0]=3 559 B9R1.48 CC1CCCCC(O)C1 Amb28051128 [0,0,1,1,0,0|2,0,0]=4 560 B9R1.48 CC1COCCC(O)O1 Amb27771498 [0,0,1,1,0,0|2,0,0]=4 561 B9R1.59 CCOC1CC1C(C)N Amb35732341 [0,0,1,1,0,0|2,0,0]=4 562 B9R1.59 CCOC1CC1C(C)O Amb28049260 [0,0,1,1,0,0|1,0,0]=3 563 B9R1.75 CCCC(C)CC1CO1 Amb25769573 [0,0,1,1,0,0|2,0,0]=4 564 B9R1.75 CCOC(C)CC1CO1 Amb33225078 [0,0,1,1,0,0|1,0,0]=3 565 B9R1.137 CC(C[C@@H](C)O)C1CC1 Amb32728774 [0,0,1,1,0,0|2,0,0]=4 566 B9R1.137 CC(C[C@H](C)O)C1CC1 Amb32728773 [0,0,1,1,0,0|2,0,0]=4 567 B9R1.171 CC(O)CC1(C)CCC1 Amb27866005 [0,0,1,1,0,0|2,0,0]=4 568 B9R1.183 CCCC(C)C1OC1C Amb24596468 [0,0,1,1,0,0|2,0,0]=4 569 B9R1.183 CCOC(C)C1CC1N Amb33425409 [0,0,1,1,0,0|2,0,0]=4 570 B9R1.183 CCOC(C)[C@@H]1C[C@H]1N Amb33425410 [0,0,1,1,0,0|2,0,0]=4 571 B9R2.68 C1CC2CCC(C1)O2 Amb22364980 [1,0,0,1,0,0|2,0,0]=4 572 B11R2.1067 CC1OC(O)CC2(C)OC12 Amb27839354 [0,0,0,1,0,1|2,0,0]=4 573 B11R2.16 NCC1CC2CCC(C1)O2 Amb28187360 [0,1,0,1,0,0|2,0,0]=4 574 B11R2.16 OCC1CC2CCC(C1)O2 Amb27186649 [0,1,0,1,0,0|2,0,0]=4 575 B11R2.466 C[C@H]1CC2(CO2)C[C@@H](C)O1 Amb33731429 [0,1,0,1,0,0|2,0,0]=4 576 B11R2.432 CC1O[C@@H]2CO[C@H](O1)[C@H]2O Amb28247949 [0,1,0,1,0,0|2,0,0]=4 577 B7R0.5 C=COC(C)C(C)O Amb27405290 [0,0,1,0,1,0|0,0,2]=4 578 B7R0.5 CC#CC(C)C(C)O Amb25145304 [0,0,1,0,1,0|1,0,1]=4 579 B7R0.5 CC(O)C(C)CCBr Amb27878805 [0,0,1,0,1,0|2,0,0]=4 580 B7R0.5 CC(O)C(C)CCF Amb28120971 [0,0,1,0,1,0|2,0,0]=4 581 B7R0.5 CC(O)C(C)CCN Amb18202662 [0,0,1,0,1,0|2,0,0]=4 582 B7R0.5 CCCC(C)C(C)C Amb4019539 [0,0,1,0,1,0|2,0,0]=4 583 B7R0.5 CCCC(C)C(C)N Amb18289572 [0,0,1,0,1,0|2,0,0]=4 584 B7R0.5 CCCC(C)C(C)N Amb29083224 [0,0,1,0,1,0|2,0,0]=4 585 B7R0.5 CCCC(C)C(C)O Amb4036337 [0,0,1,0,1,0|1,0,0]=3 586 B7R0.5 CCCC(C)[C@@H](C)N Amb33322349 [0,0,1,0,1,0|2,0,0]=4 587 B7R0.5 CCCC(C)[C@@H](C)O Amb33322347 [0,0,1,0,1,0|1,0,0]=3 588 B7R0.5 CCCC(C)[C@H](C)N Amb33322348 [0,0,1,0,1,0|2,0,0]=4 589 B7R0.5 CCCC(C)[C@H](C)O Amb33322346 [0,0,1,0,1,0|1,0,0]=3 590 B7R0.5 CCC[C@@H](C)C(C)O Amb28187641 [0,0,1,0,1,0|1,0,0]=3 591 B7R0.5 CCC[C@@H](C)[C@@H](C)O Amb27181050 [0,0,1,0,1,0|1,0,0]=3 592 B7R0.5 CCC[C@@H](Cl)[C@H](C)O Amb27668868 [0,0,1,0,1,0|2,0,0]=4 593 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [0,0,1,0,1,0|2,0,0]=4 594 B7R0.5 CCC[C@@H](O)[C@@H](C)O Amb27457775 [0,0,1,0,1,0|2,0,0]=4 595 B7R0.5 CCC[C@H](C)[C@@H](C)N Amb27839498 [0,0,1,0,1,0|2,0,0]=4 596 B7R0.5 CCC[C@H](C)[C@H](C)O Amb28065150 [0,0,1,0,1,0|1,0,0]=3 597 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [0,0,1,0,1,0|2,0,0]=4 598 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [0,0,1,0,1,0|2,0,0]=4 599 B7R0.5 CCNC(C)C(C)C Amb13951376 [0,0,1,0,1,0|2,0,0]=4 600 B7R0.5 CCNC(C)C(C)C Amb9725788 [0,0,1,0,1,0|2,0,0]=4 601 B7R0.5 CCNC(C)C(C)S Amb18124385 [0,0,1,0,1,0|1,1,0]=4 602 B7R0.5 CCN[C@@H](C)[C@H](C)N Amb27232602 [0,0,1,0,1,0|2,0,0]=4 603 B7R0.5 CCN[C@H](C)[C@H](C)N Amb27844807 [0,0,1,0,1,0|2,0,0]=4 604 B7R0.5 CCOC(=N)C(C)O Amb17593213 [0,0,1,0,1,0|1,0,1]=4 605 B7R0.5 CCOC(=N)[C@@H](C)O Amb27222305 [0,0,1,0,1,0|1,0,1]=4 606 B7R0.5 CCOC(=O)C(C)O Amb8517047 [0,0,1,0,1,0|1,0,1]=4 607 B7R0.5 CCOC(=O)[C@@H](C)O Amb17614096 [0,0,1,0,1,0|1,0,1]=4 608 B7R0.5 CCOC(=O)[C@H](C)O Amb3939669 [0,0,1,0,1,0|1,0,1]=4 609 B7R0.5 CCOC(C)C(=O)O Amb9725271 [0,0,1,0,1,0|1,0,1]=4 610 B7R0.5 CCOC(C)C(C)=O Amb9666103 [0,0,1,0,1,0|0,0,2]=4 611 B7R0.5 CCOC(C)C(C)N Amb18291405 [0,0,1,0,1,0|1,0,0]=3 612 B7R0.5 CCOC(C)[C@@H](C)N Amb26653821 [0,0,1,0,1,0|1,0,0]=3 613 B7R0.5 CCOC(C)[C@@H](C)O Amb25910898 [0,0,1,0,1,0|0,0,0]=2 614 B7R0.5 CCOC(C)[C@H](C)N Amb25857133 [0,0,1,0,1,0|1,0,0]=3 615 B7R0.5 CCOC(C)[C@H](C)O Amb27828215 [0,0,1,0,1,0|0,0,0]=2 616 B7R0.5 CCOC(Cl)C(C)Cl Amb27216662 [0,0,1,0,1,0|2,0,0]=4 617 B7R0.5 CCO[C@@H](C)[C@@H](C)O Amb27484522 [0,0,1,0,1,0|0,0,0]=2 618 B7R0.5 CCO[C@@H](Cl)[C@H](C)Cl Amb27232633 [0,0,1,0,1,0|2,0,0]=4 619 B7R0.5 CCO[C@H](C)[C@@H](C)O Amb27456387 [0,0,1,0,1,0|0,0,0]=2 620 B7R0.5 CCSC(C)C(C)C Amb27880088 [0,0,1,0,1,0|1,1,0]=4 621 B7R0.5 CCSC(C)C(C)N Amb27794385 [0,0,1,0,1,0|1,1,0]=4 622 B7R0.5 CCS[C@@H](C)[C@@H](C)Br Amb27444969 [0,0,1,0,1,0|1,1,0]=4 623 B7R0.5 CCS[C@H](C)[C@H](C)Br Amb27477442 [0,0,1,0,1,0|1,1,0]=4 624 B7R0.5 CC\C=C(/C)C(C)O Amb27761819 [0,0,1,0,1,0|1,0,1]=4 625 B7R0.5 CC\C=C(\C)[C@@H](C)O Amb27484789 [0,0,1,0,1,0|1,0,1]=4 626 B7R0.5 COCC(C)C(C)O Amb24746662 [0,0,1,0,1,0|2,0,0]=4 627 B7R0.5 C\C=C\C(C)C(C)O Amb32944797 [0,0,1,0,1,0|1,0,1]=4 628 B7R1.2 CC1=NC(C)CO1 Amb9805507 [1,0,0,0,1,0|1,0,1]=4 629 B7R1.2 CC1CC(Cl)CO1 Amb35679295 [1,0,0,0,1,0|2,0,0]=4 630 B7R1.2 CC1CC(N)CO1 Amb28283957 [1,0,0,0,1,0|2,0,0]=4 631 B7R1.2 CC1CC(N)CO1 Amb28827641 [1,0,0,0,1,0|2,0,0]=4 632 B7R1.2 CC1CC(O)CO1 Amb28430079 [1,0,0,0,1,0|2,0,0]=4 633 B7R1.2 CC1CC(S)CO1 Amb32788641 [1,0,0,0,1,0|2,0,0]=4 634 B7R1.2 CC1CCC(C)N1 Amb20626165 [1,0,0,0,1,0|2,0,0]=4 635 B7R1.2 CC1CCC(C)N1 Amb5716833 [1,0,0,0,1,0|2,0,0]=4 636 B7R1.2 CC1CNC(C)C1 Amb17593077 [1,0,0,0,1,0|2,0,0]=4 637 B7R1.2 CC1CNC(C)C1 Amb19335336 [1,0,0,0,1,0|2,0,0]=4 638 B7R1.2 CC1COC(=O)O1 Amb8513300 [1,0,0,0,1,0|1,0,1]=4 639 B7R1.2 CC1COC(C)O1 Amb24074042 [1,0,0,0,1,0|0,0,0]=2 640 B7R1.2 CC1COC(O)C1 Amb28050442 [1,0,0,0,1,0|2,0,0]=4 641 B7R1.2 CC1COS(=O)O1 Amb22346070 [1,0,0,0,1,0|2,0,0]=4 642 B7R1.2 C[C@@H]1CC[C@@H](C)C1 Amb25176920 [1,0,0,0,1,0|2,0,0]=4 643 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb17613372 [1,0,0,0,1,0|2,0,0]=4 644 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb22366804 [1,0,0,0,1,0|2,0,0]=4 645 B7R1.2 C[C@@H]1CN[C@H](C)C1 Amb18195964 [1,0,0,0,1,0|2,0,0]=4 646 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [1,0,0,0,1,0|1,0,1]=4 647 B7R1.2 C[C@@H]1COC(O)C1 Amb27399504 [1,0,0,0,1,0|2,0,0]=4 648 B7R1.2 C[C@@H]1COS(=O)O1 Amb27979548 [1,0,0,0,1,0|2,0,0]=4 649 B7R1.2 C[C@@H]1CO[C@@H](O)C1 Amb27422487 [1,0,0,0,1,0|2,0,0]=4 650 B7R1.2 C[C@H]1CC[C@@H](C)N1 Amb10567751 [1,0,0,0,1,0|2,0,0]=4 651 B7R1.2 C[C@H]1CC[C@H](C)C1 Amb22747863 [1,0,0,0,1,0|2,0,0]=4 652 B7R1.2 C[C@H]1CC[C@H](C)N1 Amb26580691 [1,0,0,0,1,0|2,0,0]=4 653 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [1,0,0,0,1,0|1,0,1]=4 654 B7R1.2 C[C@H]1CS[C@@H](C)N1 Amb27222309 [1,0,0,0,1,0|1,1,0]=4 655 B7R1.2 C[C@H]1C[C@@H](O)CO1 Amb28245786 [1,0,0,0,1,0|2,0,0]=4 656 B7R1.4 CC1CCCC1C Amb4019559 [1,0,0,0,1,0|2,0,0]=4 657 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,0,1,0|2,0,0]=4 658 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,0,1,0|2,0,0]=4 659 B7R1.4 CC1OCCC1Br Amb25073861 [1,0,0,0,1,0|2,0,0]=4 660 B7R1.4 CC1OCCC1Cl Amb24470094 [1,0,0,0,1,0|2,0,0]=4 661 B7R1.4 CC1OCCC1N Amb22058722 [1,0,0,0,1,0|2,0,0]=4 662 B7R1.4 CC1OCCC1N Amb32660981 [1,0,0,0,1,0|2,0,0]=4 663 B7R1.4 CC1OCCC1O Amb25888399 [1,0,0,0,1,0|2,0,0]=4 664 B7R1.4 CC1OCCC1S Amb8515792 [1,0,0,0,1,0|2,0,0]=4 665 B7R1.4 CC1OCOC1C Amb26430935 [1,0,0,0,1,0|0,0,0]=2 666 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,0,1,0|2,0,0]=4 667 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,0,1,0|2,0,0]=4 668 B7R1.4 C[C@@H]1CCOC1O Amb28074771 [1,0,0,0,1,0|2,0,0]=4 669 B7R1.4 C[C@@H]1CCO[C@H]1O Amb27857930 [1,0,0,0,1,0|2,0,0]=4 670 B7R1.4 C[C@@H]1NCC[C@H]1C Amb32412685 [1,0,0,0,1,0|2,0,0]=4 671 B7R1.4 C[C@@H]1OCC[C@@H]1I Amb27962293 [1,0,0,0,1,0|2,0,0]=4 672 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [1,0,0,0,1,0|2,0,0]=4 673 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [1,0,0,0,1,0|2,0,0]=4 674 B7R1.4 C[C@@H]1OCC[C@H]1I Amb27664288 [1,0,0,0,1,0|2,0,0]=4 675 B7R1.4 C[C@@H]1OCC[C@H]1N Amb27435305 [1,0,0,0,1,0|2,0,0]=4 676 B7R1.4 C[C@@H]1OCC[C@H]1N Amb34915721 [1,0,0,0,1,0|2,0,0]=4 677 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,0,1,0|2,0,0]=4 678 B7R1.4 C[C@H]1CCC[C@H]1C Amb22230410 [1,0,0,0,1,0|2,0,0]=4 679 B7R1.4 C[C@H]1CCN[C@H]1C Amb27879886 [1,0,0,0,1,0|2,0,0]=4 680 B7R1.4 C[C@H]1CCO[C@H]1Cl Amb27444980 [1,0,0,0,1,0|2,0,0]=4 681 B7R1.4 C[C@H]1CCO[C@H]1O Amb27642053 [1,0,0,0,1,0|2,0,0]=4 682 B7R1.4 C[C@H]1OCC[C@@H]1O Amb28388631 [1,0,0,0,1,0|2,0,0]=4 683 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [1,0,0,0,1,0|2,0,0]=4 684 B7R1.4 ClC1OCOC1Cl Amb28050505 [1,0,0,0,1,0|2,0,0]=4 685 B7R1.15 CC1CC(O)C1C Amb28050458 [0,0,0,0,2,0|2,0,0]=4 686 B7R1.15 CC1CC(S)C1C Amb24718624 [0,0,0,0,2,0|2,0,0]=4 687 B7R1.15 CC1SC(C)C1O Amb27165271 [0,0,0,0,2,0|1,1,0]=4 688 B9R0.48 CCCC(C)CCC(C)O Amb26868390 [0,0,1,0,0,1|2,0,0]=4 689 B9R0.48 CCCC(C)CC[C@@H](C)O Amb33321144 [0,0,1,0,0,1|2,0,0]=4 690 B9R0.48 CCCC(C)CC[C@H](C)O Amb33321145 [0,0,1,0,0,1|2,0,0]=4 691 B9R0.48 CCCC(C)COC(C)Cl Amb32715992 [0,0,1,0,0,1|2,0,0]=4 692 B9R0.48 CCCC(C)NC[C@H](C)O Amb27442940 [0,0,1,0,0,1|2,0,0]=4 693 B9R0.48 CCCC(C)OCC(C)N Amb28077537 [0,0,1,0,0,1|2,0,0]=4 694 B9R0.48 CCCC(C)OC[C@H](C)N Amb27424873 [0,0,1,0,0,1|2,0,0]=4 695 B9R0.48 CCCC(C)OC[C@H](C)O Amb27424875 [0,0,1,0,0,1|1,0,0]=3 696 B9R0.48 CCCC(C)\C=C\C(C)O Amb27262557 [0,0,1,0,0,1|2,0,0]=4 697 B9R0.48 CCOC(=O)OCC(C)O Amb27763424 [0,0,1,0,0,1|1,0,1]=4 698 B9R0.48 CCOC(C)CCC(C)N Amb33425314 [0,0,1,0,0,1|2,0,0]=4 699 B9R0.48 CCOC(C)CCC(C)O Amb33425313 [0,0,1,0,0,1|1,0,0]=3 700 B9R0.48 CCOC(C)CC[C@@H](C)N Amb33425309 [0,0,1,0,0,1|2,0,0]=4 701 B9R0.48 CCOC(C)CC[C@@H](C)O Amb33425310 [0,0,1,0,0,1|1,0,0]=3 702 B9R0.48 CCOC(C)CC[C@H](C)N Amb33425066 [0,0,1,0,0,1|2,0,0]=4 703 B9R0.48 CCOC(C)CC[C@H](C)O Amb33425312 [0,0,1,0,0,1|1,0,0]=3 704 B9R0.48 CCOC(C)COC(C)=O Amb25959518 [0,0,1,0,0,1|0,0,2]=4 705 B9R0.48 CCOC(C)OCC(=O)O Amb28126960 [0,0,1,0,0,1|1,0,1]=4 706 B9R0.48 CCOC(C)\C=C\C(C)N Amb33424976 [0,0,1,0,0,1|2,0,0]=4 707 B9R1.49 CC1CCOC(C)CN1 Amb27641711 [1,0,0,0,0,1|2,0,0]=4 708 B9R1.49 C[C@@H]1CCO[C@H](C)CN1 Amb31156635 [1,0,0,0,0,1|2,0,0]=4 709 B9R1.49 C[C@@H]1CCO[C@H](C)CN1 Amb33276620 [1,0,0,0,0,1|2,0,0]=4