0 B10R0.70 CC(=C)CC(CC(O)=O)CN Amb22054876 [0,0,0,0,0,0|0,0,2]=2 1 B10R0.70 CC(=C)C[13CH](CN)[13CH2][13C](O)=O Amb22054877 [0,0,0,0,0,0|0,0,2]=2 2 B10R0.70 CC(=O)NC(CC(O)=O)CC Amb25384609 [0,0,0,0,0,0|3,0,1]=4 3 B10R0.70 CC(=O)NC(CC(O)=O)CN Amb18645288 [0,0,0,0,0,0|2,0,1]=3 4 B10R0.70 CC(=O)NC(CC(O)=O)CO Amb25386029 [0,0,0,0,0,0|3,0,1]=4 5 B10R0.70 CC(=O)NC(CO)CN(C)C Amb25382824 [0,0,0,0,0,0|4,0,0]=4 6 B10R0.70 CC(=O)N[C@H](CC(O)=O)CC Amb25383139 [0,0,0,0,0,0|3,0,1]=4 7 B10R0.70 CC(=O)OC(CC(O)=O)CBr Amb22490939 [0,0,0,0,0,0|3,0,1]=4 8 B10R0.70 CC(=O)O[C@@H](CC(O)=O)CBr Amb22748249 [0,0,0,0,0,0|3,0,1]=4 9 B10R0.70 CC(C)=CC(CN)CC(O)=O Amb22054874 [0,0,0,0,0,0|0,0,2]=2 10 B10R0.70 CC(C)=CC([13CH2]N)[13CH2][13C](O)=O Amb22054875 [0,0,0,0,0,0|0,0,2]=2 11 B10R0.70 CC(C)CC(C=C)NC(C)=O Amb24766527 [0,0,0,0,0,0|3,0,1]=4 12 B10R0.70 CC(C)CC(C=O)NC(C)=O Amb24765252 [0,0,0,0,0,0|3,0,1]=4 13 B10R0.70 CC(C)CC(CN)NC(N)=O Amb24751226 [0,0,0,0,0,0|2,0,0]=2 14 B10R0.70 CC(C)CC(CO)NC(N)=N Amb18797568 [0,0,0,0,0,0|4,0,0]=4 15 B10R0.70 CC(C)CC(CO)NC(N)=O Amb18787963 [0,0,0,0,0,0|3,0,0]=3 16 B10R0.70 CC(C)CC(CO)NC(S)=S Amb24766660 [0,0,0,0,0,0|2,2,0]=4 17 B10R0.70 CC(C)CC(CS)NC(C)=O Amb24765237 [0,0,0,0,0,0|3,0,0]=3 18 B10R0.70 CC(C)C[C@@H](C=O)NC(C)=O Amb25385704 [0,0,0,0,0,0|3,0,1]=4 19 B10R0.70 CC(C)C[C@@H](CC(O)=O)C#N Amb25386284 [0,0,0,0,0,0|0,0,2]=2 20 B10R0.70 CC(C)C[C@@H](CC(O)=O)CN Amb22224989 [0,0,0,0,0,0|0,0,0]=0 21 B10R0.70 CC(C)C[C@@H](CN)NC(C)=O Amb25383918 [0,0,0,0,0,0|2,0,0]=2 22 B10R0.70 CC(C)C[C@@H](CO)NC(C)=O Amb24765062 [0,0,0,0,0,0|3,0,0]=3 23 B10R0.70 CC(C)C[C@@H](CS)NC(C)=O Amb24765421 [0,0,0,0,0,0|3,0,0]=3 24 B10R0.70 CC(C)NC(CC(N)=O)C#N Amb25381628 [0,0,0,0,0,0|2,0,2]=4 25 B10R0.70 CC(C)\C=C(\CC(O)=O)/C#N Amb24634124 [0,0,0,0,0,0|0,0,4]=4 26 B10R0.70 N#CC(NC(=O)C)CC(C)C Amb17399965 [0,0,0,0,0,0|2,0,2]=4 27 B10R0.70 N[13CH2]C([13CH2][13C](=O)O)CC(C)C Amb17619511 [0,0,0,0,0,0|0,0,0]=0 28 B10R0.70 OCC(NC(=O)C)CC(C)C Amb17138489 [0,0,0,0,0,0|3,0,0]=3 29 B9R0.14 C=CC(CCO)CC(O)=O Amb24595877 [1,0,0,0,0,0|2,0,1]=4 30 B9R0.14 C=C[C@H](CCO)CC(O)=O Amb24674139 [1,0,0,0,0,0|2,0,1]=4 31 B9R0.14 CC(=O)CC(CCO)CO Amb24586786 [1,0,0,0,0,0|3,0,0]=4 32 B9R0.14 CC(C)CC(CBr)CC=C Amb24451397 [1,0,0,0,0,0|2,0,0]=3 33 B9R0.14 CC(C)CC(CBr)CCC Amb25712263 [1,0,0,0,0,0|2,0,1]=4 34 B9R0.14 CC(C)CC(CC)N=C=O Amb25162770 [1,0,0,0,0,0|2,0,1]=4 35 B9R0.14 CC(C)CC(CC=C)NN Amb25731407 [1,0,0,0,0,0|2,0,0]=3 36 B9R0.14 CC(C)CC(CCN)CN Amb25702911 [1,0,0,0,0,0|1,0,1]=3 37 B9R0.14 CC(C)CC(CCl)CCC Amb25039933 [1,0,0,0,0,0|2,0,1]=4 38 B9R0.14 CC(C)CC(CN)CC=O Amb25211687 [1,0,0,0,0,0|0,0,0]=1 39 B9R0.14 CC(C)CC(CN)CCC Amb25301156 [1,0,0,0,0,0|1,0,1]=3 40 B9R0.14 CC(C)CC(CN)CCO Amb19149332 [1,0,0,0,0,0|0,0,1]=2 41 B9R0.14 CC(C)CC(CN)N=[N+]=[N-] Amb24477117 [1,0,0,0,0,0|3,0,0]=4 42 B9R0.14 CC(C)CC(CN)OCC Amb24663898 [1,0,0,0,0,0|2,0,1]=4 43 B9R0.14 CC(C)CC(CNN)CC Amb25321348 [1,0,0,0,0,0|3,0,0]=4 44 B9R0.14 CC(C)CC(CO)CC=C Amb25185268 [1,0,0,0,0,0|2,0,0]=3 45 B9R0.14 CC(C)CC(CO)COC Amb25088645 [1,0,0,0,0,0|3,0,0]=4 46 B9R0.14 CC(C)CC(CO)NC=O Amb24690016 [1,0,0,0,0,0|2,0,0]=3 47 B9R0.14 CC(C)CC(COC)NN Amb24523119 [1,0,0,0,0,0|3,0,0]=4 48 B9R0.14 CC(C)C[C@@H](C#N)NC=O Amb24502433 [1,0,0,0,0,0|1,0,2]=4 49 B9R0.14 CC(C)C[C@@H](CCN)CN Amb24468056 [1,0,0,0,0,0|1,0,1]=3 50 B9R0.14 CC(C)C[C@@H](CCO)CO Amb24412907 [1,0,0,0,0,0|1,0,1]=3 51 B9R0.14 CC(C)C[C@H](CC=O)CC Amb24435369 [1,0,0,0,0,0|1,0,0]=2 52 B9R0.14 CC(C)C[C@H](CN)CC#N Amb25098016 [1,0,0,0,0,0|1,0,1]=3 53 B9R0.14 CC(C)C[C@H](CN)CCO Amb24478210 [1,0,0,0,0,0|0,0,1]=2 54 B9R0.14 CC(C)C[C@H](CO)CCC Amb24748268 [1,0,0,0,0,0|2,0,1]=4 55 B9R0.14 CC(C)NC(CC=C)CC Amb25848711 [1,0,0,0,0,0|3,0,0]=4 56 B9R0.14 CC(C)NC(CO)CC=C Amb25705911 [1,0,0,0,0,0|3,0,0]=4 57 B9R0.14 CC(C)OC(CC=O)C=O Amb25325756 [1,0,0,0,0,0|2,0,1]=4 58 B9R0.14 CC(C)OC(CCO)CO Amb23589646 [1,0,0,0,0,0|2,0,1]=4 59 B9R0.14 CC(C)OC(CN)COC Amb24479641 [1,0,0,0,0,0|3,0,0]=4 60 B9R0.14 CC(O)CC(CO)CCC Amb25847449 [1,0,0,0,0,0|2,0,1]=4 61 B9R0.14 CCC(CC#N)CC(O)=O Amb24746759 [1,0,0,0,0,0|2,0,1]=4 62 B9R0.14 CCC(CC(N)=O)NCC Amb24682966 [1,0,0,0,0,0|3,0,0]=4 63 B9R0.14 CCC(CC(N)=O)OCC Amb24502290 [1,0,0,0,0,0|3,0,0]=4 64 B9R0.14 CCC(CC(O)=O)SCC Amb18788141 [1,0,0,0,0,0|2,0,0]=3 65 B9R0.14 CCC(CCC)NC(C)=O Amb25327258 [1,0,0,0,0,0|3,0,0]=4 66 B9R0.14 CCC(CCC)OC(N)=O Amb25848639 [1,0,0,0,0,0|3,0,0]=4 67 B9R0.14 CCC(COC)CC(O)=O Amb18202336 [1,0,0,0,0,0|2,0,0]=3 68 B9R0.14 CCCC(CB(O)O)CC Amb24504826 [1,0,0,0,0,0|2,0,1]=4 69 B9R0.14 CCCC(CBr)OC(C)=O Amb24399943 [1,0,0,0,0,0|3,0,0]=4 70 B9R0.14 CCCC(CC(=O)Cl)CC Amb25090544 [1,0,0,0,0,0|2,0,0]=3 71 B9R0.14 CCCC(CC(C)=C)NN Amb25054242 [1,0,0,0,0,0|3,0,0]=4 72 B9R0.14 CCCC(CC(C)=O)C#N Amb25714287 [1,0,0,0,0,0|1,0,2]=4 73 B9R0.14 CCCC(CC(C)=O)C=C Amb24478388 [1,0,0,0,0,0|2,0,1]=4 74 B9R0.14 CCCC(CC(C)=O)OC Amb25076204 [1,0,0,0,0,0|3,0,0]=4 75 B9R0.14 CCCC(CC(N)=O)C=C Amb24712938 [1,0,0,0,0,0|2,0,1]=4 76 B9R0.14 CCCC(CC(N)=O)NC Amb25069096 [1,0,0,0,0,0|3,0,0]=4 77 B9R0.14 CCCC(CC(O)=O)C#C Amb25330154 [1,0,0,0,0,0|1,0,1]=3 78 B9R0.14 CCCC(CC(O)=O)CC Amb18124694 [1,0,0,0,0,0|1,0,0]=2 79 B9R0.14 CCCC(CC(O)=O)CO Amb24509175 [1,0,0,0,0,0|1,0,0]=2 80 B9R0.14 CCCC(CC(O)=O)OC Amb25844554 [1,0,0,0,0,0|2,0,0]=3 81 B9R0.14 CCCC(CCl)CC(C)=C Amb25132141 [1,0,0,0,0,0|3,0,0]=4 82 B9R0.14 CCCC(CCl)OC(C)=O Amb24480605 [1,0,0,0,0,0|3,0,0]=4 83 B9R0.14 CCCC(CN)CC(O)=O Amb24587738 [1,0,0,0,0,0|0,0,0]=1 84 B9R0.14 CCCC(CN)CN(C)C Amb25822653 [1,0,0,0,0,0|2,0,1]=4 85 B9R0.14 CCCC(CN)NC(N)=O Amb24357472 [1,0,0,0,0,0|2,0,0]=3 86 B9R0.14 CCCC(CO)CC(C)=O Amb24708488 [1,0,0,0,0,0|2,0,0]=3 87 B9R0.14 CCCN(CC(N)=O)CC Amb25849535 [1,0,0,0,0,0|3,0,0]=4 88 B9R0.14 CCCN(CC(O)=O)C=O Amb18307978 [1,0,0,0,0,0|2,0,1]=4 89 B9R0.14 CCC[C@@H](CC(C)=O)C#N Amb25358879 [1,0,0,0,0,0|1,0,2]=4 90 B9R0.14 CCC[C@@H](CN)CC(O)=O Amb25835673 [1,0,0,0,0,0|0,0,0]=1 91 B9R0.14 CCC[C@@H](CO)OC(C)=O Amb25307611 [1,0,0,0,0,0|3,0,0]=4 92 B9R0.14 CCC[C@H](CC(C)=O)CC Amb24646153 [1,0,0,0,0,0|2,0,0]=3 93 B9R0.14 CCC[C@H](CC(O)=O)CC Amb24480703 [1,0,0,0,0,0|1,0,0]=2 94 B9R0.14 CCN(CC=O)CC(C)C Amb24431067 [1,0,0,0,0,0|2,0,0]=3 95 B9R0.14 CCN(CCN)CC(O)=O Amb25280640 [1,0,0,0,0,0|3,0,0]=4 96 B9R0.14 CCOC(CC(N)=O)CN Amb24505233 [1,0,0,0,0,0|2,0,0]=3 97 B9R0.14 CCOC(CC(O)=O)C#N Amb24480747 [1,0,0,0,0,0|1,0,2]=4 98 B9R0.14 CCOC(CN)CC(O)=O Amb24672836 [1,0,0,0,0,0|1,0,0]=2 99 B9R0.14 CCOC(CN)CS(C)=O Amb24669032 [1,0,0,0,0,0|3,0,0]=4 100 B9R0.14 CCO[C@@H](CC(O)=O)C#N Amb24383647 [1,0,0,0,0,0|1,0,2]=4 101 B9R0.14 CCS(CC(O)=O)OCC Amb24449991 [1,0,0,0,0,0|3,0,0]=4 102 B9R0.14 CC[C@@H](CC#N)CC(O)=O Amb25213966 [1,0,0,0,0,0|2,0,1]=4 103 B9R0.14 CC[C@@H](CC=O)CC(C)=O Amb25768389 [1,0,0,0,0,0|2,0,1]=4 104 B9R0.14 CC[C@H](CC=O)CC(C)=O Amb25299211 [1,0,0,0,0,0|2,0,1]=4 105 B9R0.14 CC\C(\CC(C)C)=C/C=O Amb24502254 [1,0,0,0,0,0|1,0,2]=4 106 B9R0.14 CN(C)CC(CC=C)NN Amb24529140 [1,0,0,0,0,0|3,0,0]=4 107 B9R0.14 COC(CC(O)=O)OCC Amb24682697 [1,0,0,0,0,0|3,0,0]=4 108 B9R0.14 COCC(CN)NC(C)=O Amb24475242 [1,0,0,0,0,0|3,0,0]=4 109 B9R0.14 CSCC(CC(O)=O)SC Amb25201534 [1,0,0,0,0,0|3,0,0]=4 110 B9R0.14 C\C=C/C(CC(O)=O)CN Amb24479019 [1,0,0,0,0,0|0,0,2]=3 111 B9R0.14 C\C=C\C(CC(O)=O)CC Amb18643921 [1,0,0,0,0,0|1,0,2]=4 112 B9R0.14 C\C=C\C(CC(O)=O)CN Amb25259204 [1,0,0,0,0,0|0,0,2]=3 113 B9R0.14 C\C=C\[C@@H](CC(O)=O)CC Amb25251887 [1,0,0,0,0,0|1,0,2]=4 114 B9R0.53 CC(=C)CC(C)CC(O)=O Amb18643943 [1,0,0,0,0,0|0,0,2]=3 115 B9R0.53 CC(=C)CC(N)CN(C)C Amb24641599 [1,0,0,0,0,0|3,0,0]=4 116 B9R0.53 CC(=CC(O)=O)NC(C)C Amb25360223 [1,0,0,0,0,0|1,0,2]=4 117 B9R0.53 CC(=O)CC(=N)CC(C)C Amb24706662 [1,0,0,0,0,0|1,0,2]=4 118 B9R0.53 CC(=O)CC(C)CC(O)=O Amb18644106 [1,0,0,0,0,0|1,0,1]=3 119 B9R0.53 CC(=O)C[C@@H](CC(=O)O)C Amb10844399 [1,0,0,0,0,0|1,0,1]=3 120 B9R0.53 CC(=O)OC(C)CC(O)=O Amb18644244 [1,0,0,0,0,0|2,0,1]=4 121 B9R0.53 CC(=O)O[C@H](C)CC(O)=O Amb25062672 [1,0,0,0,0,0|2,0,1]=4 122 B9R0.53 CC(C)=CC(C)CC(C)=O Amb25093185 [1,0,0,0,0,0|1,0,2]=4 123 B9R0.53 CC(C)=CC(C)CC(O)=O Amb24480766 [1,0,0,0,0,0|0,0,2]=3 124 B9R0.53 CC(C)=CC(N)CC(N)=O Amb25805588 [1,0,0,0,0,0|1,0,2]=4 125 B9R0.53 CC(C)=CC(O)CC(O)=O Amb18644102 [1,0,0,0,0,0|1,0,2]=4 126 B9R0.53 CC(C)=C[C@@H](O)CC(O)=O Amb24393168 [1,0,0,0,0,0|1,0,2]=4 127 B9R0.53 CC(C)CC(=C)CC(O)=O Amb18643897 [1,0,0,0,0,0|0,0,2]=3 128 B9R0.53 CC(C)CC(C)C=C(Br)Br Amb24606092 [1,0,0,0,0,0|2,0,1]=4 129 B9R0.53 CC(C)CC(C)CC(C)=O Amb20621119 [1,0,0,0,0,0|1,0,0]=2 130 B9R0.53 CC(C)CC(C)CC(C)Cl Amb24396788 [1,0,0,0,0,0|2,0,1]=4 131 B9R0.53 CC(C)CC(C)CC(C)N Amb25064296 [1,0,0,0,0,0|2,0,1]=4 132 B9R0.53 CC(C)CC(C)CC(C)O Amb24271139 [1,0,0,0,0,0|1,0,1]=3 133 B9R0.53 CC(C)CC(C)CC(N)=N Amb24479387 [1,0,0,0,0,0|2,0,0]=3 134 B9R0.53 CC(C)CC(C)CC(N)=S Amb24565637 [1,0,0,0,0,0|1,1,0]=3 135 B9R0.53 CC(C)CC(C)CN(C)C Amb24744220 [1,0,0,0,0,0|3,0,0]=4 136 B9R0.53 CC(C)CC(C)NC(C)=O Amb25824393 [1,0,0,0,0,0|2,0,0]=3 137 B9R0.53 CC(C)CC(C)NC(N)=N Amb24467365 [1,0,0,0,0,0|3,0,0]=4 138 B9R0.53 CC(C)CC(C)OC(C)=O Amb22733405 [1,0,0,0,0,0|2,0,0]=3 139 B9R0.53 CC(C)CC(Cl)CC(=O)Cl Amb25241016 [1,0,0,0,0,0|2,0,0]=3 140 B9R0.53 CC(C)CC(Cl)CC(C)=C Amb24579888 [1,0,0,0,0,0|3,0,0]=4 141 B9R0.53 CC(C)CC(Cl)NC(=O)Cl Amb25177573 [1,0,0,0,0,0|3,0,0]=4 142 B9R0.53 CC(C)CC(Cl)OC(C)=O Amb24424956 [1,0,0,0,0,0|3,0,0]=4 143 B9R0.53 CC(C)CC(N)C=C(C)C Amb25822562 [1,0,0,0,0,0|2,0,1]=4 144 B9R0.53 CC(C)CC(N)CC(C)C Amb19373200 [1,0,0,0,0,0|2,0,1]=4 145 B9R0.53 CC(C)CC(N)CC(F)F Amb18180143 [1,0,0,0,0,0|2,0,1]=4 146 B9R0.53 CC(C)CC(N)CC(N)=O Amb25785407 [1,0,0,0,0,0|1,0,0]=2 147 B9R0.53 CC(C)CC(O)CC(C)=O Amb25054426 [1,0,0,0,0,0|2,0,0]=3 148 B9R0.53 CC(C)CC(O)CC(C)O Amb25787141 [1,0,0,0,0,0|2,0,1]=4 149 B9R0.53 CC(C)CN(C)CC(=C)Cl Amb25847426 [1,0,0,0,0,0|3,0,0]=4 150 B9R0.53 CC(C)CN(C)C[C@@H](C)O Amb24479585 [1,0,0,0,0,0|2,0,1]=4 151 B9R0.53 CC(C)CN(C)NC(N)=O Amb25809406 [1,0,0,0,0,0|3,0,0]=4 152 B9R0.53 CC(C)CS(=O)CC(C)=O Amb25052491 [1,0,0,0,0,0|3,0,0]=4 153 B9R0.53 CC(C)CS(=O)CC(O)=O Amb18792576 [1,0,0,0,0,0|2,0,0]=3 154 B9R0.53 CC(C)C[C@@H](C)CC(C)=O Amb24480437 [1,0,0,0,0,0|1,0,0]=2 155 B9R0.53 CC(C)C[C@@H](C)CC(O)=O Amb24455134 [1,0,0,0,0,0|0,0,0]=1 156 B9R0.53 CC(C)C[C@@H](O)CC(C)=C Amb25788084 [1,0,0,0,0,0|3,0,0]=4 157 B9R0.53 CC(C)C[C@@H](O)CC(C)=O Amb24480617 [1,0,0,0,0,0|2,0,0]=3 158 B9R0.53 CC(C)C[C@@H](O)C[C@@H](C)O Amb24475825 [1,0,0,0,0,0|2,0,1]=4 159 B9R0.53 CC(C)C[C@H](C)CC(C)=O Amb25707831 [1,0,0,0,0,0|1,0,0]=2 160 B9R0.53 CC(C)C[C@H](N)CC(O)=O Amb19944305 [1,0,0,0,0,0|0,0,0]=1 161 B9R0.53 CC(C)C[C@H](N)CN(C)C Amb24435743 [1,0,0,0,0,0|3,0,0]=4 162 B9R0.53 CC(C)C[C@H](O)CC(O)=O Amb24505145 [1,0,0,0,0,0|1,0,0]=2 163 B9R0.53 CC(C)NC(C)CC(C)O Amb24587728 [1,0,0,0,0,0|2,0,1]=4 164 B9R0.53 CC(C)NC(C)NC(C)=O Amb24553224 [1,0,0,0,0,0|3,0,0]=4 165 B9R0.53 CC(C)N[C@H](C)C[C@@H](C)O Amb24695074 [1,0,0,0,0,0|2,0,1]=4 166 B9R0.53 CC(C)N[C@H](C)C[C@H](C)O Amb24742191 [1,0,0,0,0,0|2,0,1]=4 167 B9R0.53 CC(C)OC(C)NC(C)=O Amb22729317 [1,0,0,0,0,0|3,0,0]=4 168 B9R0.53 CC(C)O[C@H](C)CC(O)=O Amb24463494 [1,0,0,0,0,0|1,0,0]=2 169 B9R0.53 CC(C)SC(=O)CC(O)=O Amb25743447 [1,0,0,0,0,0|2,0,1]=4 170 B9R0.53 CC(C)SC(C)CC(C)=O Amb25126446 [1,0,0,0,0,0|2,0,0]=3 171 B9R0.53 CC(C)SC(C)CC(N)=N Amb18792301 [1,0,0,0,0,0|3,0,0]=4 172 B9R0.53 CC(C)SC(C)CC(O)=O Amb18303284 [1,0,0,0,0,0|1,0,0]=2 173 B9R0.53 CC(CC(=O)N)NC(C)C Amb17231987 [1,0,0,0,0,0|2,0,0]=3 174 B9R0.53 CC(CC(C)Br)CC(C)=C Amb24583898 [1,0,0,0,0,0|3,0,0]=4 175 B9R0.53 CC(CC(C)C)CC(C)C Amb10069382 [1,0,0,0,0,0|2,0,1]=4 176 B9R0.53 CC(CC(C)Cl)CC(C)=C Amb24581835 [1,0,0,0,0,0|3,0,0]=4 177 B9R0.53 CC(CC(C)N)CC(C)=C Amb24688721 [1,0,0,0,0,0|3,0,0]=4 178 B9R0.53 CC(CC(C)O)NC(C)=O Amb25211368 [1,0,0,0,0,0|3,0,0]=4 179 B9R0.53 CC(CC(CC(=O)O)N)C Amb2438867 [1,0,0,0,0,0|0,0,0]=1 180 B9R0.53 CC(CC(CC(=O)O)O)C Amb17232005 [1,0,0,0,0,0|1,0,0]=2 181 B9R0.53 CC(CC(O)=O)CC(N)=O Amb19034796 [1,0,0,0,0,0|2,0,1]=4 182 B9R0.53 CC(CC(O)=O)C[N+]([O-])=O Amb25142280 [1,0,0,0,0,0|3,0,0]=4 183 B9R0.53 CC(CC(O)=O)NS(C)=O Amb25347318 [1,0,0,0,0,0|3,0,0]=4 184 B9R0.53 CC(CC(O)=O)OC(F)F Amb24536176 [1,0,0,0,0,0|3,0,0]=4 185 B9R0.53 CC(CN(C)C)=CC(O)=O Amb24390419 [1,0,0,0,0,0|1,0,2]=4 186 B9R0.53 CC(CN(C)C)NC(C)=O Amb25127012 [1,0,0,0,0,0|3,0,0]=4 187 B9R0.53 CC(CN(CC(=C)Br)C)C Amb14915914 [1,0,0,0,0,0|3,0,0]=4 188 B9R0.53 CC(CN(CC(O)C)C)C Amb17334256 [1,0,0,0,0,0|2,0,1]=4 189 B9R0.53 CC(C[C@@H](CC(=O)O)C)C Amb10844383 [1,0,0,0,0,0|0,0,0]=1 190 B9R0.53 CC(C[C@@H](CC(=O)O)N)C Amb16184017 [1,0,0,0,0,0|0,0,0]=1 191 B9R0.53 CC(N)CC(C)NC(N)=O Amb25828986 [1,0,0,0,0,0|3,0,0]=4 192 B9R0.53 CC(N)CN(C)CC(N)=O Amb25060268 [1,0,0,0,0,0|3,0,0]=4 193 B9R0.53 CC(N)CN(C)CC(O)=O Amb25140627 [1,0,0,0,0,0|2,0,0]=3 194 B9R0.53 CC(NC(=O)CC(=O)O)C Amb17399889 [1,0,0,0,0,0|2,0,1]=4 195 B9R0.53 CC(O)CN(C)CC(C)=O Amb24441836 [1,0,0,0,0,0|3,0,0]=4 196 B9R0.53 CC(O)CN(C)CC(O)=O Amb18312778 [1,0,0,0,0,0|2,0,0]=3 197 B9R0.53 CN(C)CC(N)CC(O)=O Amb18644281 [1,0,0,0,0,0|1,0,0]=2 198 B9R0.53 CN(C)CC(O)CC(N)=O Amb24744547 [1,0,0,0,0,0|3,0,0]=4 199 B9R0.53 CN(C)C[C@@H](O)CC(O)=O Amb25084529 [1,0,0,0,0,0|2,0,0]=3 200 B9R0.53 CN(CC(F)F)CC(O)=O Amb18177927 [1,0,0,0,0,0|3,0,0]=4 201 B9R0.53 CN(C[C@@H](CC(=O)O)O)C Amb10069803 [1,0,0,0,0,0|2,0,0]=3 202 B9R0.53 CN(O)CC(O)CC(O)=O Amb24611959 [1,0,0,0,0,0|3,0,0]=4 203 B9R0.53 CS(=O)CC(N)CC(O)=O Amb25766509 [1,0,0,0,0,0|2,0,0]=3 204 B9R0.53 CS(=O)C[C@@H](N)CC(O)=O Amb25321945 [1,0,0,0,0,0|2,0,0]=3 205 B9R0.53 C[C@@H](CN(C)C)NC(N)=O Amb25129953 [1,0,0,0,0,0|3,0,0]=4 206 B9R0.53 C[C@@H](CN(C)C)OC(N)=O Amb24678456 [1,0,0,0,0,0|3,0,0]=4 207 B9R0.53 C[C@@H](C[C@@H](C)O)OC(C)=O Amb25722158 [1,0,0,0,0,0|3,0,0]=4 208 B9R0.53 C[C@H](CN(C)C)NC(N)=O Amb24734199 [1,0,0,0,0,0|3,0,0]=4 209 B9R0.53 C[C@H](C[C@@H](C)O)NC(C)=O Amb24597644 [1,0,0,0,0,0|3,0,0]=4 210 B9R0.53 C[C@H](C[C@@H](C)O)OC(C)=O Amb24386965 [1,0,0,0,0,0|3,0,0]=4 211 B9R0.53 C[C@H](C[C@H](C)O)OC(C)=O Amb24474272 [1,0,0,0,0,0|3,0,0]=4 212 B9R0.53 C[C@H](N)C[C@H](N)CC(O)=O Amb24418565 [1,0,0,0,0,0|1,0,0]=2 213 B9R0.53 C\C(\CC(C)=O)=C\C(C)C Amb24614276 [1,0,0,0,0,0|1,0,2]=4 214 B9R0.53 C\C(\CC(C)=O)=N/C(C)C Amb25833982 [1,0,0,0,0,0|2,0,1]=4 215 B9R0.53 NC(CC(=O)O)CC(=O)O Amb16184013 [1,0,0,0,0,0|2,0,1]=4 216 B9R0.53 OC(=O)C[C@@H](NC(=O)C)C Amb2372568 [1,0,0,0,0,0|2,0,1]=4 217 B9R0.53 OC(=O)C[C@H](NC(=O)C)C Amb2372567 [1,0,0,0,0,0|2,0,1]=4 218 B11R0.32 CC(=O)C(CC(O)=O)NC(C)C Amb18610978 [0,1,0,0,0,0|2,0,1]=4 219 B11R0.32 CC(C)OC(CC(O)=O)C(O)=O Amb23536087 [0,1,0,0,0,0|2,0,1]=4 220 B11R0.32 CC(CN(C(=O)C)CC(=O)O)C Amb17400383 [0,1,0,0,0,0|2,0,1]=4 221 B11R0.35 CC(C)CN(CC=C)CC(N)=O Amb19281988 [0,1,0,0,0,0|3,0,0]=4 222 B11R0.35 CC(C)C[C@@H](CNC)CC(O)=O Amb19133208 [0,1,0,0,0,0|0,0,0]=1 223 B11R0.91 CC(C)CC(CN)CC(=O)OC Amb22640992 [0,1,0,0,0,0|0,0,0]=1 224 B11R0.91 CC(C)C[C@@H](CN)CC(=O)OC Amb19133692 [0,1,0,0,0,0|0,0,0]=1 225 B11R0.91 CC(CC(CC)OC(C)=O)CC Amb24325172 [0,1,0,0,0,0|3,0,0]=4 226 B11R0.144 CC(C)C(N)C(CC(O)=O)CC Amb23536723 [0,1,0,0,0,0|1,0,0]=2 227 B11R0.144 CCN(C(=O)C(C)C)CC(=O)O Amb17400381 [0,1,0,0,0,0|2,0,1]=4 228 B11R0.274 CCC(CC(O)=O)CC(F)(F)F Amb18266891 [0,1,0,0,0,0|3,0,0]=4 229 B11R1.10 CC1(C)CC(CC(=O)C1)C=C Amb24357069 [0,0,0,1,0,0|2,0,1]=4 230 B11R1.10 CC1(C)CC(CN)CC(O)C1 Amb25212921 [0,0,0,1,0,0|1,0,1]=3 231 B11R1.10 CC[C@@H]1CC(=O)CC(C)(C)O1 Amb25334929 [0,0,0,1,0,0|3,0,0]=4 232 B11R1.49 CC(C)C1CC(=O)NC1CC Amb24383954 [0,0,0,1,0,0|3,0,0]=4 233 B11R1.49 CC(C)C1CC(=O)OC1CO Amb25845424 [0,0,0,1,0,0|3,0,0]=4 234 B11R1.49 CC(C)C1OC(=O)NC1CO Amb24517562 [0,0,0,1,0,0|2,0,0]=3 235 B11R1.49 CC(C)[C@@H]1CC(=O)O[C@@H]1CO Amb25246551 [0,0,0,1,0,0|3,0,0]=4 236 B11R1.49 CC(C)[C@@H]1OC(=O)N[C@@H]1CCl Amb25216992 [0,0,0,1,0,0|2,0,0]=3 237 B11R1.49 CC(C)[C@@H]1OC(=O)N[C@H]1CCl Amb25209970 [0,0,0,1,0,0|2,0,0]=3 238 B11R1.49 CC(C)[C@@H]1OC(=O)O[C@H]1C=C Amb24571221 [0,0,0,1,0,0|2,0,1]=4 239 B11R1.49 CC(C)[C@H]1NC(=O)O[C@H]1CO Amb25232034 [0,0,0,1,0,0|3,0,0]=4 240 B11R1.49 CC(C)[C@H]1OC(=O)NC1C#N Amb24453805 [0,0,0,1,0,0|1,0,2]=4 241 B11R1.49 CC(O)C1OC(=O)CC1OC Amb24523184 [0,0,0,1,0,0|3,0,0]=4 242 B11R1.49 CC1CC(CC)N(C1)C(C)=O Amb25344480 [0,0,0,1,0,0|3,0,0]=4 243 B11R1.49 CCN1CC(O)CC1C(O)=O Amb24533163 [0,0,0,1,0,0|3,0,0]=4 244 B11R1.49 CC[C@@H]1CC(=O)C[C@@H]1C(O)=O Amb25179117 [0,0,0,1,0,0|2,0,1]=4 245 B11R1.49 C[C@@H](O)C1OC(=O)CC1OC Amb24412136 [0,0,0,1,0,0|3,0,0]=4 246 B11R1.49 C[C@@H](O)[C@H]1OC(=O)C[C@H]1OC Amb25239390 [0,0,0,1,0,0|3,0,0]=4 247 B11R1.49 C[C@H](O)[C@H]1OC(=O)C[C@H]1C=C Amb24588339 [0,0,0,1,0,0|2,0,1]=4 248 B11R1.61 CC(C)C1C(OC)C1C(O)=O Amb25775086 [0,0,0,1,0,0|2,0,0]=3 249 B11R1.61 CC(C)[C@@H]1[C@H](OC)[C@H]1C(O)=O Amb25179292 [0,0,0,1,0,0|2,0,0]=3 250 B11R1.61 NC[C@@H]1[C@@H]([C@@H]1C(O)=O)C(O)=O Amb24369366 [0,0,0,1,0,0|2,0,1]=4 251 B11R1.157 C=C1CC(CC(O)=O)CCC1 Amb23589688 [0,0,0,1,0,0|1,0,2]=4 252 B11R1.157 CC(=O)CC1CCCC(N)C1 Amb24685265 [0,0,0,1,0,0|3,0,0]=4 253 B11R1.157 CC(=O)CC1CN(C)CCC1 Amb24634630 [0,0,0,1,0,0|3,0,0]=4 254 B11R1.157 CC(C)CC1CC(=C)CCC1 Amb25803535 [0,0,0,1,0,0|3,0,0]=4 255 B11R1.157 CC(C)CC1CC(=O)C=CO1 Amb24669636 [0,0,0,1,0,0|3,0,0]=4 256 B11R1.157 CC(C)CC1CC(=O)CCC1 Amb24485995 [0,0,0,1,0,0|2,0,0]=3 257 B11R1.157 CC(C)CC1CC(=O)CCO1 Amb23586169 [0,0,0,1,0,0|3,0,0]=4 258 B11R1.157 CC(C)CC1CC(=O)OCC1 Amb24679193 [0,0,0,1,0,0|1,0,0]=2 259 B11R1.157 CC(C)CC1CCCC(=O)N1 Amb25098493 [0,0,0,1,0,0|3,0,0]=4 260 B11R1.157 CC(C)CC=1CCOC(=O)C1 Amb25675122 [0,0,0,1,0,0|1,0,2]=4 261 B11R1.157 CC(C)C[C@@H]1CC(=O)C=CN1 Amb25731241 [0,0,0,1,0,0|3,0,0]=4 262 B11R1.157 CC(C)C[C@@H]1CC(=O)CCC1 Amb24509410 [0,0,0,1,0,0|2,0,0]=3 263 B11R1.157 CC(C)C[C@@H]1CCC[C@@H](O)C1 Amb25177096 [0,0,0,1,0,0|2,0,1]=4 264 B11R1.157 CC(C)C[C@H]1CC(=O)CCC1 Amb24676914 [0,0,0,1,0,0|2,0,0]=3 265 B11R1.157 CC(CN1CCNC(=O)C1)C Amb10695085 [0,0,0,1,0,0|3,0,0]=4 266 B11R1.157 CC(O)CC1CC(=O)CCC1 Amb24486436 [0,0,0,1,0,0|3,0,0]=4 267 B11R1.157 CC1CC(CC(C)=O)CCO1 Amb24514295 [0,0,0,1,0,0|3,0,0]=4 268 B11R1.157 CC1CC(CC(N)=O)CCC1 Amb25373952 [0,0,0,1,0,0|2,0,0]=3 269 B11R1.157 CC1CC(CC(O)=O)C=CC1 Amb18125730 [0,0,0,1,0,0|1,0,1]=3 270 B11R1.157 CC1CC(CC(O)=O)SCC1 Amb24644201 [0,0,0,1,0,0|2,0,0]=3 271 B11R1.157 CC1CC(CCC1)OC(N)=O Amb24677506 [0,0,0,1,0,0|3,0,0]=4 272 B11R1.157 CC1CCCC(CC(C)=O)N1 Amb25100933 [0,0,0,1,0,0|3,0,0]=4 273 B11R1.157 CC1CCCC(CC(O)=O)=C1 Amb25217002 [0,0,0,1,0,0|1,0,2]=4 274 B11R1.157 CC1CCCC(CC(O)=O)O1 Amb18126127 [0,0,0,1,0,0|2,0,0]=3 275 B11R1.157 CC1CCCN(C1)CC(=O)Cl Amb17142953 [0,0,0,1,0,0|3,0,0]=4 276 B11R1.157 CC1CCCN(C1)CC(=O)N Amb10671448 [0,0,0,1,0,0|3,0,0]=4 277 B11R1.157 CC1CCNC(C1)CC(C)=O Amb25746124 [0,0,0,1,0,0|3,0,0]=4 278 B11R1.157 CC1CCOC(C1)CC(C)=O Amb24106311 [0,0,0,1,0,0|3,0,0]=4 279 B11R1.157 CC1CN(CC(O)=O)CCC1 Amb21955265 [0,0,0,1,0,0|2,0,0]=3 280 B11R1.157 CC1CN(CC(O)=O)CCN1 Amb25084371 [0,0,0,1,0,0|3,0,0]=4 281 B11R1.157 CC1CN(CC(O)=O)CCS1 Amb24488162 [0,0,0,1,0,0|3,0,0]=4 282 B11R1.157 CC1COCC(CC(C)=O)N1 Amb24340416 [0,0,0,1,0,0|3,0,0]=4 283 B11R1.157 CC=1CCCC(CC(O)=O)C1 Amb25274980 [0,0,0,1,0,0|1,0,2]=4 284 B11R1.157 CN1CC(CC(=O)Cl)CCC1 Amb24627316 [0,0,0,1,0,0|3,0,0]=4 285 B11R1.157 CN1CC(CC(N)=O)CCC1 Amb25848120 [0,0,0,1,0,0|3,0,0]=4 286 B11R1.157 CN1CC(CC(O)=O)NCC1 Amb18830480 [0,0,0,1,0,0|3,0,0]=4 287 B11R1.157 CN1CC(CC(O)=O)OCC1 Amb18061928 [0,0,0,1,0,0|3,0,0]=4 288 B11R1.157 CN1CCCC(C1)CC(=O)O Amb13885805 [0,0,0,1,0,0|2,0,0]=3 289 B11R1.157 C[C@@H]1CCCC(CC(O)=O)=C1 Amb24440181 [0,0,0,1,0,0|1,0,2]=4 290 B11R1.157 C[C@@H]1CCC[C@@H](C1)NC(C)=O Amb25236145 [0,0,0,1,0,0|3,0,0]=4 291 B11R1.157 C[C@@H]1CCC[C@@H](CC(O)=O)O1 Amb24609908 [0,0,0,1,0,0|2,0,0]=3 292 B11R1.157 C[C@@H]1CCC[C@H](C1)NC(C)=O Amb25256574 [0,0,0,1,0,0|3,0,0]=4 293 B11R1.157 C[C@@H]1CCC[C@H](C1)OC(C)=O Amb25290659 [0,0,0,1,0,0|3,0,0]=4 294 B11R1.157 C[C@@H]1CN(CC(O)=O)CCC1 Amb24722257 [0,0,0,1,0,0|2,0,0]=3 295 B11R1.157 C[C@@H]1CN(CC(O)=O)CCC1 Amb25712697 [0,0,0,1,0,0|2,0,0]=3 296 B11R1.157 C[C@H]1CC(CC(N)=O)CCC1 Amb25765149 [0,0,0,1,0,0|2,0,0]=3 297 B11R1.157 C[C@H]1CC(CC(O)=O)CCC1 Amb24677826 [0,0,0,1,0,0|1,0,0]=2 298 B11R1.157 C[C@H]1CC=C[C@@H](CC(O)=O)O1 Amb24693907 [0,0,0,1,0,0|2,0,1]=4 299 B11R1.157 C[C@H]1CCC[C@@H](CC(C)=O)N1 Amb25179321 [0,0,0,1,0,0|3,0,0]=4 300 B11R1.157 C[C@H]1CCC[C@@H](CC(C)=O)O1 Amb24608605 [0,0,0,1,0,0|3,0,0]=4 301 B11R1.157 C[C@H]1CCC[C@@H](CC(O)=O)N1 Amb24669005 [0,0,0,1,0,0|2,0,0]=3 302 B11R1.157 C[C@H]1CCC[C@@H](CC(O)=O)O1 Amb25201003 [0,0,0,1,0,0|2,0,0]=3 303 B11R1.157 C[C@H]1CCO[C@H](C1)CC(C)=O Amb25245287 [0,0,0,1,0,0|3,0,0]=4 304 B11R1.157 C[C@H]1CN(CC(O)=O)CCN1 Amb25324281 [0,0,0,1,0,0|3,0,0]=4 305 B11R1.157 C[C@H]1C[C@@H](CC(O)=O)CCC1 Amb25179080 [0,0,0,1,0,0|1,0,0]=2 306 B11R1.157 C[C@H]1C[C@@H](CNC1)NC(C)=O Amb25257956 [0,0,0,1,0,0|2,0,0]=3 307 B11R1.157 C[C@H]1C\C(\CCC1)=C/C(O)=O Amb25074643 [0,0,0,1,0,0|1,0,2]=4 308 B11R1.157 NC1CC(CC(O)=O)CCC1 Amb18644926 [0,0,0,1,0,0|2,0,0]=3 309 B11R1.157 NC1CCCC(C1)CC(N)=O Amb18964224 [0,0,0,1,0,0|3,0,0]=4 310 B11R1.157 NC1CN(CC(O)=O)CCC1 Amb18955426 [0,0,0,1,0,0|3,0,0]=4 311 B11R1.157 N[C@H]1C[C@H](CC(O)=O)CCC1 Amb24627101 [0,0,0,1,0,0|2,0,0]=3 312 B11R1.157 OC(=O)CC1CCCC(Cl)C1 Amb18648013 [0,0,0,1,0,0|2,0,0]=3 313 B11R1.157 OC(=O)CC1CCCC(F)C1 Amb24651233 [0,0,0,1,0,0|2,0,0]=3 314 B11R1.157 OC(=O)CC1CNCC(=O)N1 Amb25800398 [0,0,0,1,0,0|2,0,1]=4 315 B11R1.157 OC(=O)CN1CC(Br)CCC1 Amb21860428 [0,0,0,1,0,0|3,0,0]=4 316 B11R1.157 OC(=O)CN1CC(Cl)CCC1 Amb21860309 [0,0,0,1,0,0|3,0,0]=4 317 B11R1.157 OC(=O)CN1CC(I)CCC1 Amb21860467 [0,0,0,1,0,0|3,0,0]=4 318 B11R1.157 OC(=O)C[C@@H]1CNCC(=O)N1 Amb25324304 [0,0,0,1,0,0|2,0,1]=4 319 B11R1.157 OC1CC(CC(O)=O)C=CC1 Amb24484705 [0,0,0,1,0,0|2,0,1]=4 320 B11R1.157 OC1CCCC(C1)CC(O)=O Amb18645020 [0,0,0,1,0,0|2,0,0]=3 321 B11R1.157 OC1CCCN(C1)CC(=O)O Amb15701257 [0,0,0,1,0,0|3,0,0]=4 322 B11R1.157 O[C@@H]1CCC[C@H](C1)CC(O)=O Amb25257413 [0,0,0,1,0,0|2,0,0]=3 323 B11R1.157 O[C@@H]1CN(CC(O)=O)CCC1 Amb22224789 [0,0,0,1,0,0|3,0,0]=4 324 B11R1.157 O[C@H]1CCC[C@H](C1)CC(O)=O Amb24552923 [0,0,0,1,0,0|2,0,0]=3 325 B11R1.157 O[C@H]1CN(CC(O)=O)CCC1 Amb22224754 [0,0,0,1,0,0|3,0,0]=4 326 B11R1.414 CC(C)CC1(CN)CC(C)C1 Amb23449210 [0,0,0,1,0,0|2,0,1]=4 327 B11R1.414 CC(C)SC1(CN)CC(=O)C1 Amb25770757 [0,0,0,1,0,0|2,0,0]=3 328 B11R1.414 CC(C)SC1(CN)CC(O)C1 Amb24701927 [0,0,0,1,0,0|2,0,1]=4 329 B11R1.414 CN1CC(CC(N)=O)(C1)CN Amb24638270 [0,0,0,1,0,0|2,0,0]=3 330 B11R1.518 CC(C)=C[C@@H]1[C@@H]([C@H]1C)C(O)=O Amb24711211 [0,0,0,1,0,0|1,0,2]=4 331 B11R1.518 CC(C)=C[C@@H]1[C@H](C1C)C(O)=O Amb24612431 [0,0,0,1,0,0|1,0,2]=4 332 B11R1.518 CC(C)=C[C@@H]1[C@H]([C@@H]1C)C(O)=O Amb24655955 [0,0,0,1,0,0|1,0,2]=4 333 B11R1.567 CC1(C)CN(CC(O)=O)C1=O Amb25274923 [0,0,0,1,0,0|2,0,1]=4 334 B11R1.645 CC(C)CC1=CC(=O)OC1O Amb25801779 [0,0,0,1,0,0|1,0,2]=4 335 B11R1.645 CC(C)CC1CC(=O)NC1C Amb24750092 [0,0,0,1,0,0|2,0,0]=3 336 B11R1.645 CC(C)CC1NC(=O)N=C1N Amb25297684 [0,0,0,1,0,0|2,0,1]=4 337 B11R1.645 CC(C)CC1NC(=O)NC1C Amb24411868 [0,0,0,1,0,0|3,0,0]=4 338 B11R1.645 CC(C)CC1NC(=O)OC1=O Amb22388625 [0,0,0,1,0,0|2,0,1]=4 339 B11R1.645 CC(C)CC1NC(=O)OC1C Amb24393492 [0,0,0,1,0,0|2,0,0]=3 340 B11R1.645 CC(C)C[C@@H]1NC(=O)CC1O Amb25378902 [0,0,0,1,0,0|3,0,0]=4 341 B11R1.645 CC(C)C[C@H]1NC(=O)OC1=O Amb19883923 [0,0,0,1,0,0|2,0,1]=4 342 B11R1.645 CC(C)C[C@H]1OC(=O)C[C@@H]1O Amb24515311 [0,0,0,1,0,0|3,0,0]=4 343 B11R1.645 CC1=CC(C)CC1CC(O)=O Amb18125743 [0,0,0,1,0,0|1,0,2]=4 344 B11R1.645 CC1CC(=O)CC1CC(O)=O Amb24753844 [0,0,0,1,0,0|2,0,1]=4 345 B11R1.645 CC1CC(=O)N(C1)CC(O)=O Amb25133450 [0,0,0,1,0,0|2,0,1]=4 346 B11R1.645 CC1CC(C)N(C1)CC(C)=O Amb24590413 [0,0,0,1,0,0|3,0,0]=4 347 B11R1.645 CC1CC(C)N(C1)CC(O)=O Amb24593598 [0,0,0,1,0,0|2,0,0]=3 348 B11R1.645 CC1CC(CC(C)=O)N(C)C1 Amb24662369 [0,0,0,1,0,0|3,0,0]=4 349 B11R1.645 CC1CC(CC(O)=O)C(=O)C1 Amb25074617 [0,0,0,1,0,0|1,0,1]=3 350 B11R1.645 CC1CC(CC(O)=O)C(=O)N1 Amb24533057 [0,0,0,1,0,0|2,0,1]=4 351 B11R1.645 CC1CC(CC(O)=O)C(=O)O1 Amb25684801 [0,0,0,1,0,0|2,0,1]=4 352 B11R1.645 CC1CN(CC(O)=O)C(N)=N1 Amb25137040 [0,0,0,1,0,0|2,0,1]=4 353 B11R1.645 CC=1CC(CC(O)=O)C(C)C1 Amb18125745 [0,0,0,1,0,0|1,0,2]=4 354 B11R1.645 CN1CC(=O)C(CC(O)=O)C1 Amb18200022 [0,0,0,1,0,0|2,0,1]=4 355 B11R1.645 CN1CC(CC(O)=O)C(F)C1 Amb24663327 [0,0,0,1,0,0|2,0,0]=3 356 B11R1.645 CN1CC(CC(O)=O)C(N)C1 Amb18199902 [0,0,0,1,0,0|1,0,0]=2 357 B11R1.645 CN1CC(O)C(CC(O)=O)C1 Amb18199871 [0,0,0,1,0,0|2,0,0]=3 358 B11R1.645 CN1C[C@@H](CC(O)=O)[C@H](N)C1 Amb24609869 [0,0,0,1,0,0|1,0,0]=2 359 B11R1.645 C[C@@H]1CC(=O)CC1CC(O)=O Amb24693856 [0,0,0,1,0,0|2,0,1]=4 360 B11R1.645 C[C@@H]1CC(CC(O)=O)C(=O)O1 Amb25685312 [0,0,0,1,0,0|2,0,1]=4 361 B11R1.645 C[C@@H]1C[C@@H](CC(O)=O)C(=O)N1 Amb25179907 [0,0,0,1,0,0|2,0,1]=4 362 B11R1.645 C[C@H]1CC(CC(O)=O)C(=O)O1 Amb25765726 [0,0,0,1,0,0|2,0,1]=4 363 B11R1.708 CN(C)NC1CCC1C(O)=O Amb24471766 [0,0,0,1,0,0|3,0,0]=4 364 B11R1.708 OC(=O)C[C@@H]1CN[C@H]1C(O)=O Amb19131121 [0,0,0,1,0,0|2,0,1]=4 365 B11R1.710 CC(=O)C[C@@H]1COC(C)(C)O1 Amb25145697 [0,0,0,1,0,0|3,0,0]=4 366 B11R1.710 CC(=O)C[C@H]1COC(C)(C)O1 Amb25145696 [0,0,0,1,0,0|3,0,0]=4 367 B11R1.710 CC1(C)CC(CC(O)=O)C=C1 Amb18125744 [0,0,0,1,0,0|1,0,1]=3 368 B11R1.710 CC1(C)CC(CO1)NC(N)=O Amb25240389 [0,0,0,1,0,0|3,0,0]=4 369 B11R1.710 CC1(C)CC(CS1)CC(O)=O Amb18825220 [0,0,0,1,0,0|1,0,0]=2 370 B11R1.710 CC1(C)CCC(CC(O)=O)O1 Amb18126155 [0,0,0,1,0,0|2,0,0]=3 371 B11R1.710 CC1(C)OC(CO1)CC(N)=O Amb22733790 [0,0,0,1,0,0|3,0,0]=4 372 B11R1.710 CC1(C)OC(CO1)CC(O)=O Amb25680035 [0,0,0,1,0,0|2,0,0]=3 373 B11R1.710 CC1(C)O[C@@H](CO1)CC(O)=O Amb24538265 [0,0,0,1,0,0|2,0,0]=3 374 B11R1.710 CC1(C)O[C@H](CO1)CC(O)=O Amb25076668 [0,0,0,1,0,0|2,0,0]=3 375 B11R1.750 CC1CC1C(CC(O)=O)CC Amb25385423 [0,0,0,1,0,0|1,0,0]=2 376 B11R1.750 CC1CC1C(CC)=CC(O)=O Amb24711706 [0,0,0,1,0,0|1,0,2]=4 377 B11R1.933 CC(C)CC1(CC(O)=O)CC1 Amb18830741 [0,0,0,1,0,0|1,0,0]=2 378 B11R1.933 CN(C)CC1(CC(O)=O)CC1 Amb25385089 [0,0,0,1,0,0|2,0,0]=3 379 B11R1.955 CC(=O)C1C(CC1(C)C)C#N Amb24438153 [0,0,0,1,0,0|1,0,2]=4 380 B11R1.955 CC(=O)[C@@H]1[C@@H](CC1(C)C)C#N Amb25858292 [0,0,0,1,0,0|1,0,2]=4 381 B11R1.983 CC1CNC(=O)CC(C1)CC Amb25804307 [0,0,0,1,0,0|2,0,0]=3 382 B11R1.983 C[C@@H]1CNC(=O)CC(CC)N1 Amb24740743 [0,0,0,1,0,0|3,0,0]=4 383 B11R1.1032 CCC(CC1CC1)NC(C)=O Amb25379506 [0,0,0,1,0,0|3,0,0]=4 384 B9R0.39 CC(=C)CC(CC)C(O)=O Amb24480742 [0,0,0,0,1,0|1,0,2]=4 385 B9R0.39 CC(=O)C(CC(O)=O)CC Amb24410015 [0,0,0,0,1,0|2,0,1]=4 386 B9R0.39 CC(=O)CC(CC)C(O)=O Amb18644109 [0,0,0,0,1,0|2,0,1]=4 387 B9R0.39 CC(=O)N[C@@H](CN)C(O)=O Amb24479068 [0,0,0,0,1,0|2,0,1]=4 388 B9R0.39 CC(=O)OC(CN)C(O)=O Amb25082692 [0,0,0,0,1,0|2,0,1]=4 389 B9R0.39 CC(C)C(CC(C)=C)NN Amb24643631 [0,0,0,0,1,0|3,0,0]=4 390 B9R0.39 CC(C)C(CC(C)=O)CC Amb25041005 [0,0,0,0,1,0|2,0,0]=3 391 B9R0.39 CC(C)C(CC(C)=O)OC Amb24478344 [0,0,0,0,1,0|3,0,0]=4 392 B9R0.39 CC(C)C(CC(C)O)CO Amb25051409 [0,0,0,0,1,0|2,0,1]=4 393 B9R0.39 CC(C)C(CC(N)=O)CN Amb25177753 [0,0,0,0,1,0|1,0,0]=2 394 B9R0.39 CC(C)C(CC(N)=O)NC Amb25738895 [0,0,0,0,1,0|3,0,0]=4 395 B9R0.39 CC(C)C(CC(O)=O)C#N Amb25818234 [0,0,0,0,1,0|0,0,2]=3 396 B9R0.39 CC(C)C(CC(O)=O)C=C Amb18643903 [0,0,0,0,1,0|1,0,1]=3 397 B9R0.39 CC(C)C(CC(O)=O)CC Amb18304202 [0,0,0,0,1,0|1,0,0]=2 398 B9R0.39 CC(C)C(CC(O)=O)SC Amb25858344 [0,0,0,0,1,0|2,0,0]=3 399 B9R0.39 CC(C)C(CC([O-])=O)C=O Amb25094387 [0,0,0,0,1,0|1,0,2]=4 400 B9R0.39 CC(C)C(CC)NC(C)=O Amb24382327 [0,0,0,0,1,0|3,0,0]=4 401 B9R0.39 CC(C)C(CC)NC(N)=O Amb24478066 [0,0,0,0,1,0|3,0,0]=4 402 B9R0.39 CC(C)C(CC)OC(N)=O Amb25793071 [0,0,0,0,1,0|3,0,0]=4 403 B9R0.39 CC(C)C(CN)CC(C)C Amb18312486 [0,0,0,0,1,0|2,0,1]=4 404 B9R0.39 CC(C)C(CN)CC(C)O Amb25709727 [0,0,0,0,1,0|1,0,1]=3 405 B9R0.39 CC(C)C(CN)NC(C)=O Amb18251274 [0,0,0,0,1,0|2,0,0]=3 406 B9R0.39 CC(C)C(CN)NC(N)=O Amb18251283 [0,0,0,0,1,0|2,0,0]=3 407 B9R0.39 CC(C)C(CN)NS(C)=O Amb24737278 [0,0,0,0,1,0|3,0,0]=4 408 B9R0.39 CC(C)C(CO)NC(N)=O Amb24479041 [0,0,0,0,1,0|3,0,0]=4 409 B9R0.39 CC(C)C(CS(C)=O)ON Amb24569206 [0,0,0,0,1,0|3,0,0]=4 410 B9R0.39 CC(C)C(CS)NC(C)=O Amb24624696 [0,0,0,0,1,0|3,0,0]=4 411 B9R0.39 CC(C)CC(=NO)C(O)=O Amb24669467 [0,0,0,0,1,0|2,0,1]=4 412 B9R0.39 CC(C)CC(C#N)C(C)=O Amb24731730 [0,0,0,0,1,0|1,0,2]=4 413 B9R0.39 CC(C)CC(C#N)C(O)=O Amb23558965 [0,0,0,0,1,0|0,0,2]=3 414 B9R0.39 CC(C)CC(CC)C(=O)Cl Amb24383278 [0,0,0,0,1,0|2,0,0]=3 415 B9R0.39 CC(C)CC(CC)C(C)=O Amb25805780 [0,0,0,0,1,0|2,0,0]=3 416 B9R0.39 CC(C)CC(CC)C(C)O Amb24747320 [0,0,0,0,1,0|2,0,1]=4 417 B9R0.39 CC(C)CC(CC)C(O)=O Amb19014184 [0,0,0,0,1,0|1,0,0]=2 418 B9R0.39 CC(C)CC(CF)C(O)=O Amb24596212 [0,0,0,0,1,0|1,0,0]=2 419 B9R0.39 CC(C)CC(CN)C(N)=O Amb24333087 [0,0,0,0,1,0|1,0,0]=2 420 B9R0.39 CC(C)CC(CN)C(O)=O Amb19021764 [0,0,0,0,1,0|0,0,0]=1 421 B9R0.39 CC(C)CC(CO)C(O)=O Amb18124780 [0,0,0,0,1,0|1,0,0]=2 422 B9R0.39 CC(C)CC(CS)C(N)=O Amb24695162 [0,0,0,0,1,0|2,0,0]=3 423 B9R0.39 CC(C)CC(NC)C(N)=O Amb19006600 [0,0,0,0,1,0|3,0,0]=4 424 B9R0.39 CC(C)CC(NC)C(O)=O Amb22274694 [0,0,0,0,1,0|2,0,0]=3 425 B9R0.39 CC(C)CC(NN)C(C)=C Amb25281261 [0,0,0,0,1,0|3,0,0]=4 426 B9R0.39 CC(C)CC(NN)C(O)=O Amb18644273 [0,0,0,0,1,0|1,0,0]=2 427 B9R0.39 CC(C)CC(NO)C(N)=O Amb25294339 [0,0,0,0,1,0|3,0,0]=4 428 B9R0.39 CC(C)CC(ON)C(O)=O Amb18644321 [0,0,0,0,1,0|1,0,0]=2 429 B9R0.39 CC(C)C[C@@H](CN)C(O)=O Amb22756732 [0,0,0,0,1,0|0,0,0]=1 430 B9R0.39 CC(C)C[C@@H](CN)C(O)=O Amb22756740 [0,0,0,0,1,0|0,0,0]=1 431 B9R0.39 CC(C)C[C@@H](NC)C(O)=O Amb22745995 [0,0,0,0,1,0|2,0,0]=3 432 B9R0.39 CC(C)C[C@H](CO)C(O)=O Amb25214140 [0,0,0,0,1,0|1,0,0]=2 433 B9R0.39 CC(C)C[C@H](NC)C(N)=O Amb24550819 [0,0,0,0,1,0|3,0,0]=4 434 B9R0.39 CC(C)C[C@H](NCl)C(O)=O Amb24563420 [0,0,0,0,1,0|2,0,0]=3 435 B9R0.39 CC(C)C[C@H](ON)C(O)=O Amb24505012 [0,0,0,0,1,0|1,0,0]=2 436 B9R0.39 CC(C)N(CC(O)=O)C=O Amb18972732 [0,0,0,0,1,0|2,0,1]=4 437 B9R0.39 CC(C)NC(C=C)C(O)=O Amb24481162 [0,0,0,0,1,0|2,0,1]=4 438 B9R0.39 CC(C)NC(CC)C(N)=O Amb19006566 [0,0,0,0,1,0|3,0,0]=4 439 B9R0.39 CC(C)N[C@@H](CO)C(O)=O Amb24587694 [0,0,0,0,1,0|2,0,0]=3 440 B9R0.39 CC(C)N[C@@H](CS)C(O)=O Amb25299344 [0,0,0,0,1,0|2,0,0]=3 441 B9R0.39 CC(C)N[C@H](CO)C(N)=O Amb24451366 [0,0,0,0,1,0|3,0,0]=4 442 B9R0.39 CC(C)N[C@H](CO)C(O)=O Amb25099258 [0,0,0,0,1,0|2,0,0]=3 443 B9R0.39 CC(C)N[C@H](CS)C(O)=O Amb25851404 [0,0,0,0,1,0|2,0,0]=3 444 B9R0.39 CC(C)OC(C=C)C(O)=O Amb18644139 [0,0,0,0,1,0|2,0,1]=4 445 B9R0.39 CC(C)OC(CC)C(O)=O Amb25723566 [0,0,0,0,1,0|2,0,0]=3 446 B9R0.39 CC(C)SC(CC)C(N)=O Amb18788099 [0,0,0,0,1,0|3,0,0]=4 447 B9R0.39 CC(C)SC(CO)C(O)=O Amb25172117 [0,0,0,0,1,0|2,0,0]=3 448 B9R0.39 CC(C)[C@@H](CBr)OC(C)=O Amb24505068 [0,0,0,0,1,0|3,0,0]=4 449 B9R0.39 CC(C)[C@@H](CC(C)=O)CC Amb24758695 [0,0,0,0,1,0|2,0,0]=3 450 B9R0.39 CC(C)[C@@H](CS)NC(C)=O Amb25260420 [0,0,0,0,1,0|3,0,0]=4 451 B9R0.39 CC(N)C(CC(O)=O)CC Amb23536772 [0,0,0,0,1,0|2,0,0]=3 452 B9R0.39 CC(N)NC(CO)C(O)=O Amb25367822 [0,0,0,0,1,0|3,0,0]=4 453 B9R0.39 CC(O)C(CC(O)=O)CC Amb18831453 [0,0,0,0,1,0|2,0,0]=3 454 B9R0.39 CC(O)C(CC(O)=O)NC Amb24400678 [0,0,0,0,1,0|3,0,0]=4 455 B9R0.39 CCC(=CC(C)C)C(O)=O Amb25174738 [0,0,0,0,1,0|1,0,2]=4 456 B9R0.39 CCC(C(=O)O)SC(C)C Amb17501347 [0,0,0,0,1,0|2,0,0]=3 457 B9R0.39 CCC(CC(F)F)C(O)=O Amb25709926 [0,0,0,0,1,0|3,0,0]=4 458 B9R0.39 CCC(CC(O)=O)N(C)C Amb18316272 [0,0,0,0,1,0|2,0,0]=3 459 B9R0.39 CCC(NN(C)C)C(O)=O Amb24479538 [0,0,0,0,1,0|3,0,0]=4 460 B9R0.39 CCN(CC(N)=O)C(C)C Amb24455864 [0,0,0,0,1,0|3,0,0]=4 461 B9R0.39 CC\C(=C/C(O)=O)\C(C)C Amb18967765 [0,0,0,0,1,0|1,0,2]=4 462 B9R0.39 CC\C(=C\C(C)C)\C(O)=O Amb25368298 [0,0,0,0,1,0|1,0,2]=4 463 B9R0.39 CN(C)C(CC(N)=O)CN Amb25718298 [0,0,0,0,1,0|2,0,0]=3 464 B9R0.39 CN(C)C(CC(O)=O)CO Amb18202308 [0,0,0,0,1,0|2,0,0]=3 465 B9R0.39 CN(C)CC(CN)C(N)=O Amb24383057 [0,0,0,0,1,0|2,0,0]=3 466 B9R0.39 CN[C@@H](C(=O)O)CC(C)C Amb10842218 [0,0,0,0,1,0|2,0,0]=3 467 B9R0.39 CN[C@H](C(=O)O)CC(C)C Amb16183858 [0,0,0,0,1,0|2,0,0]=3 468 B9R0.39 C[C@H](O)[C@@H](CC(O)=O)NC Amb24460369 [0,0,0,0,1,0|3,0,0]=4 469 B9R0.39 C[SiH](C)NC(CO)C(O)=O Amb24557183 [0,0,0,0,1,0|2,1,0]=4 470 B9R0.39 C[SiH](C)N[C@@H](CO)C(O)=O Amb25061339 [0,0,0,0,1,0|2,1,0]=4 471 B9R0.39 C\C=C(\CC(C)C)/C(O)=O Amb18643920 [0,0,0,0,1,0|1,0,2]=4 472 B9R0.39 NCC(CC(O)=O)C(O)=O Amb22546423 [0,0,0,0,1,0|2,0,1]=4 473 B9R0.39 NCC(CC(O)=O)C(O)=O Amb24538047 [0,0,0,0,1,0|2,0,1]=4 474 B9R0.39 NC[C@H](CC(O)=O)C(O)=O Amb25147272 [0,0,0,0,1,0|2,0,1]=4 475 B9R0.39 OC(=O)CC(CF)C(F)F Amb24513956 [0,0,0,0,1,0|3,0,0]=4 476 B9R0.39 OCC(C(C)C)NC(=O)C Amb17102545 [0,0,0,0,1,0|3,0,0]=4 477 B9R0.39 OCC(CC(F)F)C(O)=O Amb24514099 [0,0,0,0,1,0|3,0,0]=4 478 B11R0.143 CC(C)CC(CC)C#CC(O)=O Amb24360704 [0,0,0,0,0,1|1,0,1]=3 479 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb22746284 [2,0,0,0,0,0|0,0,2]=4 480 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb24539924 [2,0,0,0,0,0|0,0,2]=4 481 B8R0.5 C#CC[C@H](N)CC(O)=O Amb22226648 [2,0,0,0,0,0|0,0,2]=4 482 B8R0.5 C#CC[C@H](N)CC(O)=O Amb24642007 [2,0,0,0,0,0|0,0,2]=4 483 B8R0.5 C=CCC(N)CC(O)=O Amb22641964 [2,0,0,0,0,0|0,0,2]=4 484 B8R0.5 C=CC[C@@H](CC(=O)O)C Amb10844371 [2,0,0,0,0,0|0,0,2]=4 485 B8R0.5 C=CC[C@@H](N)CC(O)=O Amb22746166 [2,0,0,0,0,0|0,0,2]=4 486 B8R0.5 C=CC[C@H](CC(=O)O)C Amb10844336 [2,0,0,0,0,0|0,0,2]=4 487 B8R0.5 CC(C)CC(=O)CC=O Amb18642654 [2,0,0,0,0,0|1,0,1]=4 488 B8R0.5 CC(C)CC(C)CC=O Amb18642682 [2,0,0,0,0,0|0,0,0]=2 489 B8R0.5 CC(C)CC(C)CCC Amb22228271 [2,0,0,0,0,0|1,0,1]=4 490 B8R0.5 CC(C)CC(C)CCN Amb25848784 [2,0,0,0,0,0|1,0,1]=4 491 B8R0.5 CC(C)CC(C)CNC Amb19023731 [2,0,0,0,0,0|2,0,0]=4 492 B8R0.5 CC(C)CC(C)CNN Amb25084656 [2,0,0,0,0,0|2,0,0]=4 493 B8R0.5 CC(C)CC(C)CNO Amb25238605 [2,0,0,0,0,0|1,0,0]=3 494 B8R0.5 CC(C)CC(C)NC=O Amb24477688 [2,0,0,0,0,0|1,0,0]=3 495 B8R0.5 CC(C)CC(N)CC#C Amb18295814 [2,0,0,0,0,0|1,0,1]=4 496 B8R0.5 CC(C)CC(N)CC#N Amb25180676 [2,0,0,0,0,0|1,0,1]=4 497 B8R0.5 CC(C)CC(N)CC=C Amb18306504 [2,0,0,0,0,0|1,0,0]=3 498 B8R0.5 CC(C)CC(N)CCC Amb18307059 [2,0,0,0,0,0|1,0,1]=4 499 B8R0.5 CC(C)CC(N)CCO Amb18203172 [2,0,0,0,0,0|0,0,1]=3 500 B8R0.5 CC(C)CC(N)CNC Amb19009731 [2,0,0,0,0,0|2,0,0]=4 501 B8R0.5 CC(C)CC(N)CSC Amb18314440 [2,0,0,0,0,0|2,0,0]=4 502 B8R0.5 CC(C)CC(N)NC=O Amb25243005 [2,0,0,0,0,0|1,0,0]=3 503 B8R0.5 CC(C)CC(O)CC=C Amb25298097 [2,0,0,0,0,0|2,0,0]=4 504 B8R0.5 CC(C)CC(O)CCO Amb23512717 [2,0,0,0,0,0|1,0,1]=4 505 B8R0.5 CC(C)C[C@@H](N)COC Amb18016632 [2,0,0,0,0,0|2,0,0]=4 506 B8R0.5 CC(C)C[C@@H](O)CCO Amb25343763 [2,0,0,0,0,0|1,0,1]=4 507 B8R0.5 CC(C)C[C@H](C)CCBr Amb24479945 [2,0,0,0,0,0|1,0,1]=4 508 B8R0.5 CC(C)C[C@H](C)CCO Amb24456802 [2,0,0,0,0,0|0,0,1]=3 509 B8R0.5 CC(C)C[C@H](N)CC#N Amb24477736 [2,0,0,0,0,0|1,0,1]=4 510 B8R0.5 CC(C)C[C@H](N)CCO Amb24446600 [2,0,0,0,0,0|0,0,1]=3 511 B8R0.5 CC(C)C[C@H](N)CNC Amb25319273 [2,0,0,0,0,0|2,0,0]=4 512 B8R0.5 CC(C)C[C@H](N)NC=O Amb24641394 [2,0,0,0,0,0|1,0,0]=3 513 B8R0.5 CC(C)C[C@H](O)CCO Amb25129820 [2,0,0,0,0,0|1,0,1]=4 514 B8R0.5 CC(C)C\C(\C)=C\C=O Amb18642447 [2,0,0,0,0,0|0,0,2]=4 515 B8R0.5 CC(C)NC(C)CCO Amb18642855 [2,0,0,0,0,0|1,0,1]=4 516 B8R0.5 CC(C)N[C@@H](C)CCO Amb24639082 [2,0,0,0,0,0|1,0,1]=4 517 B8R0.5 CC(C)OC(C)NC=O Amb25709168 [2,0,0,0,0,0|2,0,0]=4 518 B8R0.5 CC(CC#N)CC(O)=O Amb18642506 [2,0,0,0,0,0|1,0,1]=4 519 B8R0.5 CC(CC(C)O)NC=O Amb25286121 [2,0,0,0,0,0|2,0,0]=4 520 B8R0.5 CC(CC=C)CC(C)Br Amb24712451 [2,0,0,0,0,0|2,0,0]=4 521 B8R0.5 CC(CC=C)CC(C)Cl Amb24435533 [2,0,0,0,0,0|2,0,0]=4 522 B8R0.5 CC(CC=C)CC(C)N Amb24639729 [2,0,0,0,0,0|2,0,0]=4 523 B8R0.5 CC(CC=C)CC(O)=O Amb18642628 [2,0,0,0,0,0|0,0,2]=4 524 B8R0.5 CC(CC=O)C=C(C)C Amb25289294 [2,0,0,0,0,0|0,0,2]=4 525 B8R0.5 CC(CC=O)CC(C)=C Amb18642471 [2,0,0,0,0,0|0,0,2]=4 526 B8R0.5 CC(CC=O)CC(C)O Amb25858195 [2,0,0,0,0,0|1,0,0]=3 527 B8R0.5 CC(CCBr)CC(C)=O Amb24740003 [2,0,0,0,0,0|2,0,0]=4 528 B8R0.5 CC(CCCl)CC(C)=O Amb25231057 [2,0,0,0,0,0|2,0,0]=4 529 B8R0.5 CC(CCF)CC(O)=O Amb24477914 [2,0,0,0,0,0|1,0,0]=3 530 B8R0.5 CC(CCN)CC(O)=O Amb20667689 [2,0,0,0,0,0|1,0,0]=3 531 B8R0.5 CC(CCN)CC(O)=O Amb24376646 [2,0,0,0,0,0|1,0,0]=3 532 B8R0.5 CC(CCO)CC(C)=O Amb24563263 [2,0,0,0,0,0|2,0,0]=4 533 B8R0.5 CC(CCO)CC(O)=O Amb18642882 [2,0,0,0,0,0|1,0,0]=3 534 B8R0.5 CC(CN(C)C)NC=O Amb24462983 [2,0,0,0,0,0|2,0,0]=4 535 B8R0.5 CC(NCC)CC(=O)N Amb17231866 [2,0,0,0,0,0|2,0,0]=4 536 B8R0.5 CC(NCC)CC(=O)O Amb13952759 [2,0,0,0,0,0|1,0,0]=3 537 B8R0.5 CC(O)CC(N)CCC Amb24477692 [2,0,0,0,0,0|1,0,1]=4 538 B8R0.5 CC(O)CC(O)CC=O Amb25032311 [2,0,0,0,0,0|2,0,0]=4 539 B8R0.5 CCCC(=C)CC(O)=O Amb18642622 [2,0,0,0,0,0|0,0,2]=4 540 B8R0.5 CCCC(Br)CC(O)=O Amb18127175 [2,0,0,0,0,0|1,0,0]=3 541 B8R0.5 CCCC(C)CC(C)=C Amb22730409 [2,0,0,0,0,0|2,0,0]=4 542 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [2,0,0,0,0,0|1,0,0]=3 543 B8R0.5 CCCC(C)CC(C)O Amb22229840 [2,0,0,0,0,0|1,0,1]=4 544 B8R0.5 CCCC(C)CC(N)=N Amb25771598 [2,0,0,0,0,0|2,0,0]=4 545 B8R0.5 CCCC(C)CC(N)=O Amb25146057 [2,0,0,0,0,0|1,0,0]=3 546 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [2,0,0,0,0,0|2,0,0]=4 547 B8R0.5 CCCC(CC(=O)C)O Amb17593376 [2,0,0,0,0,0|2,0,0]=4 548 B8R0.5 CCCC(CC(=O)O)N Amb1993864 [2,0,0,0,0,0|0,0,0]=2 549 B8R0.5 CCCC(N)CC(C)=C Amb25145992 [2,0,0,0,0,0|2,0,0]=4 550 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [2,0,0,0,0,0|1,0,0]=3 551 B8R0.5 CCCC(N)CC(O)=O Amb21961469 [2,0,0,0,0,0|0,0,0]=2 552 B8R0.5 CCCC(N)NC(C)=O Amb24670118 [2,0,0,0,0,0|2,0,0]=4 553 B8R0.5 CCCC(O)CC(N)=O Amb25072270 [2,0,0,0,0,0|2,0,0]=4 554 B8R0.5 CCCN(C)CC(N)=O Amb24700757 [2,0,0,0,0,0|2,0,0]=4 555 B8R0.5 CCCN(C)CC(O)=O Amb19373314 [2,0,0,0,0,0|1,0,0]=3 556 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [2,0,0,0,0,0|2,0,0]=4 557 B8R0.5 CCC[C@@H](C)CC(N)=O Amb24761385 [2,0,0,0,0,0|1,0,0]=3 558 B8R0.5 CCC[C@@H](C)CC(O)=O Amb24622486 [2,0,0,0,0,0|0,0,0]=2 559 B8R0.5 CCC[C@@H](C)NC(C)=O Amb25844046 [2,0,0,0,0,0|2,0,0]=4 560 B8R0.5 CCC[C@@H](CC(=O)O)C Amb10844381 [2,0,0,0,0,0|0,0,0]=2 561 B8R0.5 CCC[C@@H](N)CC(O)=O Amb22225223 [2,0,0,0,0,0|0,0,0]=2 562 B8R0.5 CCC[C@@H](N)CC(O)=O Amb24739278 [2,0,0,0,0,0|0,0,0]=2 563 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [2,0,0,0,0,0|2,0,0]=4 564 B8R0.5 CCC[C@@H](O)CC(O)=O Amb25188904 [2,0,0,0,0,0|1,0,0]=3 565 B8R0.5 CCC[C@H](C)CC(N)=O Amb25340178 [2,0,0,0,0,0|1,0,0]=3 566 B8R0.5 CCC[C@H](N)CC(O)=O Amb22226359 [2,0,0,0,0,0|0,0,0]=2 567 B8R0.5 CCC[C@H](O)CC(O)=O Amb25367955 [2,0,0,0,0,0|1,0,0]=3 568 B8R0.5 CCNC(C)CC(C)=O Amb25131542 [2,0,0,0,0,0|2,0,0]=4 569 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [2,0,0,0,0,0|2,0,0]=4 570 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [2,0,0,0,0,0|1,0,0]=3 571 B8R0.5 CN(C)CC(N)CC=C Amb25063213 [2,0,0,0,0,0|2,0,0]=4 572 B8R0.5 CN(CCCl)CC(O)=O Amb25829318 [2,0,0,0,0,0|2,0,0]=4 573 B8R0.5 CN(CCF)CC(O)=O Amb25760005 [2,0,0,0,0,0|2,0,0]=4 574 B8R0.5 CN(CCN)CC(O)=O Amb18313585 [2,0,0,0,0,0|2,0,0]=4 575 B8R0.5 CNCC(C)CC(O)=O Amb25284797 [2,0,0,0,0,0|1,0,0]=3 576 B8R0.5 COCC(C)CC(O)=O Amb19024342 [2,0,0,0,0,0|1,0,0]=3 577 B8R0.5 COCC(Cl)CC(O)=O Amb24627002 [2,0,0,0,0,0|2,0,0]=4 578 B8R0.5 COCC(O)CC(O)=O Amb18832518 [2,0,0,0,0,0|2,0,0]=4 579 B8R0.5 COC[C@@H](C)CC(O)=O Amb25064328 [2,0,0,0,0,0|1,0,0]=3 580 B8R0.5 COC[C@H](CC(C)C)N Amb17061639 [2,0,0,0,0,0|2,0,0]=4 581 B8R0.5 CSCC(Cl)CC(O)=O Amb18126320 [2,0,0,0,0,0|2,0,0]=4 582 B8R0.5 CSCC(N)CC(N)=O Amb25784570 [2,0,0,0,0,0|2,0,0]=4 583 B8R0.5 CSCC(O)CC(O)=O Amb24621046 [2,0,0,0,0,0|2,0,0]=4 584 B8R0.5 CSSC(C)CC(O)=O Amb25241180 [2,0,0,0,0,0|2,0,0]=4 585 B8R0.5 C[C@@H](CCN)CC(O)=O Amb25318051 [2,0,0,0,0,0|1,0,0]=3 586 B8R0.5 C[C@@H](CCO)CC(O)=O Amb24699186 [2,0,0,0,0,0|1,0,0]=3 587 B8R0.5 C[C@@H](CN(C)C)NC=O Amb25785516 [2,0,0,0,0,0|2,0,0]=4 588 B8R0.5 C[C@@H](O)C[C@@H](O)CC=O Amb24631653 [2,0,0,0,0,0|2,0,0]=4 589 B8R0.5 C[C@H](CC=O)CC(C)=C Amb25680323 [2,0,0,0,0,0|0,0,2]=4 590 B8R0.5 C\C(=C/C(=O)O)\CCC Amb10610367 [2,0,0,0,0,0|0,0,2]=4 591 B8R0.5 C\C(\CC(O)=O)=C/CC Amb25087318 [2,0,0,0,0,0|0,0,2]=4 592 B8R0.5 C\C(\CC(O)=O)=C\CC Amb24562251 [2,0,0,0,0,0|0,0,2]=4 593 B8R0.5 C\C(\CCC)=C\C(O)=O Amb24055711 [2,0,0,0,0,0|0,0,2]=4 594 B8R0.5 C\C=C\C(C)CC(O)=O Amb24731262 [2,0,0,0,0,0|0,0,2]=4 595 B8R0.5 C\C=C\[C@@H](C)CC(O)=O Amb25343237 [2,0,0,0,0,0|0,0,2]=4 596 B8R0.5 NCC[C@@H](CC(=O)O)N Amb10067021 [2,0,0,0,0,0|1,0,0]=3 597 B8R0.5 NCC[C@H](CC(=O)O)N Amb10067019 [2,0,0,0,0,0|1,0,0]=3 598 B8R0.5 N[C@@H](CCO)CC(O)=O Amb25851007 [2,0,0,0,0,0|1,0,0]=3 599 B8R0.16 CC(=O)CC(CC)CC Amb25791160 [2,0,0,0,0,0|2,0,0]=4 600 B8R0.16 CC(C)CC(C=C)NN Amb25077690 [2,0,0,0,0,0|1,0,1]=4 601 B8R0.16 CC(C)CC(CBr)C=C Amb24524179 [2,0,0,0,0,0|1,0,1]=4 602 B8R0.16 CC(C)CC(CBr)CC Amb25740694 [2,0,0,0,0,0|1,0,1]=4 603 B8R0.16 CC(C)CC(CC)C=O Amb25291041 [2,0,0,0,0,0|1,0,0]=3 604 B8R0.16 CC(C)CC(CC)NN Amb24405491 [2,0,0,0,0,0|1,0,1]=4 605 B8R0.16 CC(C)CC(CN)=C=C Amb25679279 [2,0,0,0,0,0|0,0,2]=4 606 B8R0.16 CC(C)CC(CN)CC Amb19026794 [2,0,0,0,0,0|0,0,1]=3 607 B8R0.16 CC(C)CC(CN)NC Amb24476050 [2,0,0,0,0,0|1,0,1]=4 608 B8R0.16 CC(C)CC(CN)OC Amb24644820 [2,0,0,0,0,0|1,0,1]=4 609 B8R0.16 CC(C)CC(CO)C#N Amb18642524 [2,0,0,0,0,0|0,0,2]=4 610 B8R0.16 CC(C)CC(CO)C=C Amb25788889 [2,0,0,0,0,0|1,0,1]=4 611 B8R0.16 CC(C)CC(CO)CC Amb22641858 [2,0,0,0,0,0|1,0,0]=3 612 B8R0.16 CC(C)CC(CO)NC Amb18307102 [2,0,0,0,0,0|2,0,0]=4 613 B8R0.16 CC(C)C[C@@H](CBr)C=C Amb25074579 [2,0,0,0,0,0|1,0,1]=4 614 B8R0.16 CC(C)C[C@@H](CN)CC Amb24476608 [2,0,0,0,0,0|0,0,1]=3 615 B8R0.16 CC(C)C[C@@H](CO)NC Amb24382584 [2,0,0,0,0,0|2,0,0]=4 616 B8R0.16 CC(C)C[C@H](CBr)C=C Amb25337411 [2,0,0,0,0,0|1,0,1]=4 617 B8R0.16 CC(C)C[C@H](CO)CC Amb24657452 [2,0,0,0,0,0|1,0,0]=3 618 B8R0.16 CC(C)C[C@H](CO)NC Amb25146155 [2,0,0,0,0,0|2,0,0]=4 619 B8R0.16 CC(C)NC(CN)CC Amb25209384 [2,0,0,0,0,0|1,0,1]=4 620 B8R0.16 CC(C)NC(CN)CO Amb24347462 [2,0,0,0,0,0|1,0,0]=3 621 B8R0.16 CC(C)NC(CO)CO Amb24636514 [2,0,0,0,0,0|2,0,0]=4 622 B8R0.16 CC(C)OC(CC)C=O Amb25046221 [2,0,0,0,0,0|2,0,0]=4 623 B8R0.16 CC(C)OC(CN)CC Amb19033649 [2,0,0,0,0,0|1,0,1]=4 624 B8R0.16 CC(C)OC(CO)CO Amb24456959 [2,0,0,0,0,0|2,0,0]=4 625 B8R0.16 CC(C)SC(CC)C=O Amb18643392 [2,0,0,0,0,0|2,0,0]=4 626 B8R0.16 CC(C)SC(CCl)C=O Amb25104992 [2,0,0,0,0,0|2,0,0]=4 627 B8R0.16 CC(C)SC(CN)CC Amb18314785 [2,0,0,0,0,0|1,0,1]=4 628 B8R0.16 CC(O)CC(CC)C=O Amb24669026 [2,0,0,0,0,0|2,0,0]=4 629 B8R0.16 CCC(CC(=O)Cl)CCl Amb25189070 [2,0,0,0,0,0|2,0,0]=4 630 B8R0.16 CCC(CC(O)=O)C=C Amb18642661 [2,0,0,0,0,0|1,0,1]=4 631 B8R0.16 CCC(CC(O)=O)C=O Amb25372312 [2,0,0,0,0,0|1,0,1]=4 632 B8R0.16 CCC(CC(O)=O)CO Amb25188910 [2,0,0,0,0,0|1,0,0]=3 633 B8R0.16 CCC(CC(O)=O)NC Amb25190337 [2,0,0,0,0,0|2,0,0]=4 634 B8R0.16 CCC(CC(O)=O)OC Amb19037306 [2,0,0,0,0,0|2,0,0]=4 635 B8R0.16 CCC(CC(O)=O)SC Amb18316304 [2,0,0,0,0,0|2,0,0]=4 636 B8R0.16 CCC(CN)CC(C)=C Amb24359882 [2,0,0,0,0,0|2,0,0]=4 637 B8R0.16 CCC(CN)CC(O)=O Amb20669457 [2,0,0,0,0,0|0,0,0]=2 638 B8R0.16 CCC(CN)CC(O)=O Amb22059482 [2,0,0,0,0,0|0,0,0]=2 639 B8R0.16 CCC(CN)CN(C)C Amb25146879 [2,0,0,0,0,0|1,0,1]=4 640 B8R0.16 CCC(CN)NC(C)=O Amb18112590 [2,0,0,0,0,0|2,0,0]=4 641 B8R0.16 CCC(CN)NC(N)=O Amb18908302 [2,0,0,0,0,0|2,0,0]=4 642 B8R0.16 CCC(CO)CN(C)C Amb25716404 [2,0,0,0,0,0|2,0,0]=4 643 B8R0.16 CCN(CC(O)=O)CC Amb19258254 [2,0,0,0,0,0|2,0,0]=4 644 B8R0.16 CCP(CC(O)=O)CC Amb24687205 [2,0,0,0,0,0|2,0,0]=4 645 B8R0.16 CC[C@@H](CN)CC(C)=C Amb24393061 [2,0,0,0,0,0|2,0,0]=4 646 B8R0.16 CN(C)CC(CN)CN Amb22001706 [2,0,0,0,0,0|2,0,0]=4 647 B8R0.16 CN(C)CC(CN)CO Amb25032251 [2,0,0,0,0,0|1,0,0]=3 648 B8R0.16 CN(C)CC(CO)CO Amb25333581 [2,0,0,0,0,0|2,0,0]=4 649 B8R0.16 COC(CC(O)=O)CO Amb25738299 [2,0,0,0,0,0|2,0,0]=4 650 B8R0.16 NCC(CC(O)=O)CO Amb22546422 [2,0,0,0,0,0|1,0,0]=3 651 B8R0.16 NC[C@@H](CS)CC(O)=O Amb24562843 [2,0,0,0,0,0|1,0,0]=3 652 B8R0.16 NC[C@H](CS)CC(O)=O Amb24598331 [2,0,0,0,0,0|1,0,0]=3 653 B8R0.22 C=CCC(CN)CCO Amb24426821 [2,0,0,0,0,0|2,0,0]=4 654 B8R0.22 CCC(CC=O)SCC Amb25785128 [2,0,0,0,0,0|2,0,0]=4 655 B8R0.22 CCC(CCO)CCC Amb25105408 [2,0,0,0,0,0|1,0,1]=4 656 B8R0.22 CCCC(CBr)CC=C Amb24468596 [2,0,0,0,0,0|2,0,0]=4 657 B8R0.22 CCCC(CC=O)C=C Amb18642456 [2,0,0,0,0,0|1,0,1]=4 658 B8R0.22 CCCC(CC=O)C=O Amb18642638 [2,0,0,0,0,0|1,0,1]=4 659 B8R0.22 CCCC(CC=O)CC Amb24677895 [2,0,0,0,0,0|1,0,0]=3 660 B8R0.22 CCCC(CC=O)OC Amb24741759 [2,0,0,0,0,0|2,0,0]=4 661 B8R0.22 CCCC(CC=O)SC Amb16232215 [2,0,0,0,0,0|2,0,0]=4 662 B8R0.22 CCCC(CCl)CC=C Amb25312784 [2,0,0,0,0,0|2,0,0]=4 663 B8R0.22 CCCC(CN)CCO Amb19149196 [2,0,0,0,0,0|0,0,1]=3 664 B8R0.22 CCCC(CN)COC Amb25683544 [2,0,0,0,0,0|2,0,0]=4 665 B8R0.22 CCC[C@H](CC=O)C=C Amb24748922 [2,0,0,0,0,0|1,0,1]=4 666 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [2,0,0,0,0,0|1,0,1]=4 667 B8R0.28 CC(Br)CCCC(=O)Cl Amb25364942 [2,0,0,0,0,0|2,0,0]=4 668 B8R0.28 CC(Br)CCCC(C)=O Amb24340312 [2,0,0,0,0,0|2,0,0]=4 669 B8R0.28 CC(Br)CCCC(O)=O Amb24480052 [2,0,0,0,0,0|1,0,0]=3 670 B8R0.28 CC(C)/C=C/CC(O)=O Amb17844074 [2,0,0,0,0,0|0,0,2]=4 671 B8R0.28 CC(C)CCCB(O)O Amb24593360 [2,0,0,0,0,0|1,0,1]=4 672 B8R0.28 CC(C)CCCC(=O)Cl Amb24477882 [2,0,0,0,0,0|1,0,0]=3 673 B8R0.28 CC(C)CCCC(C)=C Amb22228386 [2,0,0,0,0,0|2,0,0]=4 674 B8R0.28 CC(C)CCCC(N)=N Amb23569433 [2,0,0,0,0,0|2,0,0]=4 675 B8R0.28 CC(C)CCCC(N)=O Amb24579456 [2,0,0,0,0,0|1,0,0]=3 676 B8R0.28 CC(C)CCCS(C)=O Amb24577266 [2,0,0,0,0,0|2,0,0]=4 677 B8R0.28 CC(C)CCC[C@@H](C)O Amb22746847 [2,0,0,0,0,0|1,0,1]=4 678 B8R0.28 CC(C)CCNC(=O)Cl Amb25378849 [2,0,0,0,0,0|2,0,0]=4 679 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [2,0,0,0,0,0|2,0,0]=4 680 B8R0.28 CC(C)CCSC(N)=O Amb24680835 [2,0,0,0,0,0|2,0,0]=4 681 B8R0.28 CC(C)CNCC(C)=O Amb25067661 [2,0,0,0,0,0|2,0,0]=4 682 B8R0.28 CC(C)CNCC(O)=O Amb19373106 [2,0,0,0,0,0|1,0,0]=3 683 B8R0.28 CC(C)CNCS(O)=O Amb24478690 [2,0,0,0,0,0|2,0,0]=4 684 B8R0.28 CC(C)CSCC(N)=O Amb25283648 [2,0,0,0,0,0|2,0,0]=4 685 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [2,0,0,0,0,0|2,0,0]=4 686 B8R0.28 CC(C)OCCC(C)=O Amb22229804 [2,0,0,0,0,0|2,0,0]=4 687 B8R0.28 CC(C)OCCC(N)=O Amb25783535 [2,0,0,0,0,0|2,0,0]=4 688 B8R0.28 CC(C)OCCS(O)=O Amb24551322 [2,0,0,0,0,0|2,0,0]=4 689 B8R0.28 CC(C)ONCC(O)=O Amb24690245 [2,0,0,0,0,0|2,0,0]=4 690 B8R0.28 CC(C)SCCC(N)=O Amb25739954 [2,0,0,0,0,0|2,0,0]=4 691 B8R0.28 CC(C)SSCC(O)=O Amb24425479 [2,0,0,0,0,0|2,0,0]=4 692 B8R0.28 CC(CCCC(=O)O)O Amb2371277 [2,0,0,0,0,0|1,0,0]=3 693 B8R0.28 CC(CCCC(=O)[O-])O Amb17615415 [2,0,0,0,0,0|1,0,1]=4 694 B8R0.28 CC(CCNC(=O)N)C Amb1104833 [2,0,0,0,0,0|2,0,0]=4 695 B8R0.28 CC(CNCC(=O)N)C Amb1118171 [2,0,0,0,0,0|2,0,0]=4 696 B8R0.28 CC(COCC(=O)N)C Amb2131093 [2,0,0,0,0,0|2,0,0]=4 697 B8R0.28 CC(CSCC(=O)O)C Amb1134811 [2,0,0,0,0,0|1,0,0]=3 698 B8R0.28 CC(Cl)CCCC(C)=O Amb25724389 [2,0,0,0,0,0|2,0,0]=4 699 B8R0.28 CC(Cl)CCCC(O)=O Amb24740888 [2,0,0,0,0,0|1,0,0]=3 700 B8R0.28 CC(Cl)COCC(O)=O Amb24480258 [2,0,0,0,0,0|2,0,0]=4 701 B8R0.28 CC(N)CCCC(O)=O Amb22059416 [2,0,0,0,0,0|1,0,0]=3 702 B8R0.28 CC(N)COCC(O)=O Amb25368702 [2,0,0,0,0,0|2,0,0]=4 703 B8R0.28 CC(NCCC(=O)O)C Amb1106349 [2,0,0,0,0,0|1,0,0]=3 704 B8R0.28 CC(O)CCCC(C)=O Amb24340114 [2,0,0,0,0,0|2,0,0]=4 705 B8R0.28 CC(O)CCCC(N)=O Amb24622764 [2,0,0,0,0,0|2,0,0]=4 706 B8R0.28 CC(O)CSCC(O)=O Amb19005278 [2,0,0,0,0,0|2,0,0]=4 707 B8R0.28 CN(C)NCCC(O)=O Amb24113891 [2,0,0,0,0,0|2,0,0]=4 708 B8R0.28 CS(=O)CCCC(O)=O Amb18306076 [2,0,0,0,0,0|2,0,0]=4 709 B8R0.28 C[C@@H](N)CCCC(O)=O Amb24435680 [2,0,0,0,0,0|1,0,0]=3 710 B8R0.28 C[C@@H](N)COCC(O)=O Amb24641471 [2,0,0,0,0,0|2,0,0]=4 711 B8R0.28 C[C@H](N)COCC(O)=O Amb25305053 [2,0,0,0,0,0|2,0,0]=4 712 B8R0.28 C[C@H](O)CCCC(O)=O Amb25842809 [2,0,0,0,0,0|1,0,0]=3 713 B8R0.28 OC(=O)CCC=C(C)C Amb10601609 [2,0,0,0,0,0|0,0,2]=4 714 B8R0.28 OC(=O)CCCC(Cl)Cl Amb24479944 [2,0,0,0,0,0|2,0,0]=4 715 B8R0.28 OC(=O)CCCC(F)F Amb24117996 [2,0,0,0,0,0|2,0,0]=4 716 B8R0.28 OC(O)CCCC(O)=O Amb25205498 [2,0,0,0,0,0|2,0,0]=4 717 B10R0.23 CC(C)C(CC(O)=O)OCC Amb20669035 [1,1,0,0,0,0|2,0,0]=4 718 B10R0.54 CC(C)CC(CN)C(=O)NO Amb24754842 [1,1,0,0,0,0|1,0,1]=4 719 B10R0.54 C\C(=C/C)\C(CN)CC(O)=O Amb25384971 [1,1,0,0,0,0|0,0,2]=4 720 B10R0.54 C\C(=C\C)\C(CN)CC(O)=O Amb25386432 [1,1,0,0,0,0|0,0,2]=4 721 B10R0.79 CC#C[C@H](CCC)CC(O)=O Amb25383192 [1,1,0,0,0,0|1,0,1]=4 722 B10R0.79 CC(C)CN(CCN)CCO Amb24101941 [1,1,0,0,0,0|1,0,1]=4 723 B10R0.87 CCCCC(CC(O)=O)CC Amb18797358 [1,1,0,0,0,0|1,0,0]=3 724 B10R0.13 CC(=C)CC(C)C(C)C(O)=O Amb24762085 [1,1,0,0,0,0|0,0,2]=4 725 B10R0.13 CC(=O)C(C)C(C)CC(O)=O Amb18645031 [1,1,0,0,0,0|1,0,1]=4 726 B10R0.13 CC(=O)CC(C)C(C)C(O)=O Amb18126130 [1,1,0,0,0,0|1,0,1]=4 727 B10R0.13 CC(C(=O)N(CC(=O)O)C)C Amb1115376 [1,1,0,0,0,0|1,0,1]=4 728 B10R0.13 CC(C(C)CC(O)=O)N(C)C Amb18830326 [1,1,0,0,0,0|1,0,0]=3 729 B10R0.13 CC(C)=CC(C)C(N)C(O)=O Amb24484645 [1,1,0,0,0,0|0,0,2]=4 730 B10R0.13 CC(C)C(=O)C(C)CC(O)=O Amb18797329 [1,1,0,0,0,0|0,0,1]=3 731 B10R0.13 CC(C)C(C)C(N)CC(C)=C Amb24750531 [1,1,0,0,0,0|2,0,0]=4 732 B10R0.13 CC(C)C(C)N(C)CC(N)=O Amb18791936 [1,1,0,0,0,0|2,0,0]=4 733 B10R0.13 CC(C)C(N)C(C)CC(O)=O Amb23536747 [1,1,0,0,0,0|0,0,0]=2 734 B10R0.13 CC(C)C(N)C(O)CC(O)=O Amb25385695 [1,1,0,0,0,0|1,0,0]=3 735 B10R0.13 CC(C)C(O)C(C)CC(O)=O Amb18797772 [1,1,0,0,0,0|0,0,0]=2 736 B10R0.13 CC(C)C(O)C(N)CC(O)=O Amb18199829 [1,1,0,0,0,0|0,0,0]=2 737 B10R0.13 CC(C)C(O)C(O)CC(C)=O Amb24765335 [1,1,0,0,0,0|2,0,0]=4 738 B10R0.13 CC(C)C(O)C(O)CC(O)=O Amb25385137 [1,1,0,0,0,0|1,0,0]=3 739 B10R0.13 CC(C)CC(C)C(=O)C(O)=O Amb18645040 [1,1,0,0,0,0|0,0,1]=3 740 B10R0.13 CC(C)CC(C)C(C)C(C)=O Amb24765124 [1,1,0,0,0,0|1,0,0]=3 741 B10R0.13 CC(C)CC(C)C(Cl)C(N)=O Amb24750741 [1,1,0,0,0,0|1,0,0]=3 742 B10R0.13 CC(C)CC(C)C(F)C(O)=O Amb24761994 [1,1,0,0,0,0|0,0,0]=2 743 B10R0.13 CC(C)CC(C)C(N)C(N)=O Amb24750735 [1,1,0,0,0,0|1,0,0]=3 744 B10R0.13 CC(C)CC(C)C(N)C(O)=O Amb25384855 [1,1,0,0,0,0|0,0,0]=2 745 B10R0.13 CC(C)CC(C)C(O)C(N)=O Amb24750740 [1,1,0,0,0,0|1,0,0]=3 746 B10R0.13 CC(C)CC(C)N(C)C(=O)Cl Amb24755171 [1,1,0,0,0,0|2,0,0]=4 747 B10R0.13 CC(C)CC(C)N(C)C(C)=O Amb25379492 [1,1,0,0,0,0|2,0,0]=4 748 B10R0.13 CC(C)CC(C)N(C)C(N)=O Amb18791971 [1,1,0,0,0,0|2,0,0]=4 749 B10R0.13 CC(C)CC(N)C(O)C(O)=O Amb18645488 [1,1,0,0,0,0|0,0,0]=2 750 B10R0.13 CC(C)CC(O)C(=C)C(O)=O Amb25384598 [1,1,0,0,0,0|1,0,1]=4 751 B10R0.13 CC(C)CC(O)C(C)C(C)=O Amb24765290 [1,1,0,0,0,0|2,0,0]=4 752 B10R0.13 CC(C)CC(O)C(C)C(N)=O Amb25385675 [1,1,0,0,0,0|2,0,0]=4 753 B10R0.13 CC(C)CC(O)C(C)C(O)=O Amb18310730 [1,1,0,0,0,0|1,0,0]=3 754 B10R0.13 CC(C)CC(O)C(F)C(C)=O Amb25383623 [1,1,0,0,0,0|2,0,0]=4 755 B10R0.13 CC(C)CC(O)C(O)C(C)=O Amb24765153 [1,1,0,0,0,0|2,0,0]=4 756 B10R0.13 CC(C)CN(C)C(C)C(N)=O Amb18799990 [1,1,0,0,0,0|2,0,0]=4 757 B10R0.13 CC(C)CN(C)[C@H](C)C(N)=O Amb24756053 [1,1,0,0,0,0|2,0,0]=4 758 B10R0.13 CC(C)CS(=O)C(C)C(O)=O Amb18314642 [1,1,0,0,0,0|2,0,0]=4 759 B10R0.13 CC(C)C[C@@H](N)[C@@H](C)C(O)=O Amb25385753 [1,1,0,0,0,0|0,0,0]=2 760 B10R0.13 CC(C)C[C@@H](N)[C@@H](O)C(O)=O Amb22746335 [1,1,0,0,0,0|0,0,0]=2 761 B10R0.13 CC(C)C[C@@H](O)[C@H](C)C(N)=O Amb24764529 [1,1,0,0,0,0|2,0,0]=4 762 B10R0.13 CC(C)C[C@@H](O)[C@H](C)C(O)=O Amb25384994 [1,1,0,0,0,0|1,0,0]=3 763 B10R0.13 CC(C)OC(C)C(N)C(O)=O Amb25386033 [1,1,0,0,0,0|1,0,0]=3 764 B10R0.13 CC(C)S(=O)C(C)CC(O)=O Amb18305769 [1,1,0,0,0,0|1,0,0]=3 765 B10R0.13 CC(C)[C@H](C)[C@H](N)CC(O)=O Amb25382119 [1,1,0,0,0,0|0,0,0]=2 766 B10R0.13 CC(C)[C@H](N)[C@@H](O)CC(O)=O Amb25379824 [1,1,0,0,0,0|1,0,0]=3 767 B10R0.13 CC(O)CC(N)C(O)C(N)=O Amb25385677 [1,1,0,0,0,0|2,0,0]=4 768 B10R0.13 CC(O)CC(N)C(O)C(O)=O Amb25384591 [1,1,0,0,0,0|1,0,0]=3 769 B10R0.13 CC(O)CN(C)C(C)C(O)=O Amb19021865 [1,1,0,0,0,0|2,0,0]=4 770 B10R0.13 CN(C)C(=O)C(N)CC(O)=O Amb18224399 [1,1,0,0,0,0|1,0,1]=4 771 B10R0.13 C[C@H](O)C[C@@H](N)[C@H](O)C(O)=O Amb25382155 [1,1,0,0,0,0|1,0,0]=3 772 B10R0.13 C[C@H](O)C[C@H](O)[C@@H](O)C(O)=O Amb25385175 [1,1,0,0,0,0|2,0,0]=4 773 B10R0.13 C[C@H](O)C[C@H](O)[C@H](O)C(O)=O Amb25385154 [1,1,0,0,0,0|2,0,0]=4 774 B10R0.31 CC(=O)CC(O)CC(C)(C)C Amb24766875 [1,1,0,0,0,0|2,0,0]=4 775 B10R0.31 CC(=O)CN(C)CC(C)(C)C Amb18183220 [1,1,0,0,0,0|2,0,0]=4 776 B10R0.31 CC(C)(C)CC(=C)CC(O)=O Amb18125997 [1,1,0,0,0,0|0,0,2]=4 777 B10R0.31 CC(C)(C)CC(N)CC(O)=O Amb18830328 [1,1,0,0,0,0|0,0,0]=2 778 B10R0.31 CC(C)(C)CC(O)CC(O)=O Amb18315668 [1,1,0,0,0,0|1,0,0]=3 779 B10R0.31 CC(C)CC(C)CS(=O)(=O)Cl Amb24750737 [1,1,0,0,0,0|1,0,1]=4 780 B10R0.31 CC(C)CC(C)CS(N)(=O)=O Amb24750738 [1,1,0,0,0,0|1,0,1]=4 781 B10R0.31 CC(C)CC(N)CP(O)(O)=O Amb24764762 [1,1,0,0,0,0|1,0,0]=3 782 B10R0.31 CC(C)CC(N)CS(C)(=O)=O Amb18312788 [1,1,0,0,0,0|1,0,1]=4 783 B10R0.31 CC(C)C[C@H](N)CS(O)(=O)=O Amb24764550 [1,1,0,0,0,0|1,0,0]=3 784 B10R0.31 CC(CB(O)O)CC(C)(C)C Amb24755472 [1,1,0,0,0,0|1,0,1]=4 785 B10R0.31 CC(CC(C)(C)C)=CC(O)=O Amb25774524 [1,1,0,0,0,0|0,0,2]=4 786 B10R0.31 CC(CC(C)(C)C)NC(C)=O Amb24536434 [1,1,0,0,0,0|2,0,0]=4 787 B10R0.31 CC(CC(C)(C)C)OC(N)=O Amb24764698 [1,1,0,0,0,0|2,0,0]=4 788 B10R0.31 CC(CC(C)(C)O)NC(C)=O Amb25263777 [1,1,0,0,0,0|2,0,0]=4 789 B10R0.31 CC(CC(C)(C)O)NC(N)=O Amb25231622 [1,1,0,0,0,0|2,0,0]=4 790 B10R0.31 CC(CC(C)=O)C[Si](C)(C)C Amb24765119 [1,1,0,0,0,0|1,1,0]=4 791 B10R0.31 CC(CC(C)O)CC(C)(C)C Amb25383207 [1,1,0,0,0,0|1,0,1]=4 792 B10R0.31 CC(CC(O)=O)CC(F)(F)F Amb18266754 [1,1,0,0,0,0|2,0,0]=4 793 B10R0.31 CC(NC(C)(C)C)CC(=O)N Amb17232263 [1,1,0,0,0,0|2,0,0]=4 794 B10R0.31 CC(NC(C)(C)C)CC(=O)O Amb17334468 [1,1,0,0,0,0|1,0,0]=3 795 B10R0.31 CN(CC(N)=O)CC(C)(C)C Amb18799982 [1,1,0,0,0,0|2,0,0]=4 796 B10R0.31 CN(CC(O)=O)CC(C)(C)C Amb18800132 [1,1,0,0,0,0|1,0,0]=3 797 B10R0.31 CN(CC(O)=O)CC(C)(C)O Amb18312497 [1,1,0,0,0,0|1,0,0]=3 798 B10R0.31 C[C@@H](CC(C)=O)SC(C)(C)C Amb24766614 [1,1,0,0,0,0|2,0,0]=4 799 B10R0.31 C[C@H](CC(C)=O)CC(C)(C)C Amb24766974 [1,1,0,0,0,0|1,0,0]=3 800 B10R0.31 C[C@H](CC(C)=O)SC(C)(C)C Amb24766613 [1,1,0,0,0,0|2,0,0]=4 801 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(O)=O Amb22745454 [1,1,0,0,0,0|2,0,0]=4 802 B10R0.31 C[N+](C)(C)C[C@H](Cl)CC(O)=O Amb25385793 [1,1,0,0,0,0|2,0,0]=4 803 B10R0.31 C[N+](C)(C)C[C@H](O)CC(O)=O Amb22388510 [1,1,0,0,0,0|2,0,0]=4 804 B10R0.31 N[C@@H](CC(O)=O)CC(F)(F)F Amb25383887 [1,1,0,0,0,0|2,0,0]=4 805 B10R0.31 N[C@@H](C[N+](C)(C)C)CC(=O)[O-] Amb17607942 [1,1,0,0,0,0|1,0,1]=4 806 B10R0.31 N[C@H](CC(C)(C)C)CC(=O)O Amb10603223 [1,1,0,0,0,0|0,0,0]=2 807 B10R0.31 N[C@H](CC(O)=O)CC(F)(F)F Amb25383987 [1,1,0,0,0,0|2,0,0]=4 808 B10R0.31 N[C@H](C[N+](C)(C)C)CC(=O)[O-] Amb17607943 [1,1,0,0,0,0|1,0,1]=4 809 B10R0.44 CC(C)CC(C)CC(=O)NC Amb24762511 [1,1,0,0,0,0|1,0,0]=3 810 B10R0.44 CC(C)CC(C)NC(=O)CBr Amb24754619 [1,1,0,0,0,0|2,0,0]=4 811 B10R0.44 CC(C)CC(C)NC(=O)CC Amb25383080 [1,1,0,0,0,0|2,0,0]=4 812 B10R0.44 CC(C)CC(C)NC(N)=NO Amb18800179 [1,1,0,0,0,0|2,0,0]=4 813 B10R0.44 CC(C)CC(C)\C=C(\C)/C=O Amb25383620 [1,1,0,0,0,0|1,0,1]=4 814 B10R0.44 CC(C)CC(C)\C=C(\C)/CO Amb24750720 [1,1,0,0,0,0|1,0,1]=4 815 B10R0.44 CC(C)C[C@@H](C)\C=C(/C)\C=O Amb24766692 [1,1,0,0,0,0|1,0,1]=4 816 B10R0.44 CC(C)SC(C)CC(=O)NN Amb24755577 [1,1,0,0,0,0|2,0,0]=4 817 B10R0.44 CC(C)SC(C)CC(N)=NO Amb18795862 [1,1,0,0,0,0|2,0,0]=4 818 B10R0.44 CC(CC(C)S)NC(=O)OC Amb24765258 [1,1,0,0,0,0|2,0,0]=4 819 B10R0.44 CC(CN(C)CC(O)=O)C#N Amb18791725 [1,1,0,0,0,0|1,0,1]=4 820 B10R0.44 CC(NC(CC)C)CC(=O)N Amb17232261 [1,1,0,0,0,0|2,0,0]=4 821 B10R0.44 CNC(=O)CC(C)CC(O)=O Amb19035066 [1,1,0,0,0,0|1,0,1]=4 822 B10R0.44 CNC(=O)CN(C)CC(C)C Amb24751068 [1,1,0,0,0,0|2,0,0]=4 823 B10R0.44 COC(=O)CC(=O)CC(C)C Amb15693129 [1,1,0,0,0,0|1,0,1]=4 824 B10R0.44 COC(=O)CN(N)CC(C)C Amb24095832 [1,1,0,0,0,0|1,0,0]=3 825 B10R0.44 COC(=O)\C=C(\N)/CC(C)C Amb25385193 [1,1,0,0,0,0|0,0,2]=4 826 B10R0.44 C[C@H](C#N)O[C@H](C)CC(O)=O Amb25386223 [1,1,0,0,0,0|1,0,1]=4 827 B10R0.165 CC(=C)CC(C)(C)CC(O)=O Amb18644852 [1,1,0,0,0,0|0,0,2]=4 828 B10R0.165 CC(C)(CC(Cl)Cl)CC(O)=O Amb25386212 [1,1,0,0,0,0|2,0,0]=4 829 B10R0.165 CC(C)NC(C)(C)CC(O)=O Amb24761793 [1,1,0,0,0,0|1,0,0]=3 830 B10R0.165 CN(C)CC(C)(C)CC(O)=O Amb24116873 [1,1,0,0,0,0|1,0,0]=3 831 B10R0.53 CC(C)C(CC(=O)NN)CC Amb24762604 [0,1,0,0,1,0|2,0,0]=4 832 B10R0.53 CC(C)C(CN)NC(=O)C#C Amb18908462 [0,1,0,0,1,0|2,0,0]=4 833 B10R0.53 CC(C)C(CN)NC(=O)NC Amb18908577 [0,1,0,0,1,0|2,0,0]=4 834 B10R0.53 CC(C)[C@H](CO)NC(=O)OC Amb25384481 [0,1,0,0,1,0|2,0,0]=4 835 B10R0.53 CNC(=O)CC(CN)N(C)C Amb25381614 [0,1,0,0,1,0|2,0,0]=4 836 B10R0.76 CC(C)C(C=C)C(F)C(O)=O Amb25385693 [0,1,0,0,1,0|1,0,1]=4 837 B10R0.76 CC(C)C(C=C)C(O)C(O)=O Amb18645034 [0,1,0,0,1,0|1,0,1]=4 838 B10R0.76 CC(C)C(C=C)[C@H](O)C(O)=O Amb25384932 [0,1,0,0,1,0|1,0,1]=4 839 B10R0.76 CC(C)C(CC)C(C)C(O)=O Amb24761781 [0,1,0,0,1,0|1,0,0]=3 840 B10R0.76 CC(C)C(CC)C(F)C(O)=O Amb24761995 [0,1,0,0,1,0|1,0,0]=3 841 B10R0.76 CC(C)C(CC)C(N)C(N)=O Amb25385538 [0,1,0,0,1,0|2,0,0]=4 842 B10R0.76 CC(C)C(O)C(C=C)C(O)=O Amb18126132 [0,1,0,0,1,0|1,0,1]=4 843 B10R0.76 CC(C)C(O)C(CC)C(C)=O Amb25383609 [0,1,0,0,1,0|2,0,0]=4 844 B10R0.76 CC(C)C(O)C(CC)C(O)=O Amb18315393 [0,1,0,0,1,0|1,0,0]=3 845 B10R0.76 CC(C)C(O)C(OC)C(O)=O Amb25385837 [0,1,0,0,1,0|2,0,0]=4 846 B10R0.76 CC(C)N(C)C(CN)C(O)=O Amb25381580 [0,1,0,0,1,0|1,0,0]=3 847 B10R0.76 CC(C)S(=O)C(CC)C(O)=O Amb19012106 [0,1,0,0,1,0|2,0,0]=4 848 B10R0.76 CC(C)[C@@H](O)[C@H](CC)C(O)=O Amb25384968 [0,1,0,0,1,0|1,0,0]=3 849 B10R0.76 CC(C)[C@@H](O)[C@H](NC)C(O)=O Amb25384943 [0,1,0,0,1,0|2,0,0]=4 850 B10R0.76 CC(C)[C@@H](OC)[C@@H](N)C(O)=O Amb25384926 [0,1,0,0,1,0|2,0,0]=4 851 B10R0.76 CC(C)[C@@H](OC)[C@H](N)C(O)=O Amb25384925 [0,1,0,0,1,0|2,0,0]=4 852 B10R0.76 CC(C)[C@H](C)[C@@H](NC)C(O)=O Amb25385168 [0,1,0,0,1,0|2,0,0]=4 853 B10R0.76 CC(C)[C@H](C)[C@H](NC)C(O)=O Amb25384858 [0,1,0,0,1,0|2,0,0]=4 854 B10R0.76 CC(C)[C@H](O)[C@@H](C=C)C(O)=O Amb25385236 [0,1,0,0,1,0|1,0,1]=4 855 B10R0.76 CC(C)[C@H](O)[C@H](CC)C(O)=O Amb25384933 [0,1,0,0,1,0|1,0,0]=3 856 B10R0.95 CC(C)(C)CC(CN)C(O)=O Amb18830322 [0,1,0,0,1,0|0,0,0]=2 857 B10R0.95 CC(C)(C)NC(CF)C(O)=O Amb25386221 [0,1,0,0,1,0|2,0,0]=4 858 B10R0.95 CC(C)(C)NC(CN)C(O)=O Amb24754569 [0,1,0,0,1,0|1,0,0]=3 859 B10R0.95 CC(C)C(CN)OS(O)(=O)=O Amb25382133 [0,1,0,0,1,0|2,0,0]=4 860 B10R0.95 CCC(C[Si](C)(C)C)C(O)=O Amb24755728 [0,1,0,0,1,0|1,1,0]=4 861 B10R0.95 CCC(NC(C)(C)C)C(O)=O Amb25381606 [0,1,0,0,1,0|2,0,0]=4 862 B10R0.95 CNC(CC(C)(C)C)C(O)=O Amb18315672 [0,1,0,0,1,0|2,0,0]=4 863 B10R0.95 COC(CC(C)(C)C)C(O)=O Amb24750716 [0,1,0,0,1,0|2,0,0]=4 864 B10R0.95 CP(O)(=O)CC(CN)C(O)=O Amb25386302 [0,1,0,0,1,0|2,0,0]=4 865 B10R0.95 NCC(CC(F)(F)F)C(O)=O Amb18198728 [0,1,0,0,1,0|2,0,0]=4 866 B10R0.119 CC(C)C(C)(CC(N)=O)CN Amb25385539 [0,1,0,0,1,0|1,0,0]=3 867 B10R0.119 CC(C)CC(C)(C=C)C(O)=O Amb25386180 [0,1,0,0,1,0|1,0,1]=4 868 B10R0.119 CC(C)CC(C)(CN)C(C)O Amb25381965 [0,1,0,0,1,0|1,0,1]=4 869 B10R0.119 CC(C)CC(C)(CN)C(O)=O Amb24755658 [0,1,0,0,1,0|0,0,0]=2 870 B10R0.119 CC(C)CC(N)(C=C)C(O)=O Amb25385245 [0,1,0,0,1,0|1,0,1]=4 871 B10R0.119 CC(C)C[C@@](N)(CN)C(O)=O Amb24763012 [0,1,0,0,1,0|0,0,0]=2 872 B10R0.119 CC(CN)(CC(F)F)C(O)=O Amb24755662 [0,1,0,0,1,0|2,0,0]=4 873 B10R0.119 CCC(C)(CC(C)C)C(O)=O Amb18182375 [0,1,0,0,1,0|1,0,0]=3 874 B10R0.119 CCC(C)(CC(O)=O)C(C)C Amb25381502 [0,1,0,0,1,0|1,0,0]=3 875 B10R0.119 CCC(C)(CC(O)=O)N(C)C Amb24750754 [0,1,0,0,1,0|2,0,0]=4 876 B10R0.119 CCC(C)(CN(C)C)C(O)=O Amb18800148 [0,1,0,0,1,0|2,0,0]=4 877 B10R0.119 CCC(C)(OC(C)C)C(O)=O Amb19014844 [0,1,0,0,1,0|2,0,0]=4 878 B10R0.119 CCC(N)(CC(C)C)C(O)=O Amb25380031 [0,1,0,0,1,0|1,0,0]=3 879 B10R0.119 CCC(O)(CC(O)=O)C(C)C Amb25384967 [0,1,0,0,1,0|1,0,0]=3 880 B10R0.119 CCC(S)(CC(C)C)C(N)=O Amb24764516 [0,1,0,0,1,0|2,0,0]=4 881 B10R0.119 CCC(S)(CC(C)C)C(O)=O Amb18127667 [0,1,0,0,1,0|1,0,0]=3 882 B10R0.119 CC[C@](N)(CC(C)C)C(O)=O Amb25383856 [0,1,0,0,1,0|1,0,0]=3 883 B10R0.119 COC(C)(CC(C)C)C(O)=O Amb19014799 [0,1,0,0,1,0|2,0,0]=4 884 B10R0.138 CC(=O)NC(CN)C(C)(C)C Amb18908556 [0,1,0,0,1,0|2,0,0]=4 885 B10R0.138 CC(=O)OC(CN)C(C)(C)C Amb25383455 [0,1,0,0,1,0|2,0,0]=4 886 B10R0.138 CC(C)(C)C(CC(O)=O)C=C Amb18126009 [0,1,0,0,1,0|1,0,1]=4 887 B10R0.138 CC(C)(C)C(CN)CC(O)=O Amb22546301 [0,1,0,0,1,0|0,0,0]=2 888 B10R0.138 CC(C)(C)C(CN)NC(N)=O Amb18908578 [0,1,0,0,1,0|2,0,0]=4 889 B10R0.138 CC(C)CC(CN)S(C)(=O)=O Amb18824608 [0,1,0,0,1,0|1,0,1]=4 890 B10R0.138 NCC(CC(O)=O)C(F)(F)F Amb23454902 [0,1,0,0,1,0|2,0,0]=4 891 B10R0.162 CC(C)C(CC(=O)Cl)C(C)C Amb25383787 [0,1,0,0,1,0|2,0,0]=4 892 B10R0.162 CC(C)C(CC(C)C)C(C)=O Amb18787660 [0,1,0,0,1,0|2,0,0]=4 893 B10R0.162 CC(C)C(CC(C)C)C(O)=O Amb19009627 [0,1,0,0,1,0|1,0,0]=3 894 B10R0.162 CC(C)C(CC(O)=O)C(N)=O Amb25383446 [0,1,0,0,1,0|0,0,1]=3 895 B10R0.162 CC(C)C(CC(O)=O)C(O)=O Amb18645268 [0,1,0,0,1,0|1,0,1]=4 896 B10R0.162 CC(C)C(CC(O)=O)N(C)C Amb24750750 [0,1,0,0,1,0|2,0,0]=4 897 B10R0.162 CC(C)C(CN(C)C)C(O)=O Amb24761795 [0,1,0,0,1,0|2,0,0]=4 898 B10R0.162 CC(C)C(NC(C)=O)C(C)N Amb25150434 [0,1,0,0,1,0|2,0,0]=4 899 B10R0.162 CC(C)C(OC(C)C)C(O)=O Amb18182509 [0,1,0,0,1,0|2,0,0]=4 900 B10R0.162 CC(C)C(SC(C)C)C(O)=O Amb18303983 [0,1,0,0,1,0|2,0,0]=4 901 B10R0.162 CC(C)CC(C(C)O)C(C)=O Amb24765302 [0,1,0,0,1,0|2,0,0]=4 902 B10R0.162 CC(C)CC(C(N)=O)C(O)=O Amb25386201 [0,1,0,0,1,0|0,0,1]=3 903 B10R0.162 CC(C)C[C@H](C(O)=O)N(C)C Amb25385015 [0,1,0,0,1,0|2,0,0]=4 904 B10R0.162 CC(C)N(CC(O)=O)C(C)C Amb17871497 [0,1,0,0,1,0|2,0,0]=4 905 B10R0.162 CC(C)N(CC(O)=O)C(N)=O Amb18288826 [0,1,0,0,1,0|1,0,1]=4 906 B10R0.162 CC(CC(C(=O)O)C(=O)O)C Amb17593992 [0,1,0,0,1,0|1,0,1]=4 907 B10R0.162 CC(NC(C(=O)O)C(C)C)C Amb10199872 [0,1,0,0,1,0|2,0,0]=4 908 B10R0.162 CC(NC(C(=O)O)C(C)C)C Amb1110617 [0,1,0,0,1,0|2,0,0]=4 909 B12R0.52 CC(C)CN(CC#C)CCC(O)=O Amb18616784 [0,1,0,0,0,1|2,0,0]=4 910 B12R0.52 CC(C)CN(CC=C)CCC(O)=O Amb18616059 [0,1,0,0,0,1|2,0,0]=4 911 B12R0.52 CCCN(CC(C)C)CCC(O)=O Amb18616033 [0,1,0,0,0,1|2,0,0]=4 912 B12R0.138 CC(=O)C(CC(O)=O)NCC(C)C Amb18611356 [0,1,0,0,0,1|1,0,1]=4 913 B12R0.138 CC(C)CC(CCC(O)=O)C(O)=O Amb20668896 [0,1,0,0,0,1|1,0,1]=4 914 B12R0.41 CC(C)C[C@@H](CC(N)=O)CC(O)=O Amb22748139 [0,2,0,0,0,0|0,0,0]=2 915 B12R0.41 CC(C)C[C@H](CC(O)=O)CC(N)=O Amb22388610 [0,2,0,0,0,0|0,0,0]=2 916 B12R0.41 CC(CC(CC(=O)O)CC(=O)O)C Amb16232082 [0,2,0,0,0,0|1,0,0]=3 917 B12R0.18 CC(C)CC(CN)NC(=O)CSC Amb24768847 [0,2,0,0,0,0|1,1,0]=4 918 B10R1.8 CC1CC(=O)CC(CC)O1 Amb24736207 [1,0,0,1,0,0|2,0,0]=4 919 B10R1.8 CC1CC(=O)CC(CO)N1 Amb24634049 [1,0,0,1,0,0|2,0,0]=4 920 B10R1.8 CC1CC(CC(=O)C1)C#N Amb25053278 [1,0,0,1,0,0|0,0,2]=4 921 B10R1.8 CC1CC(CC(=O)N1)CN Amb24603209 [1,0,0,1,0,0|1,0,0]=3 922 B10R1.8 CC1CC(CN)CC(C)C1 Amb25274571 [1,0,0,1,0,0|1,0,1]=4 923 B10R1.8 CC1CC(CN)CN(C)C1 Amb25235008 [1,0,0,1,0,0|2,0,0]=4 924 B10R1.8 CC1CC(CO)NC(=O)O1 Amb25349393 [1,0,0,1,0,0|2,0,0]=4 925 B10R1.8 CCC1CC(O)CC(=O)C1 Amb25318990 [1,0,0,1,0,0|2,0,0]=4 926 B10R1.8 CCN1CC(C)CC(=O)C1 Amb2370002 [1,0,0,1,0,0|2,0,0]=4 927 B10R1.8 CCN1C[C@H](C)OC(=O)C1 Amb25350741 [1,0,0,1,0,0|2,0,0]=4 928 B10R1.8 CN1CC(CN)CC(=O)N1 Amb25195473 [1,0,0,1,0,0|2,0,0]=4 929 B10R1.8 C[C@H]1C[C@@H](CC(=O)C1)C#N Amb24512460 [1,0,0,1,0,0|0,0,2]=4 930 B10R1.8 C[C@H]1C[C@H](CO)OC(=O)C1 Amb25344012 [1,0,0,1,0,0|2,0,0]=4 931 B10R1.10 CC1CC(CCC1)CC=C Amb24553146 [1,0,0,1,0,0|2,0,0]=4 932 B10R1.10 CC1CC(CCC1)CC=O Amb25783447 [1,0,0,1,0,0|1,0,0]=3 933 B10R1.10 CC1CC(CCC1)CCO Amb20667855 [1,0,0,1,0,0|1,0,1]=4 934 B10R1.10 CC1CC(CCC1)CNO Amb24414500 [1,0,0,1,0,0|2,0,0]=4 935 B10R1.10 CC1CCCC(CC=O)O1 Amb18643934 [1,0,0,1,0,0|2,0,0]=4 936 B10R1.10 CC1CNCC(C1)CCC Amb24360161 [1,0,0,1,0,0|1,0,1]=4 937 B10R1.10 CCCC1CC(=O)CCC1 Amb22754799 [1,0,0,1,0,0|2,0,0]=4 938 B10R1.10 CCCC1CC=CC(=O)C1 Amb25723335 [1,0,0,1,0,0|2,0,0]=4 939 B10R1.10 CCC[C@H]1CC(=O)CCC1 Amb25145507 [1,0,0,1,0,0|2,0,0]=4 940 B10R1.10 CN1CC(CC=O)CCC1 Amb25339919 [1,0,0,1,0,0|2,0,0]=4 941 B10R1.10 C[C@@H]1C[C@@H](CC=C1)CC=O Amb25205458 [1,0,0,1,0,0|1,0,1]=4 942 B10R1.10 C[C@H]1CC(CCC1)CCO Amb24362849 [1,0,0,1,0,0|1,0,1]=4 943 B10R1.10 C[C@H]1C[C@H](CCC1)NC=O Amb25265164 [1,0,0,1,0,0|2,0,0]=4 944 B10R1.10 OC1CC(CCC1)CC=O Amb25208989 [1,0,0,1,0,0|2,0,0]=4 945 B10R1.18 CC(=O)CC1CNCCO1 Amb18644007 [1,0,0,1,0,0|2,0,0]=4 946 B10R1.18 CC(=O)NC1CCCNC1 Amb1095007 [1,0,0,1,0,0|2,0,0]=4 947 B10R1.18 CC(=O)N[C@@H]1CNCCC1 Amb19892549 [1,0,0,1,0,0|2,0,0]=4 948 B10R1.18 CC(=O)N[C@@H]1CNCCC1 Amb22226767 [1,0,0,1,0,0|2,0,0]=4 949 B10R1.18 CC(=O)N[C@H]1CNCCC1 Amb19892123 [1,0,0,1,0,0|2,0,0]=4 950 B10R1.18 CC(=O)N[C@H]1CNCCC1 Amb22225406 [1,0,0,1,0,0|2,0,0]=4 951 B10R1.18 CC(=O)OC1CNCCC1 Amb21956163 [1,0,0,1,0,0|2,0,0]=4 952 B10R1.18 CC(=O)OC1CNCCC1 Amb22011794 [1,0,0,1,0,0|2,0,0]=4 953 B10R1.18 CC(C)CC1CNCCC1 Amb18285001 [1,0,0,1,0,0|1,0,1]=4 954 B10R1.18 CC(C)CC1CNCCC1 Amb20630891 [1,0,0,1,0,0|1,0,1]=4 955 B10R1.18 CS(=O)CC1CNCCC1 Amb25771646 [1,0,0,1,0,0|2,0,0]=4 956 B10R1.18 NC(=O)CC1CCCCC1 Amb22491829 [1,0,0,1,0,0|2,0,0]=4 957 B10R1.18 NC(=O)CC1CNCCC1 Amb18962911 [1,0,0,1,0,0|1,0,0]=3 958 B10R1.18 NC(=O)CC1CNCCC1 Amb20623575 [1,0,0,1,0,0|1,0,0]=3 959 B10R1.18 NC(=O)CC1CNCCN1 Amb24120380 [1,0,0,1,0,0|2,0,0]=4 960 B10R1.18 NC(=O)CC1CNCCO1 Amb24581822 [1,0,0,1,0,0|2,0,0]=4 961 B10R1.18 NC(=O)CC1CNCCS1 Amb24651317 [1,0,0,1,0,0|2,0,0]=4 962 B10R1.18 NC(=O)NC1CCCNC1 Amb10610114 [1,0,0,1,0,0|2,0,0]=4 963 B10R1.18 NC(=O)N[C@H]1CNCCC1 Amb24367724 [1,0,0,1,0,0|2,0,0]=4 964 B10R1.18 NC(=O)OC1CNCCC1 Amb23598270 [1,0,0,1,0,0|2,0,0]=4 965 B10R1.18 OC(=O)CC1CC=CCC1 Amb18643595 [1,0,0,1,0,0|1,0,1]=4 966 B10R1.18 OC(=O)CC1CCCC=C1 Amb18124573 [1,0,0,1,0,0|1,0,1]=4 967 B10R1.18 OC(=O)CC1CCCCN1 Amb10576328 [1,0,0,1,0,0|2,0,0]=4 968 B10R1.18 OC(=O)CC1CCCCN1 Amb1083025 [1,0,0,1,0,0|2,0,0]=4 969 B10R1.18 OC(=O)CC1CCCCN1 Amb22587703 [1,0,0,1,0,0|2,0,0]=4 970 B10R1.18 OC(=O)CC1CCCCO1 Amb1091980 [1,0,0,1,0,0|2,0,0]=4 971 B10R1.18 OC(=O)CC1CCCNC1 Amb13952813 [1,0,0,1,0,0|0,0,0]=2 972 B10R1.18 OC(=O)CC1CCSCC1 Amb18283322 [1,0,0,1,0,0|2,0,0]=4 973 B10R1.18 OC(=O)CC1CNCCO1 Amb21959647 [1,0,0,1,0,0|1,0,0]=3 974 B10R1.18 OC(=O)CC1COCCN1 Amb21964558 [1,0,0,1,0,0|2,0,0]=4 975 B10R1.18 OC(=O)CC1COCCO1 Amb17507064 [1,0,0,1,0,0|2,0,0]=4 976 B10R1.18 OC(=O)CC1CSCCC1 Amb18199274 [1,0,0,1,0,0|1,0,0]=3 977 B10R1.18 OC(=O)CC1CSCCN1 Amb18199026 [1,0,0,1,0,0|2,0,0]=4 978 B10R1.18 OC(=O)CN1CCCCC1 Amb1098973 [1,0,0,1,0,0|2,0,0]=4 979 B10R1.18 OC(=O)CN1CCCCC1 Amb2236243 [1,0,0,1,0,0|2,0,0]=4 980 B10R1.18 OC(=O)C[C@@H]1CCCC=C1 Amb24427722 [1,0,0,1,0,0|1,0,1]=4 981 B10R1.18 OC(=O)C[C@@H]1CCCCN1 Amb13885774 [1,0,0,1,0,0|2,0,0]=4 982 B10R1.18 OC(=O)C[C@@H]1CCCCO1 Amb24361310 [1,0,0,1,0,0|2,0,0]=4 983 B10R1.18 OC(=O)C[C@@H]1CNCCC1 Amb23401360 [1,0,0,1,0,0|0,0,0]=2 984 B10R1.18 OC(=O)C[C@@H]1CNCCO1 Amb22745230 [1,0,0,1,0,0|1,0,0]=3 985 B10R1.18 OC(=O)C[C@@H]1CNCCO1 Amb22747184 [1,0,0,1,0,0|1,0,0]=3 986 B10R1.18 OC(=O)C[C@@H]1COCCN1 Amb22745748 [1,0,0,1,0,0|2,0,0]=4 987 B10R1.18 OC(=O)C[C@@H]1COCCO1 Amb24674182 [1,0,0,1,0,0|2,0,0]=4 988 B10R1.18 OC(=O)C[C@H]1CCCC=C1 Amb25789979 [1,0,0,1,0,0|1,0,1]=4 989 B10R1.18 OC(=O)C[C@H]1CCCCN1 Amb13885779 [1,0,0,1,0,0|2,0,0]=4 990 B10R1.18 OC(=O)C[NH+]1CCCCC1 Amb19914127 [1,0,0,1,0,0|2,0,0]=4 991 B10R1.18 OC(=O)NC1CCCCC1 Amb22039352 [1,0,0,1,0,0|2,0,0]=4 992 B10R1.18 [O-][N+](=O)CC1CNCCC1 Amb18831503 [1,0,0,1,0,0|1,0,1]=4 993 B10R1.32 CCC1CC(=O)CC1CO Amb25343609 [1,0,0,1,0,0|2,0,0]=4 994 B10R1.32 CCC1NC(=O)CC1CN Amb24622543 [1,0,0,1,0,0|1,0,0]=3 995 B10R1.32 CCC1NC(=O)CC1CO Amb25365286 [1,0,0,1,0,0|2,0,0]=4 996 B10R1.32 CC[C@@H]1CC(=O)C[C@@H]1CO Amb25316218 [1,0,0,1,0,0|2,0,0]=4 997 B10R1.32 CC[C@H]1CC(=O)C[C@@H]1CC Amb24575980 [1,0,0,1,0,0|2,0,0]=4 998 B10R1.32 CC[C@H]1NC(=O)C[C@@H]1CN Amb24512948 [1,0,0,1,0,0|1,0,0]=3 999 B10R1.32 CC[C@H]1NC(=O)O[C@H]1CC Amb24725616 [1,0,0,1,0,0|2,0,0]=4 1000 B10R1.32 NN[C@@H]1CC(=O)O[C@H]1CO Amb24654865 [1,0,0,1,0,0|2,0,0]=4 1001 B10R1.36 CC1(C)CC(CC1=O)C#N Amb25094447 [1,0,0,1,0,0|0,0,2]=4 1002 B10R1.36 CC1(C)CC(CO)NC1=O Amb25721601 [1,0,0,1,0,0|2,0,0]=4 1003 B10R1.36 CC1(C)C[C@@H](CF)NC1=O Amb24480701 [1,0,0,1,0,0|2,0,0]=4 1004 B10R1.36 CC1(C)C[C@@H](CO)NC1=O Amb23399709 [1,0,0,1,0,0|2,0,0]=4 1005 B10R1.36 CCC1CC(=O)C(C)(C)C1 Amb25145531 [1,0,0,1,0,0|1,0,0]=3 1006 B10R1.36 CC[C@H]1CC(=O)C(C)(C)C1 Amb25146662 [1,0,0,1,0,0|1,0,0]=3 1007 B10R1.36 CN1CC(CN)CC1(C)C Amb24514569 [1,0,0,1,0,0|2,0,0]=4 1008 B10R1.39 C=CC1CCCC1C(O)=O Amb18643536 [1,0,0,1,0,0|1,0,1]=4 1009 B10R1.39 C=C[C@@H]1CCC[C@@H]1C(O)=O Amb25174791 [1,0,0,1,0,0|1,0,1]=4 1010 B10R1.39 CC(=O)C1CCCC1CN Amb25169358 [1,0,0,1,0,0|1,0,0]=3 1011 B10R1.39 CC(=O)N1CCCC1CN Amb18251238 [1,0,0,1,0,0|2,0,0]=4 1012 B10R1.39 CC(=O)N1CCCC1CN Amb20622612 [1,0,0,1,0,0|2,0,0]=4 1013 B10R1.39 CC(=O)N1CCC[C@@H]1CN Amb18016514 [1,0,0,1,0,0|2,0,0]=4 1014 B10R1.39 CC(=O)[C@H]1CCC[C@@H]1CCl Amb25251542 [1,0,0,1,0,0|2,0,0]=4 1015 B10R1.39 CC(C)C1OCCC1CN Amb20623876 [1,0,0,1,0,0|0,0,1]=3 1016 B10R1.39 CC(C)C1OCCC1CO Amb24538099 [1,0,0,1,0,0|1,0,1]=4 1017 B10R1.39 CC(C)[C@H]1OCC[C@@H]1CN Amb25345075 [1,0,0,1,0,0|0,0,1]=3 1018 B10R1.39 CC(C)[C@H]1OCC[C@@H]1CO Amb24543185 [1,0,0,1,0,0|1,0,1]=4 1019 B10R1.39 CCC1CCCC1C(C)=O Amb24744201 [1,0,0,1,0,0|2,0,0]=4 1020 B10R1.39 CCC1CCCC1C(N)=O Amb25113439 [1,0,0,1,0,0|2,0,0]=4 1021 B10R1.39 CCC1CCCC1C(O)=O Amb18643940 [1,0,0,1,0,0|1,0,0]=3 1022 B10R1.39 CCC1CCNC1C(O)=O Amb18644001 [1,0,0,1,0,0|2,0,0]=4 1023 B10R1.39 CCC1CNCC1C(O)=O Amb18831583 [1,0,0,1,0,0|2,0,0]=4 1024 B10R1.39 CCC1NCCC1C(O)=O Amb18118150 [1,0,0,1,0,0|2,0,0]=4 1025 B10R1.39 CCN1CCC[C@@H]1C(O)=O Amb22587552 [1,0,0,1,0,0|2,0,0]=4 1026 B10R1.39 CCN1CCC[C@@H]1C(O)=O Amb23385271 [1,0,0,1,0,0|2,0,0]=4 1027 B10R1.39 CCN1CCC[C@H]1C(O)=O Amb19516987 [1,0,0,1,0,0|2,0,0]=4 1028 B10R1.39 CCN1CCC[C@H]1C(O)=O Amb25751957 [1,0,0,1,0,0|2,0,0]=4 1029 B10R1.39 CC[C@@H]1CCC[C@@H]1C(N)=O Amb24714537 [1,0,0,1,0,0|2,0,0]=4 1030 B10R1.39 CC[C@@H]1CCC[C@@H]1C(O)=O Amb25328907 [1,0,0,1,0,0|1,0,0]=3 1031 B10R1.39 CC[C@@H]1CCC[C@H]1C(C)=O Amb25264397 [1,0,0,1,0,0|2,0,0]=4 1032 B10R1.39 CC[C@@H]1NCC[C@H]1C(O)=O Amb18202480 [1,0,0,1,0,0|2,0,0]=4 1033 B10R1.39 CC[C@H]1OCC[C@H]1C(O)=O Amb24622843 [1,0,0,1,0,0|2,0,0]=4 1034 B10R1.39 CN[C@H]1CCC[C@H]1C(O)=O Amb24626122 [1,0,0,1,0,0|2,0,0]=4 1035 B10R1.39 COC1CCCC1C(O)=O Amb18967397 [1,0,0,1,0,0|2,0,0]=4 1036 B10R1.39 CSC1CCCC1C(O)=O Amb18288540 [1,0,0,1,0,0|2,0,0]=4 1037 B10R1.39 N#CC1CCCC1C(O)=O Amb18832125 [1,0,0,1,0,0|0,0,2]=4 1038 B10R1.39 NCC1CCCC1C(O)=O Amb25283657 [1,0,0,1,0,0|0,0,0]=2 1039 B10R1.39 NCC1CCCN1C(N)=O Amb18251258 [1,0,0,1,0,0|2,0,0]=4 1040 B10R1.39 NCN1CCC[C@H]1C(O)=O Amb24551895 [1,0,0,1,0,0|1,0,0]=3 1041 B10R1.39 NC[C@@H]1CCCN1C(=O)C Amb17046511 [1,0,0,1,0,0|2,0,0]=4 1042 B10R1.39 OC(=O)C1CCCC1C=O Amb24480689 [1,0,0,1,0,0|1,0,1]=4 1043 B10R1.39 OC(=O)C1CCCC1CBr Amb18130990 [1,0,0,1,0,0|1,0,0]=3 1044 B10R1.39 OC(=O)C1CCCC1CF Amb20668095 [1,0,0,1,0,0|1,0,0]=3 1045 B10R1.39 OC(=O)[C@H]1CCS[C@@H]1CS Amb24511971 [1,0,0,1,0,0|2,0,0]=4 1046 B10R1.39 OCC1CCCC1C(O)=O Amb25731866 [1,0,0,1,0,0|1,0,0]=3 1047 B10R1.39 OCN1CCCC1C(O)=O Amb25292211 [1,0,0,1,0,0|2,0,0]=4 1048 B10R1.39 OC[C@@H]1NCC[C@H]1C(O)=O Amb18202111 [1,0,0,1,0,0|2,0,0]=4 1049 B10R1.39 OC[C@H]1CCC[C@H]1C(O)=O Amb25174802 [1,0,0,1,0,0|1,0,0]=3 1050 B10R1.39 OC[C@H]1NCC[C@@H]1C(O)=O Amb24700165 [1,0,0,1,0,0|2,0,0]=4 1051 B10R1.48 CCC1C(C1CC)C(O)=O Amb25825901 [1,0,0,1,0,0|1,0,0]=3 1052 B10R1.48 CC[C@H]1C(C=C)[C@@H]1C(O)=O Amb24623782 [1,0,0,1,0,0|1,0,1]=4 1053 B10R1.48 CC[C@H]1C([C@@H]1CC)C(O)=O Amb24585719 [1,0,0,1,0,0|1,0,0]=3 1054 B10R1.48 OC(=O)C1C(CO)C1CO Amb24586614 [1,0,0,1,0,0|2,0,0]=4 1055 B10R1.54 CC(C)CC1CC(=O)CC1 Amb25056572 [1,0,0,1,0,0|1,0,0]=3 1056 B10R1.54 CC(C)CC1CCC(=O)N1 Amb17940087 [1,0,0,1,0,0|2,0,0]=4 1057 B10R1.54 CC(C)CC1CCC(O)C1 Amb25201401 [1,0,0,1,0,0|1,0,1]=4 1058 B10R1.54 CC(C)CC1CNC(=O)S1 Amb24478197 [1,0,0,1,0,0|1,0,0]=3 1059 B10R1.54 CC(C)CC1CNC(=S)S1 Amb24696174 [1,0,0,1,0,0|1,1,0]=4 1060 B10R1.54 CC(C)CC1CNC(S)=N1 Amb25345850 [1,0,0,1,0,0|1,1,0]=4 1061 B10R1.54 CC(C)CC1COC(=O)N1 Amb25833011 [1,0,0,1,0,0|2,0,0]=4 1062 B10R1.54 CC(C)C[C@@H]1CC(=O)NC1 Amb25117203 [1,0,0,1,0,0|0,0,0]=2 1063 B10R1.54 CC(C)C[C@@H]1COC(=O)N1 Amb22746691 [1,0,0,1,0,0|2,0,0]=4 1064 B10R1.54 CC(C)C[C@H]1CNC(=O)S1 Amb24394481 [1,0,0,1,0,0|1,0,0]=3 1065 B10R1.54 CC(C)C[C@H]1COC(=O)N1 Amb22226712 [1,0,0,1,0,0|2,0,0]=4 1066 B10R1.54 CC(C)NC1CC(=O)CC1 Amb25689028 [1,0,0,1,0,0|2,0,0]=4 1067 B10R1.54 CC(C)NC1CNC(=O)C1 Amb25210724 [1,0,0,1,0,0|1,0,0]=3 1068 B10R1.54 CC(CC1CNC(=O)C1)C Amb10608006 [1,0,0,1,0,0|0,0,0]=2 1069 B10R1.54 CC(CC1CNC(=O)N1)C Amb17506856 [1,0,0,1,0,0|1,0,0]=3 1070 B10R1.54 CC(N)CC1CC(=O)NC1 Amb24666873 [1,0,0,1,0,0|1,0,0]=3 1071 B10R1.54 CC1CC(CC(O)=O)C=C1 Amb18124581 [1,0,0,1,0,0|1,0,1]=4 1072 B10R1.54 CC1CC(CC(O)=O)SS1 Amb24438701 [1,0,0,1,0,0|2,0,0]=4 1073 B10R1.54 CC1CC(CC1)CC(O)=O Amb18643912 [1,0,0,1,0,0|1,0,0]=3 1074 B10R1.54 CC1CC(CN1)CC(C)O Amb24761424 [1,0,0,1,0,0|1,0,1]=4 1075 B10R1.54 CC1CC(CN1)NC(C)=O Amb25821524 [1,0,0,1,0,0|2,0,0]=4 1076 B10R1.54 CC1CCC(CC(O)=O)O1 Amb24715878 [1,0,0,1,0,0|2,0,0]=4 1077 B10R1.54 CC1CN(CC(O)=O)CC1 Amb18281107 [1,0,0,1,0,0|2,0,0]=4 1078 B10R1.54 CN(C)C[C@@H]1CNC(=O)O1 Amb25087128 [1,0,0,1,0,0|2,0,0]=4 1079 B10R1.54 CN(C)C[C@H]1CNC(=O)O1 Amb25311042 [1,0,0,1,0,0|2,0,0]=4 1080 B10R1.54 CN1CC(CC(O)=O)CC1 Amb21857556 [1,0,0,1,0,0|2,0,0]=4 1081 B10R1.54 C[C@@H]1C[C@@H](CC(O)=O)C=C1 Amb25368399 [1,0,0,1,0,0|1,0,1]=4 1082 B10R1.54 N[C@@H]1CC[C@@H](C1)CC(=O)O Amb10066892 [1,0,0,1,0,0|2,0,0]=4 1083 B10R1.54 N[C@@H]1CC[C@H](C1)CC(=O)O Amb10066890 [1,0,0,1,0,0|2,0,0]=4 1084 B10R1.54 N[C@H]1CC[C@@H](C1)CC(=O)O Amb10066891 [1,0,0,1,0,0|2,0,0]=4 1085 B10R1.54 N[C@H]1CC[C@H](C1)CC(=O)O Amb10066912 [1,0,0,1,0,0|2,0,0]=4 1086 B10R1.54 O=C1CC(CC(F)F)CN1 Amb24678801 [1,0,0,1,0,0|2,0,0]=4 1087 B10R1.54 OC(=O)CC1CC(=O)NC1 Amb18831602 [1,0,0,1,0,0|1,0,1]=4 1088 B10R1.54 OC(=O)CC1CCC(F)C1 Amb24679226 [1,0,0,1,0,0|2,0,0]=4 1089 B10R1.54 OC(=O)C[C@H]1CC(=O)NC1 Amb24410373 [1,0,0,1,0,0|1,0,1]=4 1090 B10R1.64 C=C1CCCC1CC(O)=O Amb25855116 [1,0,0,1,0,0|1,0,1]=4 1091 B10R1.64 CC(=O)C[C@@H]1CCC[C@H]1Cl Amb25238254 [1,0,0,1,0,0|2,0,0]=4 1092 B10R1.64 CC(=O)C[C@H]1CCC[C@@H]1Cl Amb25324106 [1,0,0,1,0,0|2,0,0]=4 1093 B10R1.64 CC(=O)N[C@@H]1CCC[C@H]1N Amb25339520 [1,0,0,1,0,0|2,0,0]=4 1094 B10R1.64 CC(=O)OC1CCCC1N Amb25299825 [1,0,0,1,0,0|2,0,0]=4 1095 B10R1.64 CC(C)CC1CCCC1N Amb18287711 [1,0,0,1,0,0|1,0,1]=4 1096 B10R1.64 CC(C)CC1CNCC1N Amb24578112 [1,0,0,1,0,0|2,0,0]=4 1097 B10R1.64 CC(C)CC1CSCC1N Amb18199732 [1,0,0,1,0,0|2,0,0]=4 1098 B10R1.64 CC1CCCC1CC(C)=O Amb24480371 [1,0,0,1,0,0|2,0,0]=4 1099 B10R1.64 CC1CCCN1CC(O)=O Amb18954282 [1,0,0,1,0,0|2,0,0]=4 1100 B10R1.64 CC1NCCC1CC(O)=O Amb25137202 [1,0,0,1,0,0|2,0,0]=4 1101 B10R1.64 CC1OCCC1CC(O)=O Amb24707124 [1,0,0,1,0,0|2,0,0]=4 1102 B10R1.64 CC1SCCC1CC(O)=O Amb18199391 [1,0,0,1,0,0|2,0,0]=4 1103 B10R1.64 CN1CCCC1CC(O)=O Amb22586774 [1,0,0,1,0,0|2,0,0]=4 1104 B10R1.64 C[C@@H]1CCC[C@@H]1CC(N)=O Amb24561371 [1,0,0,1,0,0|2,0,0]=4 1105 B10R1.64 C[C@@H]1NCC[C@H]1CC(O)=O Amb18202479 [1,0,0,1,0,0|2,0,0]=4 1106 B10R1.64 C[C@H]1CCC[C@@H]1CC(O)=O Amb24587811 [1,0,0,1,0,0|1,0,0]=3 1107 B10R1.64 NC1CCCC1OC(N)=O Amb24644759 [1,0,0,1,0,0|2,0,0]=4 1108 B10R1.64 NC1CCOC1CC(O)=O Amb25113917 [1,0,0,1,0,0|1,0,0]=3 1109 B10R1.64 NC1COCC1CC(O)=O Amb24477383 [1,0,0,1,0,0|1,0,0]=3 1110 B10R1.64 NC1CSCC1CC(O)=O Amb18199825 [1,0,0,1,0,0|1,0,0]=3 1111 B10R1.64 NC=1CCCC1CC(O)=O Amb24745546 [1,0,0,1,0,0|0,0,2]=4 1112 B10R1.64 N[C@@H]1CCC[C@H]1CC(N)=O Amb25252096 [1,0,0,1,0,0|1,0,0]=3 1113 B10R1.64 N[C@H]1CCC[C@H]1CC(O)=O Amb24715924 [1,0,0,1,0,0|0,0,0]=2 1114 B10R1.64 N[C@H]1CCO[C@@H]1CC(O)=O Amb24627922 [1,0,0,1,0,0|1,0,0]=3 1115 B10R1.64 N[C@H]1CCO[C@H]1CC(O)=O Amb24515136 [1,0,0,1,0,0|1,0,0]=3 1116 B10R1.64 OC(=O)CC1CCCC1=O Amb18643831 [1,0,0,1,0,0|1,0,1]=4 1117 B10R1.64 OC(=O)CC1CCCC1F Amb24733558 [1,0,0,1,0,0|1,0,0]=3 1118 B10R1.64 OC(=O)CC1COCC1F Amb24550770 [1,0,0,1,0,0|2,0,0]=4 1119 B10R1.64 OC(=O)CC1OCCC1Cl Amb18646183 [1,0,0,1,0,0|2,0,0]=4 1120 B10R1.64 OC(=O)CN1CCC[C@@H]1O Amb10067047 [1,0,0,1,0,0|2,0,0]=4 1121 B10R1.64 OC(=O)CN1CCC[C@H]1O Amb10067046 [1,0,0,1,0,0|2,0,0]=4 1122 B10R1.64 OC(=O)C[C@H]1OCC[C@H]1Cl Amb25288131 [1,0,0,1,0,0|2,0,0]=4 1123 B10R1.64 OC1CCCC1CC(O)=O Amb18202404 [1,0,0,1,0,0|1,0,0]=3 1124 B10R1.64 OC1CCNC1CC(O)=O Amb20242318 [1,0,0,1,0,0|2,0,0]=4 1125 B10R1.64 O[C@@H]1CCN[C@@H]1CC(O)=O Amb20242371 [1,0,0,1,0,0|2,0,0]=4 1126 B10R1.64 O[C@@H]1CCN[C@H]1CC(O)=O Amb20242370 [1,0,0,1,0,0|2,0,0]=4 1127 B10R1.64 O[C@@H]1CNC[C@H]1CC(O)=O Amb25276871 [1,0,0,1,0,0|2,0,0]=4 1128 B10R1.64 O[C@H]1CCN[C@@H]1CC(O)=O Amb20242369 [1,0,0,1,0,0|2,0,0]=4 1129 B10R1.64 O[C@H]1CCN[C@H]1CC(O)=O Amb20242348 [1,0,0,1,0,0|2,0,0]=4 1130 B10R1.69 CCC(CC1CC1)NC=O Amb25767178 [1,0,0,1,0,0|2,0,0]=4 1131 B10R1.86 CCCC1CCC1C(O)=O Amb24670782 [1,0,0,1,0,0|1,0,0]=3 1132 B10R1.86 CCCN1CCC1C(O)=O Amb22011891 [1,0,0,1,0,0|2,0,0]=4 1133 B10R1.86 CCNC1CCC1C(O)=O Amb24509156 [1,0,0,1,0,0|2,0,0]=4 1134 B10R1.86 CCSC1CCC1C(O)=O Amb24634751 [1,0,0,1,0,0|2,0,0]=4 1135 B10R1.86 COCC1CCC1C(O)=O Amb24713218 [1,0,0,1,0,0|2,0,0]=4 1136 B10R1.95 CC1(C)O[C@H](CO1)CC=O Amb22225051 [1,0,0,1,0,0|2,0,0]=4 1137 B10R1.130 CC1CC(=O)CC1CCC Amb24646473 [1,0,0,1,0,0|2,0,0]=4 1138 B10R1.130 CC1CC(CC=O)C(=O)C1 Amb25706979 [1,0,0,1,0,0|1,0,1]=4 1139 B10R1.130 CCCC1CC(=O)OC1=O Amb24460269 [1,0,0,1,0,0|1,0,1]=4 1140 B10R1.130 CN1CC(CCO)C(N)C1 Amb24477357 [1,0,0,1,0,0|1,0,1]=4 1141 B10R1.130 C[C@@H]1OC(=O)N[C@@H]1CCC Amb25275205 [1,0,0,1,0,0|2,0,0]=4 1142 B10R1.162 NCC1CC(=O)NCCO1 Amb25788896 [1,0,0,1,0,0|2,0,0]=4 1143 B10R1.162 NCC1CCCCC(=O)N1 Amb19515401 [1,0,0,1,0,0|2,0,0]=4 1144 B10R1.165 CC(C)C1C(CBr)OC1=O Amb24740351 [1,0,0,1,0,0|2,0,0]=4 1145 B10R1.171 CC1(C)CC(CBr)CCO1 Amb24565119 [1,0,0,1,0,0|1,0,1]=4 1146 B10R1.171 CC1(C)CC(CCO1)NN Amb18644165 [1,0,0,1,0,0|1,0,1]=4 1147 B10R1.171 CC1(C)CC(CN)CCO1 Amb18644014 [1,0,0,1,0,0|0,0,1]=3 1148 B10R1.171 CC1(C)CC(CN)CCO1 Amb22235866 [1,0,0,1,0,0|0,0,1]=3 1149 B10R1.171 CC1(C)CC(CS)CCO1 Amb25716425 [1,0,0,1,0,0|1,0,1]=4 1150 B10R1.171 CC1(C)OC(CN)CCO1 Amb24753868 [1,0,0,1,0,0|1,0,1]=4 1151 B10R1.171 CC1(C)O[C@@H](CN)CCO1 Amb25840282 [1,0,0,1,0,0|1,0,1]=4 1152 B10R1.171 OCC1CCOC(C1)(C)C Amb15701273 [1,0,0,1,0,0|1,0,1]=4 1153 B10R1.227 CC(=C)CC1(CN)CCC1 Amb25726130 [1,0,0,1,0,0|2,0,0]=4 1154 B10R1.227 CC(O)CC1(CN)CCC1 Amb25694860 [1,0,0,1,0,0|1,0,1]=4 1155 B10R1.227 CCC1(CC(C)=O)CCC1 Amb25081870 [1,0,0,1,0,0|2,0,0]=4 1156 B10R1.227 CCC1(CC(O)=O)CCC1 Amb22735900 [1,0,0,1,0,0|1,0,0]=3 1157 B10R1.227 CCC1(COC1)CC(O)=O Amb24743907 [1,0,0,1,0,0|2,0,0]=4 1158 B10R1.227 COC1(CC(O)=O)CCC1 Amb22886504 [1,0,0,1,0,0|2,0,0]=4 1159 B10R1.227 NCC1(CC(N)=O)CCC1 Amb25241824 [1,0,0,1,0,0|1,0,0]=3 1160 B10R1.227 NCC1(CC(O)=O)CCC1 Amb20669491 [1,0,0,1,0,0|0,0,0]=2 1161 B10R1.227 NCC1(CC(O)=O)CCC1 Amb22059709 [1,0,0,1,0,0|0,0,0]=2 1162 B10R1.227 NCC1(CCC1)CC(C)C Amb10607995 [1,0,0,1,0,0|1,0,1]=4 1163 B10R1.227 NCC1(CCC1)NC(N)=O Amb25146913 [1,0,0,1,0,0|2,0,0]=4 1164 B10R1.227 NCC1(COC1)CC(N)=O Amb25177734 [1,0,0,1,0,0|2,0,0]=4 1165 B10R1.227 NCC1(COC1)CC(O)=O Amb20671383 [1,0,0,1,0,0|1,0,0]=3 1166 B10R1.227 OCC1(COC1)CC(O)=O Amb25707572 [1,0,0,1,0,0|2,0,0]=4 1167 B10R1.239 OC(=O)CC1(CS)CC1F Amb22728683 [1,0,0,1,0,0|2,0,0]=4 1168 B10R1.374 CC(=O)NC(CN)C1CC1 Amb18251251 [1,0,0,1,0,0|2,0,0]=4 1169 B10R1.374 CC(C)CC(CN)C1CC1 Amb18202671 [1,0,0,1,0,0|1,0,1]=4 1170 B10R1.374 CCN(CC(O)=O)C1CC1 Amb22096981 [1,0,0,1,0,0|2,0,0]=4 1171 B10R1.374 COC(CC(O)=O)C1CC1 Amb25248855 [1,0,0,1,0,0|2,0,0]=4 1172 B10R1.374 NCC(NC(N)=O)C1CC1 Amb18251260 [1,0,0,1,0,0|2,0,0]=4 1173 B10R1.374 OC(=O)CC(C=O)C1CC1 Amb24671332 [1,0,0,1,0,0|1,0,1]=4 1174 B10R1.389 CCCC1(CC(=O)N1)CC Amb25197685 [1,0,0,1,0,0|2,0,0]=4 1175 B10R1.389 CCCC1(CN)CC(C)C1 Amb23449231 [1,0,0,1,0,0|1,0,1]=4 1176 B10R1.389 CCSC1(CN)CC(=O)C1 Amb24758355 [1,0,0,1,0,0|2,0,0]=4 1177 B10R1.389 CN1CC(CN)(CCO)C1 Amb25376236 [1,0,0,1,0,0|1,0,1]=4 1178 B10R1.389 COCC1(CN)CC(C)C1 Amb23456225 [1,0,0,1,0,0|2,0,0]=4 1179 B10R1.394 COCC1(CC(O)=O)CC1 Amb18202405 [1,0,0,1,0,0|2,0,0]=4 1180 B10R1.454 CC1(C)C[C@H](CO)[C@H]1CO Amb25177052 [1,0,0,1,0,0|1,0,1]=4 1181 B10R1.460 CC1CC1C(CC=C)NN Amb24504986 [1,0,0,1,0,0|2,0,0]=4 1182 B10R1.59 C=C1C[C@@H](N)[C@H](C1)C(O)=O Amb24560213 [1,0,0,1,0,0|0,0,2]=4 1183 B10R1.59 C=C1C[C@@H]([C@H](C1)C(=O)O)N Amb10071928 [1,0,0,1,0,0|0,0,2]=4 1184 B10R1.59 CC(=O)C1OC(=O)CC1C Amb24524380 [1,0,0,1,0,0|1,0,1]=4 1185 B10R1.59 CC(=O)[C@@H]1OC(=O)C[C@@H]1C Amb25319949 [1,0,0,1,0,0|1,0,1]=4 1186 B10R1.59 CC(=O)[C@@H]1OC(=O)C[C@H]1C Amb24584412 [1,0,0,1,0,0|1,0,1]=4 1187 B10R1.59 CC(C)C1=CC(=O)CC1C Amb24577837 [1,0,0,1,0,0|1,0,1]=4 1188 B10R1.59 CC(C)C1CC(O)CC1C Amb24548561 [1,0,0,1,0,0|1,0,1]=4 1189 B10R1.59 CC(C)C1NC(=O)CC1N Amb25840888 [1,0,0,1,0,0|1,0,0]=3 1190 B10R1.59 CC(C)C1NC(=O)OC1C Amb25691378 [1,0,0,1,0,0|2,0,0]=4 1191 B10R1.59 CC(C)C1OC(=O)CC1O Amb25796429 [1,0,0,1,0,0|1,0,0]=3 1192 B10R1.59 CC(C)C1OC(=S)OC1C Amb24398771 [1,0,0,1,0,0|1,1,0]=4 1193 B10R1.59 CC(C)[C@@H]1CC(=O)C[C@@H]1C Amb24676884 [1,0,0,1,0,0|1,0,0]=3 1194 B10R1.59 CC(C)[C@@H]1CC(=O)C[C@H]1C Amb24706947 [1,0,0,1,0,0|1,0,0]=3 1195 B10R1.59 CC(C)[C@@H]1CC(O)C[C@H]1C Amb25245013 [1,0,0,1,0,0|1,0,1]=4 1196 B10R1.59 CC(C)[C@@H]1NC(=O)C[C@@H]1O Amb24514899 [1,0,0,1,0,0|2,0,0]=4 1197 B10R1.59 CC(C)[C@@H]1NC(=O)C[C@H]1C Amb24763802 [1,0,0,1,0,0|1,0,0]=3 1198 B10R1.59 CC(C)[C@H]1NC(=O)C[C@@H]1C Amb24515899 [1,0,0,1,0,0|1,0,0]=3 1199 B10R1.59 CC(C)[C@H]1NC(=O)C[C@@H]1O Amb24612400 [1,0,0,1,0,0|2,0,0]=4 1200 B10R1.59 CC(C)[C@H]1OC(=O)C[C@@H]1O Amb24748520 [1,0,0,1,0,0|1,0,0]=3 1201 B10R1.59 CC(O)C1OC(=O)CC1N Amb25102523 [1,0,0,1,0,0|1,0,0]=3 1202 B10R1.59 CC(O)[C@@H]1OC(=O)C[C@@H]1N Amb24617770 [1,0,0,1,0,0|1,0,0]=3 1203 B10R1.59 CC1CC(=O)CC1C(O)=O Amb25281943 [1,0,0,1,0,0|1,0,1]=4 1204 B10R1.59 CC1CC(C(O)=O)N(C)C1 Amb25359118 [1,0,0,1,0,0|1,0,0]=3 1205 B10R1.59 CC1CC(C)C(=C1)C(O)=O Amb24523140 [1,0,0,1,0,0|0,0,2]=4 1206 B10R1.59 CC1CC(C)N(C1)C(N)=O Amb25125656 [1,0,0,1,0,0|2,0,0]=4 1207 B10R1.59 CC1CC(C)NC1C(O)=O Amb25126900 [1,0,0,1,0,0|1,0,0]=3 1208 B10R1.59 CC1CC(N)C(=C1)C(O)=O Amb25238457 [1,0,0,1,0,0|0,0,2]=4 1209 B10R1.59 CC1CC(N)C(O1)C(O)=O Amb24609573 [1,0,0,1,0,0|1,0,0]=3 1210 B10R1.59 CC1CC(O)C(N1)C(O)=O Amb25737391 [1,0,0,1,0,0|2,0,0]=4 1211 B10R1.59 CC1CC(O)NC1C(O)=O Amb24505217 [1,0,0,1,0,0|2,0,0]=4 1212 B10R1.59 CC1CN(C)CC1C(N)=O Amb24618634 [1,0,0,1,0,0|2,0,0]=4 1213 B10R1.59 CC1CN(C)CC1C(O)=O Amb24478023 [1,0,0,1,0,0|1,0,0]=3 1214 B10R1.59 CC1C[C@H](N)C(=C1)C(O)=O Amb24629358 [1,0,0,1,0,0|0,0,2]=4 1215 B10R1.59 CC1NC(C)CC1C(O)=O Amb24586145 [1,0,0,1,0,0|1,0,0]=3 1216 B10R1.59 CC1OC(C(C)O1)C(O)=O Amb25128234 [1,0,0,1,0,0|2,0,0]=4 1217 B10R1.59 CC1OC(C)CC1C(C)=O Amb24408473 [1,0,0,1,0,0|2,0,0]=4 1218 B10R1.59 CC=1C[C@@H](N)[C@H](C1)C(O)=O Amb24499611 [1,0,0,1,0,0|0,0,2]=4 1219 B10R1.59 CC=1C[C@H]([C@@H](N)C1)C(O)=O Amb25174958 [1,0,0,1,0,0|0,0,2]=4 1220 B10R1.59 CN1CC(S)CC1C(O)=O Amb25217631 [1,0,0,1,0,0|2,0,0]=4 1221 B10R1.59 CN1C[C@@H](F)C[C@@H]1C(O)=O Amb25328928 [1,0,0,1,0,0|2,0,0]=4 1222 B10R1.59 CN1C[C@@H](F)C[C@H]1C(O)=O Amb25305695 [1,0,0,1,0,0|2,0,0]=4 1223 B10R1.59 CN1C[C@@H](N)C[C@H]1C(O)=O Amb19516794 [1,0,0,1,0,0|2,0,0]=4 1224 B10R1.59 CN1C[C@@H](O)C[C@@H]1C(O)=O Amb23592288 [1,0,0,1,0,0|2,0,0]=4 1225 B10R1.59 CN1C[C@@H](O)C[C@H]1C(O)=O Amb22757084 [1,0,0,1,0,0|2,0,0]=4 1226 B10R1.59 CN1C[C@H](F)C[C@H]1C(O)=O Amb25175012 [1,0,0,1,0,0|2,0,0]=4 1227 B10R1.59 CN1C[C@H](N)C[C@H]1C(O)=O Amb22587284 [1,0,0,1,0,0|2,0,0]=4 1228 B10R1.59 CN1C[C@H](N)C[C@H]1C(O)=O Amb23385233 [1,0,0,1,0,0|2,0,0]=4 1229 B10R1.59 CN1C[C@H](O)C[C@@H]1C(O)=O Amb24669003 [1,0,0,1,0,0|2,0,0]=4 1230 B10R1.59 C[C@@H](O)[C@@H]1OC(=O)C[C@@H]1N Amb25261013 [1,0,0,1,0,0|1,0,0]=3 1231 B10R1.59 C[C@@H](O)[C@@H]1OC(=O)C[C@@H]1O Amb25221046 [1,0,0,1,0,0|2,0,0]=4 1232 B10R1.59 C[C@@H]1CC(=O)C[C@@H]1C(O)=O Amb25174905 [1,0,0,1,0,0|1,0,1]=4 1233 B10R1.59 C[C@@H]1CC(=O)O[C@H]1[C@H](C)Br Amb25239352 [1,0,0,1,0,0|1,0,0]=3 1234 B10R1.59 C[C@@H]1CN(C)C[C@H]1C(O)=O Amb24643115 [1,0,0,1,0,0|1,0,0]=3 1235 B10R1.59 C[C@@H]1C[C@H](Cl)[C@H](O1)C(O)=O Amb24628935 [1,0,0,1,0,0|2,0,0]=4 1236 B10R1.59 C[C@H]1CC(=O)O[C@H]1[C@H](C)O Amb25296426 [1,0,0,1,0,0|1,0,0]=3 1237 B10R1.59 C[C@H]1O[C@@H](C)C[C@H]1C(C)=O Amb24737346 [1,0,0,1,0,0|2,0,0]=4 1238 B10R1.59 NC1CC(=O)CC1C(O)=O Amb24523031 [1,0,0,1,0,0|1,0,1]=4 1239 B10R1.59 NC1CC(C(N)C1)C(O)=O Amb25200055 [1,0,0,1,0,0|1,0,0]=3 1240 B10R1.59 N[C@@H]1CC(=O)C[C@@H]1C(O)=O Amb24391186 [1,0,0,1,0,0|1,0,1]=4 1241 B10R1.59 N[C@H]1CC(=C)C[C@H]1C(O)=O Amb17938168 [1,0,0,1,0,0|0,0,2]=4 1242 B10R1.110 CC1CC1C(C)CC(O)=O Amb24666851 [1,0,0,1,0,0|0,0,0]=2 1243 B10R1.110 CC1OC1C(C)CC(C)=O Amb25146705 [1,0,0,1,0,0|2,0,0]=4 1244 B10R1.110 C[C@@H]1C[C@H]1[C@@H](O)CC(C)=O Amb24645463 [1,0,0,1,0,0|2,0,0]=4 1245 B10R1.110 O[C@@H](CC(O)=O)[C@@H]1C[C@H]1Cl Amb25259289 [1,0,0,1,0,0|2,0,0]=4 1246 B10R1.268 CC(CC(=O)N)NC1CC1 Amb17231944 [1,0,0,1,0,0|2,0,0]=4 1247 B10R1.268 CC(CC1CC1)=CC(O)=O Amb25689276 [1,0,0,1,0,0|0,0,2]=4 1248 B10R1.268 CC(CC1CC1)CC(O)=O Amb25147806 [1,0,0,1,0,0|0,0,0]=2 1249 B10R1.268 CC(CC1CC1)NC(C)=O Amb25318073 [1,0,0,1,0,0|2,0,0]=4 1250 B10R1.268 CC(CC1CC1)NC(N)=O Amb24678560 [1,0,0,1,0,0|2,0,0]=4 1251 B10R1.268 NC(CC1CC1)CC(O)=O Amb25704189 [1,0,0,1,0,0|0,0,0]=2 1252 B10R1.268 O=S(CC(=O)O)CC1CC1 Amb10608093 [1,0,0,1,0,0|2,0,0]=4 1253 B10R1.282 CC=1C(C1C(C)C)C(O)=O Amb24680999 [1,0,0,1,0,0|0,0,2]=4 1254 B10R1.282 C[C@@H]1[C@H]([C@@H]1C(C)=O)C(C)O Amb24737169 [1,0,0,1,0,0|2,0,0]=4 1255 B10R1.310 CC1CC(C)(C)N1C(C)=O Amb25355934 [1,0,0,1,0,0|2,0,0]=4 1256 B10R1.329 CC1(C)CC(F)CC(=O)C1 Amb24742732 [1,0,0,1,0,0|2,0,0]=4 1257 B10R1.329 CC1(C)CC(N)CC(=O)N1 Amb25242814 [1,0,0,1,0,0|1,0,0]=3 1258 B10R1.329 CC1(C)C[C@H](O)C[C@@H](N)C1 Amb24514822 [1,0,0,1,0,0|1,0,1]=4 1259 B10R1.329 CC1(C)C[C@H](O)C[C@H](N)C1 Amb24514853 [1,0,0,1,0,0|1,0,1]=4 1260 B10R1.329 CC1CC(=C)CC(C)(C)C1 Amb24334940 [1,0,0,1,0,0|2,0,0]=4 1261 B10R1.329 CC1CC(=O)CC(C)(C)N1 Amb18643755 [1,0,0,1,0,0|2,0,0]=4 1262 B10R1.329 CC1CC(=O)CC(C)(C)O1 Amb25821913 [1,0,0,1,0,0|2,0,0]=4 1263 B10R1.329 CC1CC(=O)CC(C)(O)C1 Amb24356969 [1,0,0,1,0,0|2,0,0]=4 1264 B10R1.329 CC1CC(=O)NC(C)(C)C1 Amb24417989 [1,0,0,1,0,0|1,0,0]=3 1265 B10R1.329 CC1CC(C)(C)NC(=O)N1 Amb25313546 [1,0,0,1,0,0|2,0,0]=4 1266 B10R1.329 CC=1CC(=O)OC(C)(C)C1 Amb19944700 [1,0,0,1,0,0|0,0,2]=4 1267 B10R1.329 C[C@@H]1C[C@@H](O)CC(C)(C)C1 Amb22801531 [1,0,0,1,0,0|1,0,1]=4 1268 B10R1.329 C[C@@H]1C[C@H](O)CC(C)(C)C1 Amb22230423 [1,0,0,1,0,0|1,0,1]=4 1269 B10R1.330 CC1CC(C)CNC(=N)C1 Amb25127671 [1,0,0,1,0,0|2,0,0]=4 1270 B10R1.330 CC1CC(C)NC(=O)CC1 Amb24400989 [1,0,0,1,0,0|2,0,0]=4 1271 B10R1.330 CC1CNC(=O)CC(C)O1 Amb25823614 [1,0,0,1,0,0|2,0,0]=4 1272 B10R1.330 C[C@H]1C[C@@H](C)C[C@@H](O)CC1 Amb24515237 [1,0,0,1,0,0|1,0,1]=4 1273 B10R1.330 C[C@H]1C[C@H](C)CC(=O)CC1 Amb24621210 [1,0,0,1,0,0|1,0,0]=3 1274 B10R1.368 CC(=C)C[C@H]1C[C@@H]1C(O)=O Amb25378774 [1,0,0,1,0,0|0,0,2]=4 1275 B10R1.368 CC(C)=C[C@@H]1C[C@@H]1C(O)=O Amb25259811 [1,0,0,1,0,0|0,0,2]=4 1276 B10R1.368 CC(C)CC1CC1C(C)=O Amb24456697 [1,0,0,1,0,0|1,0,0]=3 1277 B10R1.368 CC(C)CC1CC1C(O)=O Amb18297987 [1,0,0,1,0,0|0,0,0]=2 1278 B10R1.368 CC(C)C[C@@H]1C[C@H]1C(C)O Amb24635949 [1,0,0,1,0,0|1,0,1]=4 1279 B10R1.368 CC(C)C[C@@H]1C[C@H]1C(N)=O Amb25360281 [1,0,0,1,0,0|1,0,0]=3 1280 B10R1.368 CN(C)C1CC1CC(O)=O Amb24710726 [1,0,0,1,0,0|1,0,0]=3 1281 B10R1.371 CC1(C)CC(CC(N)=O)C1 Amb24351575 [1,0,0,1,0,0|1,0,0]=3 1282 B10R1.371 CC1(C)CN(CC(N)=O)C1 Amb24752732 [1,0,0,1,0,0|2,0,0]=4 1283 B10R1.371 CC1(O)CC(CC(O)=O)C1 Amb25782430 [1,0,0,1,0,0|1,0,0]=3 1284 B10R1.371 OC(=O)CC1CC(F)(F)C1 Amb22739013 [1,0,0,1,0,0|2,0,0]=4 1285 B10R1.443 CC1(C)CC1(C)CC(C)=O Amb24633876 [1,0,0,1,0,0|1,0,0]=3 1286 B10R1.443 CC1(CC1(Cl)Cl)CC(O)=O Amb24725943 [1,0,0,1,0,0|2,0,0]=4 1287 B10R1.443 CC1(CC1(F)Cl)CC(O)=O Amb25199162 [1,0,0,1,0,0|2,0,0]=4 1288 B10R1.30 CC1CC(CN)C(=O)NC1 Amb23586227 [0,0,0,1,1,0|1,0,0]=3 1289 B10R1.30 CC1CC(CO)C(=O)CC1 Amb24633425 [0,0,0,1,1,0|2,0,0]=4 1290 B10R1.30 CC1CCC(=O)C(C1)CC Amb22059014 [0,0,0,1,1,0|2,0,0]=4 1291 B10R1.30 C[C@@H]1CCC(=O)C[C@H]1CC Amb25191522 [0,0,0,1,1,0|2,0,0]=4 1292 B10R1.30 C[C@@H]1C[C@H](CO)C(=O)CC1 Amb24686550 [0,0,0,1,1,0|2,0,0]=4 1293 B10R1.33 CC1(C)CC(CO)C(=O)C1 Amb25759712 [0,0,0,1,1,0|2,0,0]=4 1294 B10R1.42 CC1(C)C(C#C)C1C(O)=O Amb24460777 [0,0,0,1,1,0|1,0,1]=4 1295 B10R1.42 CC1(C)C(C#N)C1C(O)=O Amb25340466 [0,0,0,1,1,0|0,0,2]=4 1296 B10R1.42 CC1(C)C(C=C)C1C(O)=O Amb24671316 [0,0,0,1,1,0|1,0,1]=4 1297 B10R1.42 CC1(C)C(CBr)C1C(O)=O Amb25791058 [0,0,0,1,1,0|1,0,0]=3 1298 B10R1.42 CC1(C)C(CN)C1C(O)=O Amb25261168 [0,0,0,1,1,0|0,0,0]=2 1299 B10R1.42 CC1(C)[C@@H](C#N)[C@@H]1C(O)=O Amb24515006 [0,0,0,1,1,0|0,0,2]=4 1300 B10R1.42 CC1(C)[C@@H](C#N)[C@H]1C(O)=O Amb24586871 [0,0,0,1,1,0|0,0,2]=4 1301 B10R1.42 CC1(C)[C@@H](C=C)[C@@H]1C(O)=O Amb24671299 [0,0,0,1,1,0|1,0,1]=4 1302 B10R1.42 CC1(C)[C@@H](C=O)[C@@H]1C(O)=O Amb24546993 [0,0,0,1,1,0|1,0,1]=4 1303 B10R1.42 CC1(C)[C@@H](C=O)[C@H]1C(O)=O Amb25288490 [0,0,0,1,1,0|1,0,1]=4 1304 B10R1.42 CC1(C)[C@H](C#N)[C@@H]1C(O)=O Amb25174790 [0,0,0,1,1,0|0,0,2]=4 1305 B10R1.42 CC1(C)[C@H](C#N)[C@H]1C(O)=O Amb25261460 [0,0,0,1,1,0|0,0,2]=4 1306 B10R1.42 CC[C@@H]1[C@H](C(O)=O)C1(C)C Amb24514920 [0,0,0,1,1,0|1,0,0]=3 1307 B10R1.42 COC1C(C(O)=O)C1(C)C Amb23538769 [0,0,0,1,1,0|2,0,0]=4 1308 B10R1.42 NC[C@@H]1[C@H](C(O)=O)C1(F)F Amb25044983 [0,0,0,1,1,0|2,0,0]=4 1309 B10R1.52 CC(C)[C@H]1NC(=O)[C@@H]1CC Amb24541366 [0,0,0,1,1,0|2,0,0]=4 1310 B10R1.113 CC(C)C1CNCC(=O)N1 Amb24351593 [0,0,0,1,1,0|2,0,0]=4 1311 B10R1.113 CC(C)[C@@H]1CC(=O)CCC1 Amb24408361 [0,0,0,1,1,0|2,0,0]=4 1312 B10R1.113 CC(C)[C@@H]1CC(=O)NCC1 Amb24372332 [0,0,0,1,1,0|2,0,0]=4 1313 B10R1.113 CC(C)[C@H]1CC(=O)CCC1 Amb25204978 [0,0,0,1,1,0|2,0,0]=4 1314 B10R1.113 CC(C)[C@H]1CNCC(=O)N1 Amb25146328 [0,0,0,1,1,0|2,0,0]=4 1315 B10R1.113 CC1CC(CC=C1)C(O)=O Amb24350925 [0,0,0,1,1,0|1,0,1]=4 1316 B10R1.113 CC1CC(CCC1)C(=O)Cl Amb25715458 [0,0,0,1,1,0|2,0,0]=4 1317 B10R1.113 CC1CC(CCC1)C(N)=O Amb24680794 [0,0,0,1,1,0|2,0,0]=4 1318 B10R1.113 CC1CC(CCN1)C(O)=O Amb18831574 [0,0,0,1,1,0|2,0,0]=4 1319 B10R1.113 CC1CC(CNC1)C(O)=O Amb18643998 [0,0,0,1,1,0|0,0,0]=2 1320 B10R1.113 CC1CC(NCC1)C(=O)O Amb13886199 [0,0,0,1,1,0|2,0,0]=4 1321 B10R1.113 CC1CC(NCC1)C(O)=O Amb19375550 [0,0,0,1,1,0|2,0,0]=4 1322 B10R1.113 CC1CC(OCC1)C(O)=O Amb25266110 [0,0,0,1,1,0|2,0,0]=4 1323 B10R1.113 CC1CCCC(C1)C(C)=O Amb24505220 [0,0,0,1,1,0|2,0,0]=4 1324 B10R1.113 CC1CCCC(N1)C(O)=O Amb19959953 [0,0,0,1,1,0|2,0,0]=4 1325 B10R1.113 CC1CCCC(O1)C(O)=O Amb24529278 [0,0,0,1,1,0|2,0,0]=4 1326 B10R1.113 CC1CNCC(O1)C(N)=O Amb25351035 [0,0,0,1,1,0|2,0,0]=4 1327 B10R1.113 CC1COCC(N1)C(O)=O Amb23585511 [0,0,0,1,1,0|2,0,0]=4 1328 B10R1.113 CC1CSCC(N1)C(O)=O Amb18645533 [0,0,0,1,1,0|2,0,0]=4 1329 B10R1.113 CN1C[C@@H](CCC1)C(O)=O Amb22751960 [0,0,0,1,1,0|2,0,0]=4 1330 B10R1.113 C[C@@H]1CCCC(C1)C(C)=O Amb25358902 [0,0,0,1,1,0|2,0,0]=4 1331 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O Amb10843963 [0,0,0,1,1,0|1,0,0]=3 1332 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(O)=O Amb25168905 [0,0,0,1,1,0|2,0,0]=4 1333 B10R1.113 C[C@@H]1CCC[C@H](C1)C(C)=O Amb24736673 [0,0,0,1,1,0|2,0,0]=4 1334 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(O)=O Amb25378882 [0,0,0,1,1,0|1,0,0]=3 1335 B10R1.113 C[C@@H]1COC[C@@H](N1)C(O)=O Amb25102766 [0,0,0,1,1,0|2,0,0]=4 1336 B10R1.113 C[C@@H]1CSC[C@H](N1)C(O)=O Amb24565699 [0,0,0,1,1,0|2,0,0]=4 1337 B10R1.113 C[C@@H]1C[C@@H](NCC1)C(O)=O Amb24725617 [0,0,0,1,1,0|2,0,0]=4 1338 B10R1.113 C[C@@H]1C[C@H](CNC1)C(O)=O Amb25095251 [0,0,0,1,1,0|0,0,0]=2 1339 B10R1.113 C[C@@H]1C[C@H](NCC1)C(O)=O Amb22744764 [0,0,0,1,1,0|2,0,0]=4 1340 B10R1.113 C[C@H]1CC(CCC1)C(N)=O Amb24650556 [0,0,0,1,1,0|2,0,0]=4 1341 B10R1.113 C[C@H]1CC(CCC1)C(O)=O Amb25824115 [0,0,0,1,1,0|1,0,0]=3 1342 B10R1.113 C[C@H]1CCC[C@H](O1)C(O)=O Amb24622482 [0,0,0,1,1,0|2,0,0]=4 1343 B10R1.113 C[C@H]1C[C@@H](CC=C1)C(O)=O Amb24514830 [0,0,0,1,1,0|1,0,1]=4 1344 B10R1.113 C[C@H]1C[C@@H](CCC1)C(O)=O Amb24657322 [0,0,0,1,1,0|1,0,0]=3 1345 B10R1.113 C[C@H]1C[C@@H](OCC1)C(O)=O Amb25168475 [0,0,0,1,1,0|2,0,0]=4 1346 B10R1.113 C[C@H]1C[C@H](CC=C1)C(O)=O Amb24514831 [0,0,0,1,1,0|1,0,1]=4 1347 B10R1.113 NC1CC(COC1)C(O)=O Amb25088866 [0,0,0,1,1,0|2,0,0]=4 1348 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O Amb10873166 [0,0,0,1,1,0|2,0,0]=4 1349 B10R1.113 N[C@@H]1C[C@@H](CCC1)C(O)=O Amb20241307 [0,0,0,1,1,0|2,0,0]=4 1350 B10R1.113 N[C@@H]1C[C@@H](CCC1)C(O)=O Amb23439976 [0,0,0,1,1,0|2,0,0]=4 1351 B10R1.113 N[C@@H]1C[C@@H](CNC1)C(O)=O Amb24587389 [0,0,0,1,1,0|1,0,0]=3 1352 B10R1.113 N[C@@H]1C[C@H](CCC1)C(O)=O Amb22746829 [0,0,0,1,1,0|2,0,0]=4 1353 B10R1.113 N[C@@H]1C[C@H](CCC1)C(O)=O Amb23439848 [0,0,0,1,1,0|2,0,0]=4 1354 B10R1.113 N[C@H]1C[C@H](CCC1)C(O)=O Amb20241308 [0,0,0,1,1,0|2,0,0]=4 1355 B10R1.113 OC(=O)C1CC(F)CNC1 Amb13889096 [0,0,0,1,1,0|1,0,0]=3 1356 B10R1.113 OC(=O)C1CCCC(Br)C1 Amb24478263 [0,0,0,1,1,0|2,0,0]=4 1357 B10R1.113 OC(=O)C1CCCC(Cl)C1 Amb18126349 [0,0,0,1,1,0|2,0,0]=4 1358 B10R1.113 OC(=O)[C@@H]1CCC[C@@H](Br)C1 Amb25366201 [0,0,0,1,1,0|2,0,0]=4 1359 B10R1.113 OC(=O)[C@@H]1CCC[C@H](Cl)C1 Amb24511905 [0,0,0,1,1,0|2,0,0]=4 1360 B10R1.113 OC(=O)[C@@H]1C[C@@H](Cl)CNN1 Amb24557811 [0,0,0,1,1,0|2,0,0]=4 1361 B10R1.113 OC(=O)[C@H]1CNC[C@@H](F)C1 Amb24737294 [0,0,0,1,1,0|1,0,0]=3 1362 B10R1.113 OC(=O)[C@H]1C[C@H](Cl)CNN1 Amb24710060 [0,0,0,1,1,0|2,0,0]=4 1363 B10R1.113 OC1CCCC(C1)C(O)=O Amb18644123 [0,0,0,1,1,0|2,0,0]=4 1364 B10R1.113 OC1CNNC(C1)C(O)=O Amb18644257 [0,0,0,1,1,0|2,0,0]=4 1365 B10R1.113 O[C@@H]1CCC[C@@H](C1)C(O)=O Amb22899465 [0,0,0,1,1,0|2,0,0]=4 1366 B10R1.113 O[C@@H]1CCC[C@H](C1)C(O)=O Amb22899464 [0,0,0,1,1,0|2,0,0]=4 1367 B10R1.113 O[C@H]1CCC[C@@H](C1)C(O)=O Amb24546990 [0,0,0,1,1,0|2,0,0]=4 1368 B10R1.113 O[C@H]1CNN[C@H](C1)C(O)=O Amb24622480 [0,0,0,1,1,0|2,0,0]=4 1369 B10R1.234 CC(C)C1(CO)CC(=O)N1 Amb25301227 [0,0,0,1,1,0|2,0,0]=4 1370 B10R1.234 CC1CC(C1)(C#N)C(O)=O Amb20668855 [0,0,0,1,1,0|0,0,2]=4 1371 B10R1.234 CC1CC(C1)(CO)C(O)=O Amb23453486 [0,0,0,1,1,0|1,0,0]=3 1372 B10R1.234 CC1CC(CN)(C1)C(C)O Amb23538192 [0,0,0,1,1,0|1,0,1]=4 1373 B10R1.234 CC1CC(CN)(C1)C(O)=O Amb24586159 [0,0,0,1,1,0|0,0,0]=2 1374 B10R1.234 CCC1(CC(C)C1)C(O)=O Amb23448799 [0,0,0,1,1,0|1,0,0]=3 1375 B10R1.234 CN1CC(C1)(CO)C(O)=O Amb24403348 [0,0,0,1,1,0|2,0,0]=4 1376 B10R1.234 CNC1(CC(C)C1)C(O)=O Amb25187332 [0,0,0,1,1,0|2,0,0]=4 1377 B10R1.234 NCC1(CC(O)C1)C(O)=O Amb24413153 [0,0,0,1,1,0|1,0,0]=3 1378 B10R1.242 CC1(C)CC1(C#N)C(O)=O Amb23541307 [0,0,0,1,1,0|0,0,2]=4 1379 B10R1.287 CC(=O)CC1C(Cl)C1(C)C Amb24381479 [0,0,0,1,1,0|2,0,0]=4 1380 B10R1.287 CC(=O)C[C@@H]1[C@@H](Br)C1(C)C Amb24519911 [0,0,0,1,1,0|2,0,0]=4 1381 B10R1.287 CC1(C)[C@@H](N)[C@H]1CC(O)=O Amb25261513 [0,0,0,1,1,0|0,0,0]=2 1382 B10R1.288 CC1(C)CC(C1N)C(N)=O Amb25743195 [0,0,0,1,1,0|1,0,0]=3 1383 B10R1.288 CC1(C)CC(C1N)C(O)=O Amb24402159 [0,0,0,1,1,0|0,0,0]=2 1384 B10R1.288 CC1(C)C[C@@H]([C@H]1N)C(O)=O Amb25313341 [0,0,0,1,1,0|0,0,0]=2 1385 B10R1.288 CC1(C)O[C@@H]([C@H]1Br)C(O)=O Amb24519936 [0,0,0,1,1,0|2,0,0]=4 1386 B10R1.351 CC1(C)CCN1CC(O)=O Amb25225935 [0,0,0,1,1,0|2,0,0]=4 1387 B10R1.359 CC(=O)C1CC(C)(C)CC1 Amb25136434 [0,0,0,1,1,0|2,0,0]=4 1388 B10R1.359 CC1(C)CC(C=C1)C(O)=O Amb18643602 [0,0,0,1,1,0|1,0,1]=4 1389 B10R1.359 CC1(C)CC(CC1)C(N)=O Amb24449433 [0,0,0,1,1,0|2,0,0]=4 1390 B10R1.359 CC1(C)CC(CC1)C(O)=O Amb18643933 [0,0,0,1,1,0|1,0,0]=3 1391 B10R1.359 CC1(C)CC(CN1)C(O)=O Amb23589283 [0,0,0,1,1,0|0,0,0]=2 1392 B10R1.359 CC1(C)CC(CO1)C(O)=O Amb24312661 [0,0,0,1,1,0|1,0,0]=3 1393 B10R1.359 CC1(C)CCC(N1)C(O)=O Amb22755806 [0,0,0,1,1,0|2,0,0]=4 1394 B10R1.359 CC1(C)CCC(O1)C(O)=O Amb23455423 [0,0,0,1,1,0|2,0,0]=4 1395 B10R1.359 CC1(C)CNC(C1)C(O)=O Amb22756172 [0,0,0,1,1,0|2,0,0]=4 1396 B10R1.359 CC1(C)CN[C@@H](C1)C(O)=O Amb20671421 [0,0,0,1,1,0|2,0,0]=4 1397 B10R1.359 CC1(C)CN[C@@H](C1)C(O)=O Amb22751658 [0,0,0,1,1,0|2,0,0]=4 1398 B10R1.359 CC1(C)CN[C@H](C1)C(O)=O Amb24620405 [0,0,0,1,1,0|2,0,0]=4 1399 B10R1.359 CC1(C)NCC(N1)C(O)=O Amb25852540 [0,0,0,1,1,0|1,0,0]=3 1400 B10R1.359 CC1(C)NC[C@H](N1)C(O)=O Amb25047969 [0,0,0,1,1,0|1,0,0]=3 1401 B10R1.359 CC1(C)OC[C@@H](O1)C(O)=O Amb22745866 [0,0,0,1,1,0|2,0,0]=4 1402 B10R1.359 CC1(C)OC[C@H](O1)C(O)=O Amb24411495 [0,0,0,1,1,0|2,0,0]=4 1403 B10R1.359 CC1(C)SCC(S1)C(O)=O Amb25708424 [0,0,0,1,1,0|2,0,0]=4 1404 B10R1.359 CC1(F)CC(CC1)C(O)=O Amb25740509 [0,0,0,1,1,0|2,0,0]=4 1405 B10R1.359 CC1(O)CC(CC1)C(O)=O Amb23454111 [0,0,0,1,1,0|2,0,0]=4 1406 B10R1.359 C[N+]1(C)CC(CC1)C(O)=O Amb24533109 [0,0,0,1,1,0|2,0,0]=4 1407 B10R1.359 OC(=O)C1CCC(N1)(C)C Amb17593611 [0,0,0,1,1,0|2,0,0]=4 1408 B10R1.359 OC(=O)C1COC(O1)(C)C Amb10603493 [0,0,0,1,1,0|2,0,0]=4 1409 B10R1.359 OC(=O)C1CSC(N1)(C)C Amb1155998 [0,0,0,1,1,0|2,0,0]=4 1410 B10R1.359 OC(=O)C1CSC(N1)(C)C Amb2371339 [0,0,0,1,1,0|2,0,0]=4 1411 B10R1.359 OC(=O)[C@H]1CSC(N1)(C)C Amb2404830 [0,0,0,1,1,0|2,0,0]=4 1412 B10R1.361 CC(C)N1CCC1C(O)=O Amb22011881 [0,0,0,1,1,0|2,0,0]=4 1413 B10R1.361 CC(C)N1CC[C@@H]1C(O)=O Amb23399601 [0,0,0,1,1,0|2,0,0]=4 1414 B10R1.361 CC(C)N1CC[C@H]1C(O)=O Amb25113865 [0,0,0,1,1,0|2,0,0]=4 1415 B10R1.442 CC(C)C1(CC(O)=O)CC1 Amb18831636 [0,0,0,1,1,0|1,0,0]=3 1416 B10R1.442 CC(C)CC1(CC1)C(C)=O Amb18062204 [0,0,0,1,1,0|2,0,0]=4 1417 B10R1.442 CC(C)CC1(CC1)C(O)=O Amb18062327 [0,0,0,1,1,0|1,0,0]=3 1418 B10R1.442 CC(O)CC1(CC1)C(O)=O Amb25710245 [0,0,0,1,1,0|2,0,0]=4 1419 B10R1.442 CN(C)C1(CC(O)=O)CC1 Amb24405408 [0,0,0,1,1,0|2,0,0]=4 1420 B10R1.442 CN(CC1(CC1)C(=O)O)C Amb17334215 [0,0,0,1,1,0|2,0,0]=4 1421 B10R1.444 CC1(C)OC(=O)CC1C=O Amb24582965 [0,0,0,1,1,0|1,0,1]=4 1422 B10R1.444 CC1(C)OC(=O)N[C@H]1CO Amb25806619 [0,0,0,1,1,0|2,0,0]=4 1423 B10R1.444 CC[C@@H]1CC(=O)CC1(C)C Amb25838766 [0,0,0,1,1,0|2,0,0]=4 1424 B10R1.469 CCC(CC1CC1)C(O)=O Amb18831634 [0,0,0,1,1,0|1,0,0]=3 1425 B10R1.469 COC(CC1CC1)C(O)=O Amb25243296 [0,0,0,1,1,0|2,0,0]=4 1426 B10R1.469 N#CC(CC1CC1)C(O)=O Amb25216051 [0,0,0,1,1,0|0,0,2]=4 1427 B10R1.469 NCC(CC1CC1)C(O)=O Amb19021768 [0,0,0,1,1,0|0,0,0]=2 1428 B12R1.11 CC1CC(CBr)CN(C1)C(C)=O Amb24543123 [0,0,0,1,0,1|2,0,0]=4 1429 B12R1.11 CC1CC(CCl)CN(C1)C(C)=O Amb24543023 [0,0,0,1,0,1|2,0,0]=4 1430 B12R1.11 CC1CC(CN)CN(C1)C(C)=O Amb24587978 [0,0,0,1,0,1|1,0,0]=3 1431 B12R1.11 CC1CN(CC(CN)O1)C(N)=O Amb25334661 [0,0,0,1,0,1|2,0,0]=4 1432 B12R1.11 CCC1CC(Cl)CC(O1)C(O)=O Amb25054719 [0,0,0,1,0,1|2,0,0]=4 1433 B12R1.11 CC[C@H]1C[C@@H](Cl)C[C@H](O1)C(O)=O Amb25210890 [0,0,0,1,0,1|2,0,0]=4 1434 B12R1.11 CN1C[C@@H](C[C@H](C1)CO)C(O)=O Amb25338142 [0,0,0,1,0,1|2,0,0]=4 1435 B12R1.11 C[C@H]1C[C@H](N[C@@H](C1)CC)C(O)=O Amb25321035 [0,0,0,1,0,1|1,0,0]=3 1436 B12R1.46 CC1CC(C(CC1)C=C)C(O)=O Amb25804075 [0,0,0,1,0,1|1,0,1]=4 1437 B12R1.46 CC1C[C@@H]([C@@H](CC1)C=C)C(O)=O Amb25176124 [0,0,0,1,0,1|1,0,1]=4 1438 B12R1.65 CC1CC(CC)N(C1)CC(C)=O Amb24585574 [0,0,0,1,0,1|2,0,0]=4 1439 B12R1.226 CC(C)CCC1CC(=O)CCC1 Amb25152572 [0,0,0,1,0,1|2,0,0]=4 1440 B12R1.226 CC1CC(CCC(O)=O)C=CC1 Amb18126541 [0,0,0,1,0,1|1,0,1]=4 1441 B12R1.226 CC1CC(CCC1)CCC(N)=O Amb25159422 [0,0,0,1,0,1|2,0,0]=4 1442 B12R1.226 CC1CC(CCC1)OCC(N)=O Amb18802287 [0,0,0,1,0,1|2,0,0]=4 1443 B12R1.226 CC1CC(CCC1)SCC(N)=O Amb19071177 [0,0,0,1,0,1|2,0,0]=4 1444 B12R1.226 CC1CC(CCC1)SCC(O)=O Amb18995903 [0,0,0,1,0,1|1,0,0]=3 1445 B12R1.226 CC1CC(CCO1)NCC(O)=O Amb25298897 [0,0,0,1,0,1|2,0,0]=4 1446 B12R1.226 CC1CC(CSC1)OCC(O)=O Amb24411066 [0,0,0,1,0,1|1,0,0]=3 1447 B12R1.226 CC1CCCC(C1)COC(C)=O Amb24672316 [0,0,0,1,0,1|2,0,0]=4 1448 B12R1.226 CC1CCCC(C1)NCC(=O)N Amb1119501 [0,0,0,1,0,1|2,0,0]=4 1449 B12R1.226 CC1CCCC(C1)SCC(C)=O Amb19070411 [0,0,0,1,0,1|2,0,0]=4 1450 B12R1.226 CN1CC(CCC1)CCC(O)=O Amb22587003 [0,0,0,1,0,1|2,0,0]=4 1451 B12R1.226 CN1CC(CCC1)NCC(O)=O Amb22224827 [0,0,0,1,0,1|2,0,0]=4 1452 B12R1.226 CN1CCCC(C1)CCC(=O)O Amb10607786 [0,0,0,1,0,1|2,0,0]=4 1453 B12R1.226 CN1C[C@@H](CCC1)NCC(O)=O Amb22224743 [0,0,0,1,0,1|2,0,0]=4 1454 B12R1.226 CN1C[C@@H](CCC1)OCC(O)=O Amb22224744 [0,0,0,1,0,1|2,0,0]=4 1455 B12R1.226 CN1C[C@H](CCC1)NCC(O)=O Amb22224776 [0,0,0,1,0,1|2,0,0]=4 1456 B12R1.226 CN1C[C@H](CCC1)OCC(O)=O Amb22224777 [0,0,0,1,0,1|2,0,0]=4 1457 B12R1.226 C[C@@H]1CN(CCC1)CCC(O)=O Amb25669825 [0,0,0,1,0,1|2,0,0]=4 1458 B12R1.226 C[C@@H]1C[C@@H](CCC1)CCC(O)=O Amb25327813 [0,0,0,1,0,1|1,0,0]=3 1459 B12R1.226 C[C@@H]1C[C@H](CCC(O)=O)C=CC1 Amb25366392 [0,0,0,1,0,1|1,0,1]=4 1460 B12R1.226 NC1CC(CCC1)OCC(O)=O Amb25340337 [0,0,0,1,0,1|2,0,0]=4 1461 B12R1.226 OC(=O)COC1CCCC(F)C1 Amb25223337 [0,0,0,1,0,1|2,0,0]=4 1462 B12R1.226 OC1CCCC(C1)CCC(O)=O Amb25353026 [0,0,0,1,0,1|2,0,0]=4 1463 B12R1.233 CC1CC(C)N(CC(O)=O)CC1 Amb18960159 [0,0,0,1,0,1|2,0,0]=4 1464 B12R1.233 CC1CC(O)C(CC(O)=O)CC1 Amb18198275 [0,0,0,1,0,1|1,0,0]=3 1465 B12R1.233 CC1CN(C)C(CO1)CC(O)=O Amb25377306 [0,0,0,1,0,1|2,0,0]=4 1466 B12R1.233 CC1CN(C)CCC1CC(O)=O Amb24570830 [0,0,0,1,0,1|2,0,0]=4 1467 B12R1.233 CC1C[C@H](C)[C@@H](CC(O)=O)CC1 Amb24635630 [0,0,0,1,0,1|1,0,0]=3 1468 B12R1.233 CC=1CC(C)C(CC1)CC(O)=O Amb25110013 [0,0,0,1,0,1|1,0,1]=4 1469 B12R1.233 CN1CC(O)C(CC(O)=O)CC1 Amb18197972 [0,0,0,1,0,1|2,0,0]=4 1470 B12R1.233 C[C@@H]1C[C@H](Cl)[C@@H](CC(C)=O)CO1 Amb25173161 [0,0,0,1,0,1|2,0,0]=4 1471 B12R1.389 CC(C)=C1C[C@H](CC(O)=O)CC1 Amb25685329 [0,0,0,1,0,1|1,0,1]=4 1472 B12R1.389 CC(C)C1CN(CC(O)=O)CC1 Amb24469034 [0,0,0,1,0,1|2,0,0]=4 1473 B12R1.389 CC(C)CC1CN(CC1)C(C)=O Amb25099173 [0,0,0,1,0,1|2,0,0]=4 1474 B12R1.389 CC(C)CC1CN(CC1)C(N)=O Amb24387447 [0,0,0,1,0,1|2,0,0]=4 1475 B12R1.389 CC(C)CC1N[C@@H](CS1)C(O)=O Amb19060659 [0,0,0,1,0,1|2,0,0]=4 1476 B12R1.389 CC(C)CC1N[C@H](CS1)C(O)=O Amb25690549 [0,0,0,1,0,1|2,0,0]=4 1477 B12R1.389 CC(C)CN1CCC(C1)C(O)=O Amb18302804 [0,0,0,1,0,1|2,0,0]=4 1478 B12R1.389 CC(C)CN1CCC(C1)C(O)=O Amb20633731 [0,0,0,1,0,1|2,0,0]=4 1479 B12R1.389 CC(C)N1CCC(CC(N)=O)C1 Amb24584009 [0,0,0,1,0,1|2,0,0]=4 1480 B12R1.389 CC(C)N1CCC(CC(O)=O)C1 Amb18984418 [0,0,0,1,0,1|1,0,0]=3 1481 B12R1.389 CC(C)[C@H]1CCC(CC(C)=O)O1 Amb25371930 [0,0,0,1,0,1|2,0,0]=4 1482 B12R1.389 CC(C)[C@H]1CC[C@@H](CC(C)=O)N1 Amb24602871 [0,0,0,1,0,1|2,0,0]=4 1483 B12R1.389 CN(C)CC1CCC(O1)C(O)=O Amb18988025 [0,0,0,1,0,1|2,0,0]=4 1484 B12R1.593 CC1(C)SC(CN)N[C@H]1C(O)=O Amb25200023 [0,0,0,1,0,1|1,0,0]=3 1485 B12R1.593 CC1(C)SC(CO)NC1C(O)=O Amb24558623 [0,0,0,1,0,1|2,0,0]=4 1486 B12R1.684 CC(C)CC1(CN)CNC(=O)C1 Amb25800856 [0,0,0,1,0,1|1,0,0]=3 1487 B12R1.684 CC1CC(CN)(CC(C)=C)CC1 Amb25780809 [0,0,0,1,0,1|2,0,0]=4 1488 B12R1.684 CC1CCC(CN)(C1)CC(C)O Amb25827400 [0,0,0,1,0,1|1,0,1]=4 1489 B12R1.684 CNC1(CC(C)CC1)CC(O)=O Amb24441813 [0,0,0,1,0,1|2,0,0]=4 1490 B12R1.684 C[C@@H]1C[C@@](CN)(CC(O)=O)CC1 Amb25280195 [0,0,0,1,0,1|0,0,0]=2 1491 B12R1.861 CC(C)CCC1CC(=O)OC1=O Amb24591276 [0,0,0,1,0,1|1,0,1]=4 1492 B12R1.974 CC1C(CC(O)=O)CCC1(C)C Amb24355937 [0,0,0,1,0,1|1,0,0]=3 1493 B12R1.1020 CC1CCCC(CC(N)=O)CC1 Amb25152329 [0,0,0,1,0,1|2,0,0]=4 1494 B12R1.1020 CC1CCCC(CC(O)=O)CC1 Amb25150903 [0,0,0,1,0,1|1,0,0]=3 1495 B12R1.1020 CC1CCOC(CC(O)=O)CN1 Amb24439175 [0,0,0,1,0,1|2,0,0]=4 1496 B12R1.1020 CC1CNCC(CC(O)=O)OC1 Amb24725918 [0,0,0,1,0,1|0,0,0]=2 1497 B12R1.1020 CN1CCCC(CC(O)=O)CC1 Amb18198562 [0,0,0,1,0,1|2,0,0]=4 1498 B12R1.1806 CC1(C)CC(CO1)NCC(N)=O Amb24714828 [0,0,0,1,0,1|2,0,0]=4 1499 B12R1.1806 CC1(C)CC(CO1)NCC(O)=O Amb24698131 [0,0,0,1,0,1|1,0,0]=3 1500 B12R1.1806 CC1(C)CCC(CCC(O)=O)O1 Amb25840086 [0,0,0,1,0,1|2,0,0]=4 1501 B12R1.1806 CC1(C)CN(CCC(O)=O)CC1 Amb25339080 [0,0,0,1,0,1|2,0,0]=4 1502 B12R1.1806 CC1(C)COC(C1)CCC(O)=O Amb25342863 [0,0,0,1,0,1|2,0,0]=4 1503 B12R1.1806 CC1(C)OC(CO1)CCC(O)=O Amb20247170 [0,0,0,1,0,1|2,0,0]=4 1504 B12R1.1806 CC1(C)O[C@@H](CO1)CCC(O)=O Amb25279489 [0,0,0,1,0,1|2,0,0]=4 1505 B12R1.1806 CC1(C)O[C@H](CO1)CCC(O)=O Amb25074554 [0,0,0,1,0,1|2,0,0]=4 1506 B12R1.1819 CC(=O)CC1CCC(C)(C)CC1 Amb25323824 [0,0,0,1,0,1|2,0,0]=4 1507 B12R1.1819 CC(=O)CC1COC(C)(C)OC1 Amb25371831 [0,0,0,1,0,1|2,0,0]=4 1508 B12R1.1819 CC(=O)C[C@@H]1COC(C)(C)CC1 Amb25358944 [0,0,0,1,0,1|2,0,0]=4 1509 B12R1.1819 CC1(C)CCC(CC(N)=O)CC1 Amb24635664 [0,0,0,1,0,1|2,0,0]=4 1510 B12R1.1819 CC1(C)CCC(CC(O)=O)CC1 Amb18198842 [0,0,0,1,0,1|1,0,0]=3 1511 B12R1.1819 CC1(C)CCN(CC(O)=O)CC1 Amb18966125 [0,0,0,1,0,1|2,0,0]=4 1512 B12R1.1819 CC1(C)CO[C@@H](CN1)CC(O)=O Amb22747814 [0,0,0,1,0,1|0,0,0]=2 1513 B12R1.1819 CC1(F)CCC(CC(O)=O)CC1 Amb25311513 [0,0,0,1,0,1|2,0,0]=4 1514 B12R1.1819 CC1(O)CCC(CC(O)=O)CC1 Amb21520460 [0,0,0,1,0,1|2,0,0]=4 1515 B12R1.1819 C[C@]1(O)CC[C@@H](CC(O)=O)CC1 Amb25061298 [0,0,0,1,0,1|2,0,0]=4 1516 B12R1.3867 CC1(C)CCC1(CN)CC(O)=O Amb25779372 [0,0,0,1,0,1|0,0,0]=2 1517 B12R1.3867 CC1(C)CC[C@@]1(CN)CC(O)=O Amb25108103 [0,0,0,1,0,1|0,0,0]=2 1518 B12R1.127 CC1CC(CC(O)=O)C(=O)CC1 Amb18647358 [0,1,0,1,0,0|1,0,1]=4 1519 B12R1.127 CC1CC(CC(O)=O)C(C)CC1 Amb25793973 [0,1,0,1,0,0|1,0,0]=3 1520 B12R1.127 CC1CC(CC(O)=O)C(N)CC1 Amb25210909 [0,1,0,1,0,0|0,0,0]=2 1521 B12R1.127 CC1CCC(O)C(C1)CC(O)=O Amb18198283 [0,1,0,1,0,0|1,0,0]=3 1522 B12R1.127 CC1CN(CC(O)=O)C(C)CC1 Amb25059028 [0,1,0,1,0,0|2,0,0]=4 1523 B12R1.127 CC=1CC(CC(O)=O)C(O)CC1 Amb25828430 [0,1,0,1,0,0|1,0,1]=4 1524 B12R1.127 CN1CCC(O)C(CC(O)=O)C1 Amb18197942 [0,1,0,1,0,0|2,0,0]=4 1525 B12R1.213 CC(C)CC1C(OC1=O)C(O)=O Amb24734945 [0,1,0,1,0,0|1,0,1]=4 1526 B12R1.844 CC1CC(C)(C)CC1CC(O)=O Amb24582393 [0,1,0,1,0,0|1,0,0]=3 1527 B12R1.844 CC1OC(C)(C)OC1CC(O)=O Amb24705735 [0,1,0,1,0,0|2,0,0]=4 1528 B12R1.844 C[C@H]1OC(C)(C)O[C@@H]1CC(O)=O Amb24519748 [0,1,0,1,0,0|2,0,0]=4 1529 B12R1.844 N[C@@H]1CS(=O)(=O)C[C@H]1CC(O)=O Amb24612349 [0,1,0,1,0,0|2,0,0]=4 1530 B12R1.850 CC(=C)[C@H]1CC(C)C[C@H]1C(O)=O Amb25326656 [0,1,0,1,0,0|1,0,1]=4 1531 B12R1.850 CC1CC(C(C1)C(O)=O)C(O)=O Amb25246178 [0,1,0,1,0,0|1,0,1]=4 1532 B12R1.850 CC1C[C@@H]([C@@H](C1)C(O)=O)C(N)=O Amb25142220 [0,1,0,1,0,0|0,0,1]=3 1533 B12R1.1043 CC1CC(C1)(CC(O)=O)C(C)N Amb25121757 [0,1,0,1,0,0|0,0,0]=2 1534 B12R1.1043 CC1CC(C1)(CC(O)=O)N(C)C Amb25223020 [0,1,0,1,0,0|2,0,0]=4 1535 B12R1.1219 CC(C)C1CC(C)COC(=O)C1 Amb24488772 [0,1,0,1,0,0|1,0,0]=3 1536 B12R1.1383 CC(C)[C@@H]1[C@H]([C@H]1C(O)=O)C(O)=O Amb24390257 [0,1,0,1,0,0|1,0,1]=4 1537 B12R1.1822 CC(C)CC1C(C(O)=O)C1(C)C Amb25111180 [0,1,0,1,0,0|1,0,0]=3 1538 B12R1.1822 CC(O)C[C@H]1[C@@H](C(O)=O)C1(C)C Amb25210434 [0,1,0,1,0,0|2,0,0]=4 1539 B12R1.1822 C[C@H](O)C[C@H]1[C@@H](C(O)=O)C1(C)C Amb25176126 [0,1,0,1,0,0|2,0,0]=4 1540 B12R1.1833 CC1(C)CC1(CC(O)=O)C(C)C Amb25179933 [0,1,0,1,0,0|1,0,0]=3 1541 B12R1.3005 CC(C)C1CC(C)(C)OC(=O)N1 Amb25250634 [0,1,0,1,0,0|2,0,0]=4 1542 B12R1.3101 CC1(C)C[C@@H]([C@@H]1C(O)=O)C(O)=O Amb25176100 [0,1,0,1,0,0|1,0,1]=4 1543 B12R1.3101 CC1(C)C[C@H]([C@@H]1C(O)=O)C(O)=O Amb25232609 [0,1,0,1,0,0|1,0,1]=4 1544 B12R1.42 CC1(C)CC(CC=C)CC(=O)C1 Amb25140676 [0,1,0,1,0,0|2,0,0]=4 1545 B12R1.101 CC(=O)CC1CC(C)CC(C)C1 Amb25693573 [0,1,0,1,0,0|2,0,0]=4 1546 B12R1.101 CC(C)CC1CC(=O)CC(C)N1 Amb25800152 [0,1,0,1,0,0|2,0,0]=4 1547 B12R1.101 CC(C)CC1CC(=O)NC(=O)C1 Amb20669161 [0,1,0,1,0,0|2,0,0]=4 1548 B12R1.101 CC(C)CC1CC(=O)OC(=O)C1 Amb22728839 [0,1,0,1,0,0|1,0,0]=3 1549 B12R1.101 CC(C)CN1CC(=O)OC(=O)C1 Amb25063942 [0,1,0,1,0,0|2,0,0]=4 1550 B12R1.101 CC(CC1CC(=O)NC(=N1)N)C Amb16733720 [0,1,0,1,0,0|1,0,1]=4 1551 B12R1.101 CC1CC(C)CN(C1)CC(=O)O Amb10072974 [0,1,0,1,0,0|2,0,0]=4 1552 B12R1.101 CC1CC(CC(N)=O)CC(C)C1 Amb25152327 [0,1,0,1,0,0|2,0,0]=4 1553 B12R1.101 CC1CC(CC(O)=O)CC(C)N1 Amb24565830 [0,1,0,1,0,0|2,0,0]=4 1554 B12R1.101 CC1CC(CC(O1)C)CC(=O)O Amb16230687 [0,1,0,1,0,0|2,0,0]=4 1555 B12R1.101 CC1CC(O)CC(CC(O)=O)O1 Amb25350388 [0,1,0,1,0,0|2,0,0]=4 1556 B12R1.101 CC=1CC(CC(C)C)CC(=O)C1 Amb25667610 [0,1,0,1,0,0|2,0,0]=4 1557 B12R1.101 C[C@@H]1CC(CC(O)=O)C[C@@H](C)O1 Amb24550129 [0,1,0,1,0,0|2,0,0]=4 1558 B12R1.101 C[C@@H]1CC(CC(O)=O)C[C@H](C)O1 Amb24571705 [0,1,0,1,0,0|2,0,0]=4 1559 B12R1.101 C[C@@H]1C[C@@H](O)C[C@@H](CC(O)=O)O1 Amb25322179 [0,1,0,1,0,0|2,0,0]=4 1560 B12R1.101 C[C@@H]1C[C@H](CC(O)=O)C[C@H](C)O1 Amb24692797 [0,1,0,1,0,0|2,0,0]=4 1561 B12R1.101 C[C@@H]1C[C@H](O)CN(C1)CC(O)=O Amb25250969 [0,1,0,1,0,0|2,0,0]=4 1562 B12R1.101 C[C@@H]1C[C@H](O)C[C@@H](CC(O)=O)O1 Amb24677809 [0,1,0,1,0,0|2,0,0]=4 1563 B12R1.101 C[C@H]1C[C@H](CC(O)=O)C[C@@H](C)O1 Amb24470080 [0,1,0,1,0,0|2,0,0]=4 1564 B12R1.276 CC(C)[C@H]1OC(=O)N[C@@H]1CC=C Amb25346242 [0,1,0,1,0,0|2,0,0]=4 1565 B12R1.276 CC(O)C1OC(=O)CC1SCC Amb25856398 [0,1,0,1,0,0|2,0,0]=4 1566 B12R1.276 C[C@H](O)[C@@H]1OC(=O)CC1SCC Amb24629796 [0,1,0,1,0,0|2,0,0]=4 1567 B12R1.276 NCCN1CC(O)CC1C(O)=O Amb24367136 [0,1,0,1,0,0|2,0,0]=4 1568 B12R1.392 CC(=C)C1CNCC1CC(O)=O Amb24724611 [0,1,0,1,0,0|0,0,2]=4 1569 B12R1.392 CC(=O)C1CNCC1CC(O)=O Amb25674207 [0,1,0,1,0,0|1,0,1]=4 1570 B12R1.392 CC(C)C1CCCN1CC(O)=O Amb25261633 [0,1,0,1,0,0|2,0,0]=4 1571 B12R1.392 CC(C)C1SCCC1CC(O)=O Amb18820673 [0,1,0,1,0,0|1,0,0]=3 1572 B12R1.392 CC(C)CC1CCCC1C(O)=O Amb24668437 [0,1,0,1,0,0|1,0,0]=3 1573 B12R1.392 CC(C)CC1CNCC1C(O)=O Amb18198569 [0,1,0,1,0,0|0,0,0]=2 1574 B12R1.392 CC(C)CC1NCCC1C(O)=O Amb18117795 [0,1,0,1,0,0|1,0,0]=3 1575 B12R1.392 CC(C)CN1CCCC1C(O)=O Amb22585666 [0,1,0,1,0,0|2,0,0]=4 1576 B12R1.392 CC(C)CN1CCC[C@@H]1C(O)=O Amb23401416 [0,1,0,1,0,0|2,0,0]=4 1577 B12R1.392 CC(C)CN1CCC[C@@H]1C(O)=O Amb25712617 [0,1,0,1,0,0|2,0,0]=4 1578 B12R1.392 CC(C)CN1CCC[C@H]1C(O)=O Amb24474120 [0,1,0,1,0,0|2,0,0]=4 1579 B12R1.392 CC(C)CN1CCC[C@H]1C(O)=O Amb25281207 [0,1,0,1,0,0|2,0,0]=4 1580 B12R1.392 CC(C)N1CCCC1CC(O)=O Amb18977157 [0,1,0,1,0,0|2,0,0]=4 1581 B12R1.392 CC(C)N1CCCC1CC(O)=O Amb20622922 [0,1,0,1,0,0|2,0,0]=4 1582 B12R1.392 CC(C)NC1COCC1C(O)=O Amb24342013 [0,1,0,1,0,0|2,0,0]=4 1583 B12R1.392 CC(C)SC1CCCC1C(O)=O Amb19002581 [0,1,0,1,0,0|2,0,0]=4 1584 B12R1.392 CC(C)[C@@H]1CNC[C@H]1NC(C)=O Amb25337806 [0,1,0,1,0,0|2,0,0]=4 1585 B12R1.392 CC(C)[C@@H]1COC[C@H]1CC(C)=O Amb24662407 [0,1,0,1,0,0|2,0,0]=4 1586 B12R1.392 CC(C)[C@H]1CNC[C@H]1CC(O)=O Amb25288138 [0,1,0,1,0,0|0,0,0]=2 1587 B12R1.392 CC(CN1CCCC1C(=O)O)C Amb2372387 [0,1,0,1,0,0|2,0,0]=4 1588 B12R1.392 CN(C)C1CCCC1CC(O)=O Amb18198574 [0,1,0,1,0,0|2,0,0]=4 1589 B12R1.392 CN(C)CC1CCNC1C(N)=O Amb25139426 [0,1,0,1,0,0|2,0,0]=4 1590 B12R1.874 CC(C)CC1CC(=O)CCCC1 Amb25152530 [0,1,0,1,0,0|2,0,0]=4 1591 B12R1.874 CC(C)CC1CC(=O)NCCN1 Amb18825565 [0,1,0,1,0,0|2,0,0]=4 1592 B12R1.874 CC1CN(CC(O)=O)CCCO1 Amb18966355 [0,1,0,1,0,0|2,0,0]=4 1593 B12R1.874 CC1COCCN(C1)CC(O)=O Amb25291542 [0,1,0,1,0,0|2,0,0]=4 1594 B12R1.1006 CC1(C)CN(CC1N)CC(N)=O Amb25211440 [0,1,0,1,0,0|2,0,0]=4 1595 B12R1.1006 CC1(C)CN(CC1O)CC(O)=O Amb25184965 [0,1,0,1,0,0|2,0,0]=4 1596 B12R1.1006 CC1CC(CC(N)=O)CC1(C)C Amb25053290 [0,1,0,1,0,0|2,0,0]=4 1597 B12R1.1157 CC1CC(CC(=O)CC1)CC=C Amb25066369 [0,1,0,1,0,0|2,0,0]=4 1598 B12R1.1157 CC1CCC(=O)CC(C1)CCC Amb24614799 [0,1,0,1,0,0|2,0,0]=4 1599 B12R1.1821 CC(=O)CC1CC(C)(C)CCN1 Amb25858115 [0,1,0,1,0,0|2,0,0]=4 1600 B12R1.1821 CC1(C)CC(CC(N)=O)CCO1 Amb24379590 [0,1,0,1,0,0|2,0,0]=4 1601 B12R1.1821 CC1(C)CC(CC(O)=O)CCC1 Amb18198841 [0,1,0,1,0,0|1,0,0]=3 1602 B12R1.1821 CC1(C)CC(CC(O)=O)CCN1 Amb24455821 [0,1,0,1,0,0|0,0,0]=2 1603 B12R1.1821 CC1(C)CC(CC(O)=O)CCS1 Amb18820663 [0,1,0,1,0,0|1,0,0]=3 1604 B12R1.1821 CC1(C)CC(CC(O)=O)SCC1 Amb25360954 [0,1,0,1,0,0|1,0,0]=3 1605 B12R1.1821 CC1(C)CC(CC=C1)CC(O)=O Amb18647042 [0,1,0,1,0,0|1,0,0]=3 1606 B12R1.1821 CC1(C)CCSC(CC(O)=O)N1 Amb25783878 [0,1,0,1,0,0|2,0,0]=4 1607 B12R1.1821 CC1(C)CN(CC(O)=O)CCS1 Amb25282033 [0,1,0,1,0,0|2,0,0]=4 1608 B12R1.1821 OC(=O)CC1CCOC(C1)(C)C Amb17594313 [0,1,0,1,0,0|1,0,0]=3 1609 B12R1.19 CC1CC(CC(O)=O)C=CC1C Amb25111125 [0,1,0,1,0,0|1,0,1]=4 1610 B12R1.19 CC1CC(CC(O)=O)CCN1C Amb18198572 [0,1,0,1,0,0|1,0,0]=3 1611 B12R1.19 CC1CCC(CC1C)CC(C)=O Amb25716256 [0,1,0,1,0,0|2,0,0]=4 1612 B12R1.19 CC1CCN(CC1C)CC(O)=O Amb25214367 [0,1,0,1,0,0|2,0,0]=4 1613 B12R1.19 CC1CN(CCC1O)CC(O)=O Amb24435826 [0,1,0,1,0,0|2,0,0]=4 1614 B12R1.19 CN1CCN(CC1C)CC(O)=O Amb21861267 [0,1,0,1,0,0|2,0,0]=4 1615 B12R1.50 CC(CC1CC(=O)CCC1)CC Amb25825698 [0,1,0,1,0,0|2,0,0]=4 1616 B12R1.50 CC(CC1CNCC(=O)N1)CC Amb25159371 [0,1,0,1,0,0|2,0,0]=4 1617 B12R1.50 CC1CC(CC(=O)C=C)CCC1 Amb24358564 [0,1,0,1,0,0|2,0,0]=4 1618 B12R1.50 CC1CC(CC(=O)NO)CCC1 Amb25725181 [0,1,0,1,0,0|1,0,0]=3 1619 B12R1.50 CC1CC(CC(=O)OC)CCN1 Amb24432151 [0,1,0,1,0,0|2,0,0]=4 1620 B12R1.50 CC1CC(CC(N)=NO)CCC1 Amb25142771 [0,1,0,1,0,0|2,0,0]=4 1621 B12R1.50 CC1CC(CCC1)CC(O)C=O Amb25205232 [0,1,0,1,0,0|1,0,1]=4 1622 B12R1.50 CC1CC(CCC1)NC(=O)CO Amb24430759 [0,1,0,1,0,0|2,0,0]=4 1623 B12R1.50 CC1CC(CNC1)NC(=O)OC Amb25238584 [0,1,0,1,0,0|1,0,0]=3 1624 B12R1.50 CC1CCCC(C1)CC(=O)CC Amb24438774 [0,1,0,1,0,0|2,0,0]=4 1625 B12R1.50 COC(=O)CC1CCCC(N)C1 Amb25799610 [0,1,0,1,0,0|2,0,0]=4 1626 B12R1.50 COC(=O)CN1C[C@@H](C)CCC1 Amb24343611 [0,1,0,1,0,0|2,0,0]=4 1627 B12R1.50 COC(=O)C[C@H]1CCC[C@@H](O)C1 Amb25176862 [0,1,0,1,0,0|2,0,0]=4 1628 B12R1.50 COC(=O)\C=C/1\CNCC(C)C1 Amb24331911 [0,1,0,1,0,0|0,0,2]=4 1629 B12R1.50 C[C@@H]1CCC[C@H](CC(=O)OC)N1 Amb25195855 [0,1,0,1,0,0|2,0,0]=4 1630 B12R1.50 C[C@H](C[C@H]1CNCC(=O)N1)CC Amb24561615 [0,1,0,1,0,0|2,0,0]=4 1631 B12R1.50 C[C@H]1CCC[C@@H](C1)NC(=O)OC Amb25254205 [0,1,0,1,0,0|2,0,0]=4 1632 B12R1.57 CC(C)[C@H]1CCC(=O)C[C@H]1CC Amb25179724 [0,1,0,1,0,0|2,0,0]=4 1633 B12R1.57 CC1CCC(C(C1)SC)C(O)=O Amb19047212 [0,1,0,1,0,0|2,0,0]=4 1634 B12R1.438 CC(=O)CC1CCCC(CN)C1 Amb25786547 [0,1,0,1,0,0|2,0,0]=4 1635 B12R1.438 CC(C)CC1CC(CCC1)=NO Amb24381271 [0,1,0,1,0,0|2,0,0]=4 1636 B12R1.438 CCC1CC(CC(O)=O)CCC1 Amb24502105 [0,1,0,1,0,0|1,0,0]=3 1637 B12R1.438 CCC1CC(CC(O)=O)NCC1 Amb18825410 [0,1,0,1,0,0|2,0,0]=4 1638 B12R1.438 CCC1CC(CCN1)CC(O)=O Amb18825411 [0,1,0,1,0,0|2,0,0]=4 1639 B12R1.438 CCC1CC(CNC1)CC(O)=O Amb24596396 [0,1,0,1,0,0|0,0,0]=2 1640 B12R1.438 CCC1CNCC(CC(O)=O)O1 Amb24387178 [0,1,0,1,0,0|1,0,0]=3 1641 B12R1.438 CCN1CC(CC(O)=O)CCC1 Amb18300084 [0,1,0,1,0,0|2,0,0]=4 1642 B12R1.438 CNC1CN(CC(O)=O)CCC1 Amb18992718 [0,1,0,1,0,0|2,0,0]=4 1643 B12R1.438 COC1CC(CC(O)=O)CCC1 Amb18647668 [0,1,0,1,0,0|1,0,0]=3 1644 B12R1.438 COC1CN(CC(O)=O)CCC1 Amb21865574 [0,1,0,1,0,0|2,0,0]=4 1645 B12R1.438 N#CC1CC(CC(O)=O)CCC1 Amb18827225 [0,1,0,1,0,0|1,0,1]=4 1646 B12R1.438 NCC1CC(CC(O)=O)CCC1 Amb18647520 [0,1,0,1,0,0|1,0,0]=3 1647 B12R1.438 NCC1CCCC(CC(O)=O)O1 Amb18197930 [0,1,0,1,0,0|2,0,0]=4 1648 B12R1.438 NCC1CN(CC(O)=O)CCC1 Amb18294011 [0,1,0,1,0,0|2,0,0]=4 1649 B12R1.438 OC(=O)CN1CC(CBr)CCC1 Amb21860457 [0,1,0,1,0,0|2,0,0]=4 1650 B12R1.438 OC(=O)CN1CC(CCl)CCC1 Amb21860353 [0,1,0,1,0,0|2,0,0]=4 1651 B12R1.438 OC(=O)CN1CC(CI)CCC1 Amb21860482 [0,1,0,1,0,0|2,0,0]=4 1652 B12R1.532 CC1CC(C)N(C1)CC(=O)OC Amb25363034 [0,1,0,1,0,0|2,0,0]=4 1653 B12R1.609 CN1[C@@H]([C@@H](CN)CC1=O)C(O)=O Amb18825372 [0,1,0,1,0,0|1,0,1]=4 1654 B12R1.1276 CC(C)C[C@@H]1NC(=O)[C@@H](C)[C@@H]1N Amb25210421 [0,1,0,1,0,0|2,0,0]=4 1655 B12R1.1276 CC1C(CC(O)=O)OC(C)C1O Amb25276481 [0,1,0,1,0,0|2,0,0]=4 1656 B12R1.1276 CC1C(N)C(CC(O)=O)CN1C Amb18825352 [0,1,0,1,0,0|1,0,0]=3 1657 B12R1.1276 CC1CC(CC(O)=O)C(=O)N1C Amb24484304 [0,1,0,1,0,0|1,0,1]=4 1658 B12R1.1276 CC1CN(CC(O)=O)C(C)C1C Amb24764224 [0,1,0,1,0,0|2,0,0]=4 1659 B12R1.1276 C[C@@H]1C(CC(O)=O)OC(C)[C@H]1O Amb24550569 [0,1,0,1,0,0|2,0,0]=4 1660 B12R1.1673 CC1(C)CC(CC1)NC(=O)CO Amb25787982 [0,1,0,1,0,0|2,0,0]=4 1661 B12R1.1673 COC(=O)CN1CC(C)(C)CC1 Amb24356311 [0,1,0,1,0,0|2,0,0]=4 1662 B12R1.1673 COC(=O)C[C@@H]1COC(C)(C)O1 Amb22735816 [0,1,0,1,0,0|2,0,0]=4 1663 B12R1.1673 COC(=O)C[C@H]1COC(O1)(C)C Amb16226983 [0,1,0,1,0,0|2,0,0]=4 1664 B12R1.1673 COC(=O)NC1COC(C)(C)C1 Amb24573413 [0,1,0,1,0,0|2,0,0]=4 1665 B12R1.1926 CC(CO)C1OC(=O)N[C@@H]1CO Amb24682749 [0,1,0,1,0,0|2,0,0]=4 1666 B12R1.1926 CC1CC(CO)N(C1)C(=O)OC Amb25343612 [0,1,0,1,0,0|2,0,0]=4 1667 B12R1.1926 COC(=O)C1CC(O)CC1CCl Amb25695310 [0,1,0,1,0,0|2,0,0]=4 1668 B12R1.1926 COC(=O)[C@H]1C[C@@H](O)C[C@H]1CCl Amb24519987 [0,1,0,1,0,0|2,0,0]=4 1669 B12R1.1986 CCC1CC(=O)NCC(C)(C)C1 Amb25709619 [0,1,0,1,0,0|2,0,0]=4 1670 B12R1.3851 C[C@@H]1C[C@](CN)(CC(O)=O)[C@H]1C Amb24557818 [0,1,0,1,0,0|0,0,0]=2 1671 B12R1.3851 C[C@H]1C[C@](CN)(CC(O)=O)[C@H]1C Amb25363239 [0,1,0,1,0,0|0,0,0]=2 1672 B12R1.3855 CCC1(C)CN(CC(O)=O)CC1 Amb24673309 [0,1,0,1,0,0|2,0,0]=4 1673 B12R1.224 CC(C)CC1CNCC(=O)N1C Amb24497435 [0,1,0,1,0,0|2,0,0]=4 1674 B12R1.224 CC1CCCC(CC(O)=O)C1=O Amb24635682 [0,1,0,1,0,0|1,0,1]=4 1675 B12R1.224 CC1CCCC(CC(O)=O)C1C Amb25087666 [0,1,0,1,0,0|1,0,0]=3 1676 B12R1.224 CC1CCCN(CC(O)=O)C1C Amb18960401 [0,1,0,1,0,0|2,0,0]=4 1677 B12R1.225 CC(C)C(C)C1CC(=O)CCC1 Amb24383449 [0,1,0,1,0,0|2,0,0]=4 1678 B12R1.225 CC(C1CN(C)CCC1)C(O)=O Amb18198563 [0,1,0,1,0,0|2,0,0]=4 1679 B12R1.225 CC1CC(CCC1)C(=O)C(O)=O Amb24618215 [0,1,0,1,0,0|1,0,1]=4 1680 B12R1.225 CC1CC(CCC1)C(N)C(O)=O Amb24271219 [0,1,0,1,0,0|1,0,0]=3 1681 B12R1.225 CC1CC(CCC1)C(O)C(N)=O Amb25309360 [0,1,0,1,0,0|2,0,0]=4 1682 B12R1.225 CC1CC(CCC1)C(O)C(O)=O Amb24715447 [0,1,0,1,0,0|1,0,0]=3 1683 B12R1.225 CC1CC(CCO1)C(O)C(O)=O Amb24673984 [0,1,0,1,0,0|2,0,0]=4 1684 B12R1.225 CN1CC(CCC1)C(F)C(O)=O Amb25074939 [0,1,0,1,0,0|2,0,0]=4 1685 B12R1.225 CN1CC(CCC1)C(N)C(O)=O Amb18825355 [0,1,0,1,0,0|2,0,0]=4 1686 B12R1.225 C[C@@H]1CN(CCC1)C(C)C(O)=O Amb25072255 [0,1,0,1,0,0|2,0,0]=4 1687 B12R1.225 NC(C1CC(O)CCC1)C(O)=O Amb25206426 [0,1,0,1,0,0|2,0,0]=4 1688 B12R1.592 CC1(C)OC(C(CN)O1)C(O)=O Amb24571745 [0,1,0,1,0,0|1,0,0]=3 1689 B12R1.592 CC1(C)O[C@H]([C@@H](CO)O1)C(O)=O Amb24580350 [0,1,0,1,0,0|2,0,0]=4 1690 B12R1.592 CC1(C)O[C@H]([C@H](CN)O1)C(O)=O Amb25201018 [0,1,0,1,0,0|1,0,0]=3 1691 B12R1.766 CC(C)[C@H]1OC(=O)N(C)[C@H]1CO Amb24641866 [0,1,0,1,0,0|2,0,0]=4 1692 B12R1.766 CC1CC(C(CC)C1=O)C(O)=O Amb24711511 [0,1,0,1,0,0|1,0,1]=4 1693 B12R1.854 CC(C)CC1C(C)C(=O)NC1C Amb24581472 [0,1,0,1,0,0|2,0,0]=4 1694 B12R1.864 CC(C)C(C)C1CC(=O)NC1C Amb25345298 [0,1,0,1,0,0|2,0,0]=4 1695 B12R1.864 CC(C1CC(C)OC1C)C(O)=O Amb25235107 [0,1,0,1,0,0|2,0,0]=4 1696 B12R1.864 CC1CC(C(F)C(O)=O)C(C)O1 Amb24536470 [0,1,0,1,0,0|2,0,0]=4 1697 B12R1.864 CC1OC(C)CC1C(O)C(O)=O Amb25214056 [0,1,0,1,0,0|2,0,0]=4 1698 B12R1.1382 CC(C)C(=O)C1CCC1C(O)=O Amb24391607 [0,1,0,1,0,0|1,0,1]=4 1699 B12R1.1382 CC(C)C(C)C1CCC1C(O)=O Amb24501585 [0,1,0,1,0,0|1,0,0]=3 1700 B12R1.1382 CC(C)N(C)C1CCC1C(O)=O Amb25039296 [0,1,0,1,0,0|2,0,0]=4 1701 B12R1.1815 CC(C)CC1CCC1(N)C(O)=O Amb23456078 [0,1,0,1,0,0|1,0,0]=3 1702 B12R1.2203 CC(C1CC(C)(C)CC1)C(O)=O Amb25103995 [0,1,0,1,0,0|1,0,0]=3 1703 B12R1.2203 CC1(C)CC(CC1)C(O)C(O)=O Amb24487543 [0,1,0,1,0,0|1,0,0]=3 1704 B12R1.2203 CC1(C)CC(CO1)C(O)C(O)=O Amb24597286 [0,1,0,1,0,0|1,0,0]=3 1705 B12R1.2203 CC1(C)OC[C@@H](O1)[C@H](O)C(O)=O Amb25176139 [0,1,0,1,0,0|2,0,0]=4 1706 B12R1.2203 CC1(C)OC[C@H](O1)[C@@H](O)C(O)=O Amb25175694 [0,1,0,1,0,0|2,0,0]=4 1707 B12R1.857 CC(C)CC1(C)CC(=O)NC1C Amb25083692 [0,1,0,1,0,0|2,0,0]=4 1708 B12R1.1257 CC(C)CC1(C)CC(=O)CCC1 Amb24364173 [0,1,0,1,0,0|2,0,0]=4 1709 B12R1.1257 CC(C)C[C@@]1(C)CC(=O)CCC1 Amb25093700 [0,1,0,1,0,0|2,0,0]=4 1710 B12R1.1257 CC(C)C[C@]1(C)CC(=O)CCC1 Amb25128960 [0,1,0,1,0,0|2,0,0]=4 1711 B12R1.1257 CC1CC(N)(CC(O)=O)CCO1 Amb25284723 [0,1,0,1,0,0|2,0,0]=4 1712 B12R1.1257 CN1CC(O)(CC(O)=O)CCC1 Amb18197977 [0,1,0,1,0,0|2,0,0]=4 1713 B12R1.1257 C[C@@H]1CC=C[C@@](C)(C1)CC(O)=O Amb24626644 [0,1,0,1,0,0|1,0,1]=4 1714 B12R1.1831 CC1(C)CC(O)(CO1)CC(O)=O Amb25228643 [0,1,0,1,0,0|1,0,0]=3 1715 B12R1.1831 CC1(C)CCC(C)(CC(O)=O)N1 Amb18647508 [0,1,0,1,0,0|2,0,0]=4 1716 B12R1.2417 CC(C)C1CC(=O)CC1(C)CC Amb25282708 [0,1,0,1,0,0|2,0,0]=4 1717 B12R1.2417 CC(C)[C@@H]1CC(=O)C[C@@]1(C)CC Amb24576036 [0,1,0,1,0,0|2,0,0]=4 1718 B12R1.3896 CC1(C)CC(C1)(CC(O)=O)NC Amb25216739 [0,1,0,1,0,0|2,0,0]=4 1719 B12R1.4126 CC1(C)CC(=O)CC(C)(C1)CN Amb25667226 [0,1,0,1,0,0|1,0,0]=3 1720 B12R1.4126 CC1(C)CC(=O)CC(C)(C1)CO Amb24524908 [0,1,0,1,0,0|2,0,0]=4 1721 B12R1.67 CC(C)(C)C1OC(=O)NC1CCl Amb25695878 [0,1,0,1,0,0|2,0,0]=4 1722 B12R1.67 CC(C)(C)C1OC(=O)NC1CO Amb24495968 [0,1,0,1,0,0|2,0,0]=4 1723 B12R1.86 NC[C@@H]1[C@@H]([C@H]1C(F)(F)F)C(O)=O Amb19148382 [0,1,0,1,0,0|2,0,0]=4 1724 B12R1.119 CC(C)(C)CC1CC(=O)CCC1 Amb25667366 [0,1,0,1,0,0|2,0,0]=4 1725 B12R1.119 CC(C)(C)OC1CNNC(=O)C1 Amb24525870 [0,1,0,1,0,0|2,0,0]=4 1726 B12R1.2440 CC(C)(C)SC1(CN)CC(=O)C1 Amb25667104 [0,1,0,1,0,0|2,0,0]=4 1727 B12R1.3796 N[C@@H]1[C@H](CC(O)=O)[C@@H]1C(F)(F)F Amb19375200 [0,1,0,1,0,0|2,0,0]=4 1728 B12R1.3796 N[C@@H]1[C@H](CC(O)=O)[C@H]1C(F)(F)F Amb19375201 [0,1,0,1,0,0|2,0,0]=4 1729 B12R1.3796 N[C@H]1[C@@H](CC(O)=O)[C@@H]1C(F)(F)F Amb25267165 [0,1,0,1,0,0|2,0,0]=4 1730 B12R2.544 O=S1(=O)CC2CNCC(C1)C2 Amb25313861 [0,0,0,2,0,0|1,0,1]=4 1731 B12R2.998 CC1(C)CC2CC(=O)N1CC2 Amb24526879 [0,0,0,2,0,0|2,0,0]=4 1732 B12R2.998 CC1(C)C[C@@H]2CN[C@H]1C(=O)O2 Amb25234097 [0,0,0,2,0,0|2,0,0]=4 1733 B12R2.1153 CC12CC(CC(=O)C1)CCC2 Amb25718297 [0,0,0,2,0,0|2,0,0]=4 1734 B12R2.3710 CCC1CC2(C)CC1C(=O)C2 Amb24602935 [0,0,0,2,0,0|2,0,0]=4 1735 B12R2.6426 CC1(C)CC(=O)CC2(C1)CC2 Amb24602980 [0,0,0,2,0,0|2,0,0]=4 1736 B12R2.202 CC1CNCC2NC(=O)OC21 Amb24484568 [0,0,0,2,0,0|1,0,0]=3 1737 B12R2.202 O=C1C[C@@H]2CCCC(Br)[C@@H]2O1 Amb24680289 [0,0,0,2,0,0|2,0,0]=4 1738 B12R2.202 O=C1C[C@H]2COC[C@H](I)[C@H]2O1 Amb25175908 [0,0,0,2,0,0|2,0,0]=4 1739 B12R2.202 O=C1OCC[C@H]2C[C@H](Cl)C[C@@H]12 Amb25339762 [0,0,0,2,0,0|2,0,0]=4 1740 B12R2.202 OC1CCC[C@@H]2CC(=O)O[C@@H]21 Amb25332298 [0,0,0,2,0,0|2,0,0]=4 1741 B12R2.202 O[C@H]1CCC[C@@H]2CC(=O)O[C@H]21 Amb24640278 [0,0,0,2,0,0|2,0,0]=4 1742 B12R2.1129 CN1CC2CCC1C2C(O)=O Amb24753928 [0,0,0,2,0,0|2,0,0]=4 1743 B12R2.1129 NC1CC2CCC1C2C(O)=O Amb23454093 [0,0,0,2,0,0|2,0,0]=4 1744 B12R2.1129 OC1C[C@@H]2CC[C@H]1C2C(O)=O Amb24511946 [0,0,0,2,0,0|2,0,0]=4 1745 B12R2.1129 OC1C[C@H]2CC[C@@H]1C2C(O)=O Amb24511947 [0,0,0,2,0,0|2,0,0]=4 1746 B12R2.1129 O[C@@H]1C[C@@H]2CC[C@H]1[C@@H]2C(O)=O Amb24729546 [0,0,0,2,0,0|2,0,0]=4 1747 B12R2.1129 O[C@H]1C[C@@H]2CC[C@H]1[C@@H]2C(O)=O Amb24519228 [0,0,0,2,0,0|2,0,0]=4 1748 B12R2.1145 C=C1CC2CC(C1C2)C(O)=O Amb24694130 [0,0,0,2,0,0|1,0,1]=4 1749 B12R2.1145 C=C1C[C@H]2C[C@@H]([C@@H]1C2)C(O)=O Amb25361477 [0,0,0,2,0,0|1,0,1]=4 1750 B12R2.1145 CC(=O)C1CC2CC1C(Cl)C2 Amb25363329 [0,0,0,2,0,0|2,0,0]=4 1751 B12R2.1145 CC(=O)[C@H]1C[C@H]2C[C@@H]1[C@H](O)C2 Amb24570459 [0,0,0,2,0,0|2,0,0]=4 1752 B12R2.1145 C[C@@H]1C[C@H]2C[C@H]1[C@@H](C2)C(O)=O Amb25179280 [0,0,0,2,0,0|1,0,0]=3 1753 B12R2.1145 NC(=O)C1CC2CC1C(S)C2 Amb24435000 [0,0,0,2,0,0|2,0,0]=4 1754 B12R2.1145 NC(=O)[C@@H]1C[C@H]2C[C@@H]1[C@@H](O)C2 Amb24512058 [0,0,0,2,0,0|2,0,0]=4 1755 B12R2.1145 NC(=O)[C@@H]1C[C@H]2C[C@@H]1[C@H](O)C2 Amb24601786 [0,0,0,2,0,0|2,0,0]=4 1756 B12R2.1145 NC(=O)[C@H]1C[C@H]2C[C@@H]1[C@H](O)C2 Amb25335409 [0,0,0,2,0,0|2,0,0]=4 1757 B12R2.1145 NC1CC2CC1C(C2)C(O)=O Amb23589115 [0,0,0,2,0,0|0,0,0]=2 1758 B12R2.1145 OC(=O)C1CC2CC(=O)C1C2 Amb22372042 [0,0,0,2,0,0|1,0,1]=4 1759 B12R2.1145 OC1CC2CC(C1O2)C(O)=O Amb24558668 [0,0,0,2,0,0|2,0,0]=4 1760 B12R2.1145 O[C@H]1C[C@H]2C[C@H]([C@@H]1C2)C(O)=O Amb25238259 [0,0,0,2,0,0|1,0,0]=3 1761 B12R2.1391 CC(=O)N1CC2CNCC1C2 Amb24484877 [0,0,0,2,0,0|2,0,0]=4 1762 B12R2.1391 OC(=O)C1CC2CN1CCC2 Amb24078302 [0,0,0,2,0,0|2,0,0]=4 1763 B12R2.1391 OC(=O)C1CN2CC1CCC2 Amb24381374 [0,0,0,2,0,0|2,0,0]=4 1764 B12R2.1391 OC(=O)C1C[C@H]2C[C@@H]1CCC2 Amb25227521 [0,0,0,2,0,0|1,0,0]=3 1765 B12R2.1391 OC(=O)C1NC2CC1COC2 Amb25073161 [0,0,0,2,0,0|2,0,0]=4 1766 B12R2.1391 OC(=O)C1OC2CNCC1O2 Amb24419889 [0,0,0,2,0,0|2,0,0]=4 1767 B12R2.1391 OC(=O)[C@@H]1C[C@@H]2C[C@H]1CCC2 Amb25320927 [0,0,0,2,0,0|1,0,0]=3 1768 B12R2.1391 OC(=O)[C@@H]1C[C@H]2C[C@@H]1CCC2 Amb25210431 [0,0,0,2,0,0|1,0,0]=3 1769 B12R2.1391 OC(=O)[C@H]1C[C@@H]2CCC[C@H]1N2 Amb24606496 [0,0,0,2,0,0|2,0,0]=4 1770 B12R2.1671 OCC1NC(=O)OC1C2CC2 Amb24665952 [0,0,0,2,0,0|2,0,0]=4 1771 B12R2.2429 CC1(C)[C@@H](O)[C@@H]2CC(=O)O[C@H]12 Amb25284604 [0,0,0,2,0,0|1,0,0]=3 1772 B12R2.5342 CC1CC2C(C1)C(=O)OC2=O Amb25244470 [0,0,0,2,0,0|1,0,1]=4 1773 B12R2.5342 CC1CC2C(C1)C(C)CC2=O Amb25087208 [0,0,0,2,0,0|2,0,0]=4 1774 B12R2.1085 CN1CCCC2C(C12)C(O)=O Amb18200454 [0,0,0,2,0,0|2,0,0]=4 1775 B12R2.1085 CN1CCC[C@@H]2C([C@H]12)C(O)=O Amb25168865 [0,0,0,2,0,0|2,0,0]=4 1776 B12R2.1085 OC1CCC[C@@H]2[C@H]1[C@H]2C(O)=O Amb25683492 [0,0,0,2,0,0|2,0,0]=4 1777 B12R2.89 CC1CC2C(C2CC1)C(N)=O Amb25123961 [0,0,0,2,0,0|2,0,0]=4 1778 B12R2.89 CN1CC2C(C2CC1)C(O)=O Amb18200455 [0,0,0,2,0,0|2,0,0]=4 1779 B12R2.589 CC(C)C[C@H]1[C@@H]2[C@H]1CCC2=O Amb24570419 [0,0,0,2,0,0|2,0,0]=4 1780 B12R2.594 O=C1CC2CC(CCC2)CC1 Amb25151469 [0,0,0,2,0,0|2,0,0]=4 1781 B12R2.594 O=C1C[C@@H]2C[C@@H](CCC2)CC1 Amb24689462 [0,0,0,2,0,0|2,0,0]=4 1782 B12R2.606 CC1CC2CCC(=O)CC2C1 Amb24357258 [0,0,0,2,0,0|2,0,0]=4 1783 B12R2.606 CC1CNC2CC(=O)NC2C1 Amb24687776 [0,0,0,2,0,0|2,0,0]=4 1784 B12R2.606 CC1C[C@H]2CCC(=O)C[C@@H]2C1 Amb24631681 [0,0,0,2,0,0|2,0,0]=4 1785 B12R2.606 CC1C[C@H]2CCC(=O)C[C@H]2C1 Amb24633400 [0,0,0,2,0,0|2,0,0]=4 1786 B12R2.606 C[C@@H]1C[C@@H]2NC(=O)O[C@H]2CC1 Amb25254149 [0,0,0,2,0,0|2,0,0]=4 1787 B12R2.606 O=C1C[C@H]2C[C@H](Cl)C[C@H]2CO1 Amb24626585 [0,0,0,2,0,0|2,0,0]=4 1788 B12R2.606 OC1CC2CC(=O)OCC2C1 Amb25152150 [0,0,0,2,0,0|2,0,0]=4 1789 B12R2.606 O[C@@H]1C[C@@H]2CC(=O)OC[C@@H]2C1 Amb24748613 [0,0,0,2,0,0|2,0,0]=4 1790 B12R2.761 OC1CC(CC(O)=O)C2CC12 Amb25685418 [0,0,0,2,0,0|2,0,0]=4 1791 B12R2.761 O[C@H]1CC(CC(O)=O)[C@@H]2C[C@H]12 Amb24692682 [0,0,0,2,0,0|2,0,0]=4 1792 B12R2.761 O[C@H]1CC(CC(O)=O)[C@H]2C[C@@H]12 Amb25336572 [0,0,0,2,0,0|2,0,0]=4 1793 B12R2.1095 CC1(C)CC2CCCC(=O)C12 Amb25134117 [0,0,0,2,0,0|2,0,0]=4 1794 B12R2.1661 CC(=O)C[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb25179561 [0,0,0,2,0,0|2,0,0]=4 1795 B12R2.1661 CC(=O)C[C@@H]1C[C@@H]2C[C@H]1CC2 Amb24620043 [0,0,0,2,0,0|2,0,0]=4 1796 B12R2.1661 CC(=O)C[C@H]1C[C@@H]2C[C@@H]1CC2 Amb24625794 [0,0,0,2,0,0|2,0,0]=4 1797 B12R2.1661 NC(=O)CC1C[C@H]2C[C@@H]1CC2 Amb24550040 [0,0,0,2,0,0|2,0,0]=4 1798 B12R2.1661 OC(=O)CC1CC2CCC1O2 Amb18200227 [0,0,0,2,0,0|2,0,0]=4 1799 B12R2.1661 OC(=O)CC1C[C@@H]2C[C@H]1C=C2 Amb24706706 [0,0,0,2,0,0|1,0,1]=4 1800 B12R2.1661 OC(=O)CN1C[C@H]2C[C@@H]1CC2 Amb10844645 [0,0,0,2,0,0|2,0,0]=4 1801 B12R2.1661 OC(=O)C[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb25238311 [0,0,0,2,0,0|1,0,0]=3 1802 B12R2.1661 OC(=O)C[C@@H]1C[C@@H]2C[C@H]1CC2 Amb24735957 [0,0,0,2,0,0|1,0,0]=3 1803 B12R2.1661 OC(=O)C[C@@H]1C[C@H]2C[C@@H]1C=C2 Amb10607426 [0,0,0,2,0,0|1,0,1]=4 1804 B12R2.1661 OC(=O)C[C@@H]1C[C@H]2C[C@@H]1CC2 Amb24635755 [0,0,0,2,0,0|1,0,0]=3 1805 B12R2.1661 OC(=O)C[C@H]1C[C@@H]2C[C@@H]1C=C2 Amb25322062 [0,0,0,2,0,0|1,0,1]=4 1806 B12R2.2899 C[C@@H]1C[C@@H]2CC(=O)C[C@H](C1)C2 Amb25142705 [0,0,0,2,0,0|2,0,0]=4 1807 B12R2.2899 C[C@@H]1C[C@H]2CC(=O)C=C(C2)C1 Amb24570294 [0,0,0,2,0,0|2,0,0]=4 1808 B12R2.2899 C[C@@H]1C[C@H]2CC(=O)C[C@@H](C1)C2 Amb25807615 [0,0,0,2,0,0|2,0,0]=4 1809 B12R2.3255 OC(=O)CC1CCCC2OC12 Amb24392126 [0,0,0,2,0,0|2,0,0]=4 1810 B12R2.5120 CC1CC2(CC(=O)N2)CCC1 Amb24676976 [0,0,0,2,0,0|2,0,0]=4 1811 B12R2.1061 CC1(C)CC2(CO1)CC(=O)N2 Amb24540730 [0,0,0,2,0,0|2,0,0]=4 1812 B12R2.7244 OCC12CC(CNC(=O)C1)C2 Amb24484379 [0,0,0,2,0,0|2,0,0]=4 1813 B12R2.3128 CC1(C)CC2C(C2C1)C(O)=O Amb25732189 [0,0,0,2,0,0|1,0,0]=3 1814 B12R2.237 CC1(C)CC2CC(=O)CC2C1 Amb24486241 [0,0,0,2,0,0|2,0,0]=4 1815 B12R2.237 CC1(C)C[C@@H]2CC(=O)C[C@@H]2C1 Amb24584428 [0,0,0,2,0,0|2,0,0]=4 1816 B12R2.237 CC1(C)C[C@@H]2CC(=O)C[C@H]2C1 Amb25263462 [0,0,0,2,0,0|2,0,0]=4 1817 B12R2.3863 CC12CC(Br)CC1CC(=O)O2 Amb25092931 [0,0,0,2,0,0|2,0,0]=4 1818 B12R2.3863 CC12CC(O)CC1CC(=O)O2 Amb25150764 [0,0,0,2,0,0|2,0,0]=4 1819 B12R2.3863 C[C@]12C[C@@H](O)C[C@H]1CC(=O)O2 Amb25235991 [0,0,0,2,0,0|2,0,0]=4 1820 B12R2.1359 OC(=O)C1CCN1CC2CC2 Amb25195570 [0,0,0,2,0,0|2,0,0]=4 1821 B12R2.3612 OC(=O)CN1CC2(CC1)CC2 Amb25260190 [0,0,0,2,0,0|2,0,0]=4 1822 B8R0.15 C=CC[C@H](CN)C(O)=O Amb24679707 [1,0,0,0,1,0|0,0,2]=4 1823 B8R0.15 CC(C)C(CC)NC=O Amb25359814 [1,0,0,0,1,0|2,0,0]=4 1824 B8R0.15 CC(C)C(CC=O)C=C Amb25835710 [1,0,0,0,1,0|1,0,1]=4 1825 B8R0.15 CC(C)C(CC=O)C=O Amb18642625 [1,0,0,0,1,0|1,0,1]=4 1826 B8R0.15 CC(C)C(CN)CCC Amb19023863 [1,0,0,0,1,0|1,0,1]=4 1827 B8R0.15 CC(C)C(CN)CNC Amb25730078 [1,0,0,0,1,0|2,0,0]=4 1828 B8R0.15 CC(C)C(CN)CNO Amb24409859 [1,0,0,0,1,0|1,0,0]=3 1829 B8R0.15 CC(C)C(CO)NC=O Amb25092355 [1,0,0,0,1,0|2,0,0]=4 1830 B8R0.15 CC(C)[C@@H](CC=O)CC Amb25081100 [1,0,0,0,1,0|1,0,0]=3 1831 B8R0.15 CC(C)[C@@H](CCO)CO Amb24576590 [1,0,0,0,1,0|1,0,1]=4 1832 B8R0.15 CC(C)[C@H](CC=O)CC Amb25690271 [1,0,0,0,1,0|1,0,0]=3 1833 B8R0.15 CC(C)[C@H](CO)NC=O Amb25062060 [1,0,0,0,1,0|2,0,0]=4 1834 B8R0.15 CCC(CCC)C(C)=O Amb25683405 [1,0,0,0,1,0|2,0,0]=4 1835 B8R0.15 CCC(CCC)C(N)=O Amb24678022 [1,0,0,0,1,0|2,0,0]=4 1836 B8R0.15 CCC(CCC)C(O)=O Amb19009626 [1,0,0,0,1,0|1,0,0]=3 1837 B8R0.15 CCC(CCN)C(O)=O Amb24699884 [1,0,0,0,1,0|2,0,0]=4 1838 B8R0.15 CCC(CCO)C(O)=O Amb18642884 [1,0,0,0,1,0|2,0,0]=4 1839 B8R0.15 CCC(COC)C(O)=O Amb18124352 [1,0,0,0,1,0|2,0,0]=4 1840 B8R0.15 CCCC(C#C)C(O)=O Amb25280471 [1,0,0,0,1,0|1,0,1]=4 1841 B8R0.15 CCCC(CN)C(C)=O Amb25756244 [1,0,0,0,1,0|1,0,0]=3 1842 B8R0.15 CCCC(CN)C(O)=O Amb19373497 [1,0,0,0,1,0|0,0,0]=2 1843 B8R0.15 CCCC(NBr)C(O)=O Amb24634034 [1,0,0,0,1,0|2,0,0]=4 1844 B8R0.15 CCCC(NC)C(O)=O Amb21961534 [1,0,0,0,1,0|2,0,0]=4 1845 B8R0.15 CCCC(NC)C(O)=O Amb22587444 [1,0,0,0,1,0|2,0,0]=4 1846 B8R0.15 CCCC(NCl)C(O)=O Amb25032132 [1,0,0,0,1,0|2,0,0]=4 1847 B8R0.15 CCCC(NO)C(O)=O Amb22372057 [1,0,0,0,1,0|2,0,0]=4 1848 B8R0.15 CCC[C@@H](CO)C(O)=O Amb24571859 [1,0,0,0,1,0|1,0,0]=3 1849 B8R0.15 CCC[C@@H](NC)C(O)=O Amb25771939 [1,0,0,0,1,0|2,0,0]=4 1850 B8R0.15 CCC[C@H](CO)C(O)=O Amb25063310 [1,0,0,0,1,0|1,0,0]=3 1851 B8R0.15 CCC[C@H](NC)C(O)=O Amb25062610 [1,0,0,0,1,0|2,0,0]=4 1852 B8R0.15 CCC[C@H](NO)C(O)=O Amb25744829 [1,0,0,0,1,0|2,0,0]=4 1853 B8R0.15 CCN(CC=O)C(C)C Amb25048770 [1,0,0,0,1,0|2,0,0]=4 1854 B8R0.15 CCNC(CN)C(O)=O Amb25825729 [1,0,0,0,1,0|1,0,0]=3 1855 B8R0.15 CCNC(CO)C(O)=O Amb24477808 [1,0,0,0,1,0|2,0,0]=4 1856 B8R0.15 CCNC(CS)C(O)=O Amb25694444 [1,0,0,0,1,0|2,0,0]=4 1857 B8R0.15 CCN[C@@H](CO)C(O)=O Amb24477673 [1,0,0,0,1,0|2,0,0]=4 1858 B8R0.15 CCN[C@@H](CS)C(O)=O Amb25801938 [1,0,0,0,1,0|2,0,0]=4 1859 B8R0.15 CCN[C@H](CO)C(O)=O Amb25328424 [1,0,0,0,1,0|2,0,0]=4 1860 B8R0.15 CCN[C@H](CS)C(O)=O Amb24692505 [1,0,0,0,1,0|2,0,0]=4 1861 B8R0.15 CCOC(CO)C(O)=O Amb18316294 [1,0,0,0,1,0|2,0,0]=4 1862 B8R0.15 CCOC(CS)C(O)=O Amb19037339 [1,0,0,0,1,0|2,0,0]=4 1863 B8R0.15 CCSC(CCl)C(O)=O Amb25837308 [1,0,0,0,1,0|2,0,0]=4 1864 B8R0.15 CCSC(CN)C(N)=O Amb25801244 [1,0,0,0,1,0|2,0,0]=4 1865 B8R0.15 CCSC(CN)C(O)=O Amb25808987 [1,0,0,0,1,0|1,0,0]=3 1866 B8R0.15 CCSC(CO)C(O)=O Amb25803319 [1,0,0,0,1,0|2,0,0]=4 1867 B8R0.15 CC[C@@H](CCC)C(N)=O Amb24393313 [1,0,0,0,1,0|2,0,0]=4 1868 B8R0.15 CC[C@@H](CCC)C(O)=O Amb24529114 [1,0,0,0,1,0|1,0,0]=3 1869 B8R0.15 CC[C@H](CCC)C(O)=O Amb24376457 [1,0,0,0,1,0|1,0,0]=3 1870 B8R0.15 CONC(CN)C(O)=O Amb25688022 [1,0,0,0,1,0|2,0,0]=4 1871 B8R0.15 NCCC(CF)C(O)=O Amb25174518 [1,0,0,0,1,0|2,0,0]=4 1872 B8R0.23 BrC(C(=O)O)CC(C)C Amb16233356 [1,0,0,0,1,0|1,0,0]=3 1873 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [1,0,0,0,1,0|0,0,2]=4 1874 B8R0.23 CC(=C)CC(C)C(O)=O Amb24471924 [1,0,0,0,1,0|0,0,2]=4 1875 B8R0.23 CC(=C)C[C@@H](C(=O)O)C Amb10843988 [1,0,0,0,1,0|0,0,2]=4 1876 B8R0.23 CC(=C)C[C@@H](C)C(O)=O Amb24340253 [1,0,0,0,1,0|0,0,2]=4 1877 B8R0.23 CC(=C)C[C@@H](N)C(O)=O Amb22801689 [1,0,0,0,1,0|0,0,2]=4 1878 B8R0.23 CC(=C)C[C@H](N)C(O)=O Amb25757900 [1,0,0,0,1,0|0,0,2]=4 1879 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [1,0,0,0,1,0|1,0,1]=4 1880 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [1,0,0,0,1,0|1,0,1]=4 1881 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [1,0,0,0,1,0|1,0,1]=4 1882 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [1,0,0,0,1,0|1,0,1]=4 1883 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [1,0,0,0,1,0|1,0,1]=4 1884 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [1,0,0,0,1,0|1,0,1]=4 1885 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [1,0,0,0,1,0|1,0,1]=4 1886 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [1,0,0,0,1,0|1,0,1]=4 1887 B8R0.23 CC(=S)CC(C)C(O)=O Amb24588975 [1,0,0,0,1,0|1,0,1]=4 1888 B8R0.23 CC(C(=O)N)CN(C)C Amb17231865 [1,0,0,0,1,0|2,0,0]=4 1889 B8R0.23 CC(C(=O)O)NC(C)C Amb10199874 [1,0,0,0,1,0|1,0,0]=3 1890 B8R0.23 CC(C(=O)O)NC(C)C Amb1110769 [1,0,0,0,1,0|1,0,0]=3 1891 B8R0.23 CC(C(=O)O)OC(C)C Amb10607866 [1,0,0,0,1,0|1,0,0]=3 1892 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [1,0,0,0,1,0|0,0,0]=2 1893 B8R0.23 CC(C)=C(C)CC(O)=O Amb18642613 [1,0,0,0,1,0|0,0,2]=4 1894 B8R0.23 CC(C)=C[C@@H](C)C(O)=O Amb25794277 [1,0,0,0,1,0|0,0,2]=4 1895 B8R0.23 CC(C)=C[C@H](N)C(O)=O Amb24629144 [1,0,0,0,1,0|0,0,2]=4 1896 B8R0.23 CC(C)C(=C)CC(O)=O Amb25074109 [1,0,0,0,1,0|0,0,2]=4 1897 B8R0.23 CC(C)C(Br)CC(N)=O Amb25706465 [1,0,0,0,1,0|2,0,0]=4 1898 B8R0.23 CC(C)C(C)CC(C)=O Amb25835876 [1,0,0,0,1,0|1,0,0]=3 1899 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [1,0,0,0,1,0|1,0,0]=3 1900 B8R0.23 CC(C)C(C)NC(C)=O Amb23329033 [1,0,0,0,1,0|2,0,0]=4 1901 B8R0.23 CC(C)C(C)OC(C)=O Amb24458336 [1,0,0,0,1,0|2,0,0]=4 1902 B8R0.23 CC(C)C(Cl)CC(=O)Cl Amb24479955 [1,0,0,0,1,0|2,0,0]=4 1903 B8R0.23 CC(C)C(F)CC(O)=O Amb25854273 [1,0,0,0,1,0|1,0,0]=3 1904 B8R0.23 CC(C)C(N)=CC(O)=O Amb24481870 [1,0,0,0,1,0|0,0,2]=4 1905 B8R0.23 CC(C)C(N)CC(=O)Cl Amb24763731 [1,0,0,0,1,0|1,0,0]=3 1906 B8R0.23 CC(C)C(N)CC(=O)S Amb24477693 [1,0,0,0,1,0|0,1,0]=3 1907 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [1,0,0,0,1,0|1,0,0]=3 1908 B8R0.23 CC(C)C(N)CS(C)=O Amb25268163 [1,0,0,0,1,0|2,0,0]=4 1909 B8R0.23 CC(C)C(O)CC(C)=O Amb24079595 [1,0,0,0,1,0|2,0,0]=4 1910 B8R0.23 CC(C)C(O)CC(N)=O Amb24481942 [1,0,0,0,1,0|2,0,0]=4 1911 B8R0.23 CC(C)C(S)CC(C)=O Amb24736725 [1,0,0,0,1,0|2,0,0]=4 1912 B8R0.23 CC(C)CC(=C)C(O)=O Amb18642603 [1,0,0,0,1,0|0,0,2]=4 1913 B8R0.23 CC(C)CC(Br)C(N)=O Amb24423796 [1,0,0,0,1,0|2,0,0]=4 1914 B8R0.23 CC(C)CC(C)C(C)=O Amb24640121 [1,0,0,0,1,0|1,0,0]=3 1915 B8R0.23 CC(C)CC(C)C(N)=N Amb24332069 [1,0,0,0,1,0|2,0,0]=4 1916 B8R0.23 CC(C)CC(C)C(N)=O Amb25733229 [1,0,0,0,1,0|1,0,0]=3 1917 B8R0.23 CC(C)CC(C)C(N)=S Amb24481694 [1,0,0,0,1,0|1,1,0]=4 1918 B8R0.23 CC(C)CC(C)C(O)=O Amb18975244 [1,0,0,0,1,0|0,0,0]=2 1919 B8R0.23 CC(C)CC(C)S([O-])=O Amb24371233 [1,0,0,0,1,0|1,0,1]=4 1920 B8R0.23 CC(C)CC(Cl)C(N)=O Amb24534175 [1,0,0,0,1,0|2,0,0]=4 1921 B8R0.23 CC(C)CC(F)C(O)=O Amb24565634 [1,0,0,0,1,0|1,0,0]=3 1922 B8R0.23 CC(C)CC(N)B(O)O Amb25125820 [1,0,0,0,1,0|1,0,1]=4 1923 B8R0.23 CC(C)CC(N)C(C)=C Amb25764676 [1,0,0,0,1,0|2,0,0]=4 1924 B8R0.23 CC(C)CC(N)C(C)=O Amb18203220 [1,0,0,0,1,0|1,0,0]=3 1925 B8R0.23 CC(C)CC(N)C(C)=O Amb22899479 [1,0,0,0,1,0|1,0,0]=3 1926 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [1,0,0,0,1,0|1,0,1]=4 1927 B8R0.23 CC(C)CC(N)C(O)=O Amb22001061 [1,0,0,0,1,0|0,0,0]=2 1928 B8R0.23 CC(C)CC(N)[13C](O)=O Amb22363198 [1,0,0,0,1,0|0,0,0]=2 1929 B8R0.23 CC(C)CC(S)C(O)=O Amb18296292 [1,0,0,0,1,0|1,0,0]=3 1930 B8R0.23 CC(C)CC([15NH2])C(O)=O Amb22351200 [1,0,0,0,1,0|0,0,0]=2 1931 B8R0.23 CC(C)CN(C)C(C)=O Amb24545444 [1,0,0,0,1,0|2,0,0]=4 1932 B8R0.23 CC(C)C[13CH](N)C(O)=O Amb22351309 [1,0,0,0,1,0|0,0,0]=2 1933 B8R0.23 CC(C)C[13CH](N)[13C](O)=O Amb22367336 [1,0,0,0,1,0|0,0,0]=2 1934 B8R0.23 CC(C)C[C@@H](Br)C(=O)Cl Amb25290167 [1,0,0,0,1,0|2,0,0]=4 1935 B8R0.23 CC(C)C[C@@H](Br)C(N)=O Amb25310991 [1,0,0,0,1,0|2,0,0]=4 1936 B8R0.23 CC(C)C[C@@H](Br)C(O)=O Amb24648832 [1,0,0,0,1,0|1,0,0]=3 1937 B8R0.23 CC(C)C[C@@H](Cl)C(O)=O Amb22800398 [1,0,0,0,1,0|1,0,0]=3 1938 B8R0.23 CC(C)C[C@@H](F)C(O)=O Amb24616998 [1,0,0,0,1,0|1,0,0]=3 1939 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [1,0,0,0,1,0|1,0,0]=3 1940 B8R0.23 CC(C)C[C@@H]([15NH2])C(O)=O Amb22801141 [1,0,0,0,1,0|0,0,0]=2 1941 B8R0.23 CC(C)C[C@H](Br)C(O)=O Amb22226489 [1,0,0,0,1,0|1,0,0]=3 1942 B8R0.23 CC(C)C[C@H](Cl)C(N)=O Amb25145996 [1,0,0,0,1,0|2,0,0]=4 1943 B8R0.23 CC(C)C[C@H](Cl)C(O)=O Amb22388637 [1,0,0,0,1,0|1,0,0]=3 1944 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [1,0,0,0,1,0|1,0,1]=4 1945 B8R0.23 CC(C)C[C@H](N)C(=O)Cl Amb25842766 [1,0,0,0,1,0|1,0,0]=3 1946 B8R0.23 CC(C)C[C@H](N)C(O)=O Amb22351113 [1,0,0,0,1,0|0,0,0]=2 1947 B8R0.23 CC(C)C[C@H](N)C(O)O Amb24353011 [1,0,0,0,1,0|0,0,2]=4 1948 B8R0.23 CC(C)C[C@H](N)[C@@H](C)O Amb25851073 [1,0,0,0,1,0|1,0,1]=4 1949 B8R0.23 CC(C)C[C@H](O)C(N)=O Amb24548495 [1,0,0,0,1,0|2,0,0]=4 1950 B8R0.23 CC(C)C[C@H](S)C(O)=O Amb24457027 [1,0,0,0,1,0|1,0,0]=3 1951 B8R0.23 CC(C)N(C)CC(C)=O Amb22587141 [1,0,0,0,1,0|2,0,0]=4 1952 B8R0.23 CC(C)N(C)CC(N)=O Amb24384718 [1,0,0,0,1,0|2,0,0]=4 1953 B8R0.23 CC(C)NC(C)C(C)=O Amb18642711 [1,0,0,0,1,0|2,0,0]=4 1954 B8R0.23 CC(C)N[C@@H](C)C(N)=O Amb24749342 [1,0,0,0,1,0|2,0,0]=4 1955 B8R0.23 CC(C)N[C@H](C)C(N)=O Amb24680081 [1,0,0,0,1,0|2,0,0]=4 1956 B8R0.23 CC(C)SC(F)C(O)=O Amb24671129 [1,0,0,0,1,0|2,0,0]=4 1957 B8R0.23 CC(C)S[C@@H](C)C(O)=O Amb25108429 [1,0,0,0,1,0|1,0,0]=3 1958 B8R0.23 CC(C)[C@@H](N)CC(C)=C Amb25821833 [1,0,0,0,1,0|2,0,0]=4 1959 B8R0.23 CC(C)[C@@H](N)CC(O)=O Amb22226647 [1,0,0,0,1,0|0,0,0]=2 1960 B8R0.23 CC(C)[C@@H](O)CC(C)=O Amb25147078 [1,0,0,0,1,0|2,0,0]=4 1961 B8R0.23 CC(C)[C@@H](O)CC(O)=O Amb25761246 [1,0,0,0,1,0|1,0,0]=3 1962 B8R0.23 CC(C)[C@H](C)CC(C)=O Amb25188966 [1,0,0,0,1,0|1,0,0]=3 1963 B8R0.23 CC(C)[C@H](N)CC(C)=C Amb24715099 [1,0,0,0,1,0|2,0,0]=4 1964 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [1,0,0,0,1,0|1,0,0]=3 1965 B8R0.23 CC(C)[C@H](N)CC(O)=O Amb20240790 [1,0,0,0,1,0|0,0,0]=2 1966 B8R0.23 CC(C)[C@H](O)CC(C)=O Amb25135567 [1,0,0,0,1,0|2,0,0]=4 1967 B8R0.23 CC(C)[C@H](O)CC(O)=O Amb24561913 [1,0,0,0,1,0|1,0,0]=3 1968 B8R0.23 CC(CC(C)=O)C(C)O Amb24339979 [1,0,0,0,1,0|2,0,0]=4 1969 B8R0.23 CC(CC(C)N)C(O)=O Amb20620336 [1,0,0,0,1,0|1,0,0]=3 1970 B8R0.23 CC(CC(C)O)C(C)=O Amb25682085 [1,0,0,0,1,0|2,0,0]=4 1971 B8R0.23 CC(CC(F)F)C(O)=O Amb22896466 [1,0,0,0,1,0|2,0,0]=4 1972 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [1,0,0,0,1,0|1,0,0]=3 1973 B8R0.23 CC(CC(O)=O)N(C)N Amb25699365 [1,0,0,0,1,0|2,0,0]=4 1974 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [1,0,0,0,1,0|2,0,0]=4 1975 B8R0.23 CC(CN(C)O)C(O)=O Amb24540617 [1,0,0,0,1,0|2,0,0]=4 1976 B8R0.23 CC(CS(C)=O)C(O)=O Amb18974546 [1,0,0,0,1,0|2,0,0]=4 1977 B8R0.23 CC(F)CC(N)C(O)=O Amb25803619 [1,0,0,0,1,0|1,0,0]=3 1978 B8R0.23 CC(N(C)C)CC(=O)N Amb17231867 [1,0,0,0,1,0|2,0,0]=4 1979 B8R0.23 CC(N(CC(=O)O)C)C Amb10609863 [1,0,0,0,1,0|1,0,0]=3 1980 B8R0.23 CC(NN(C)C)C(O)=O Amb24523085 [1,0,0,0,1,0|2,0,0]=4 1981 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [1,0,0,0,1,0|1,0,0]=3 1982 B8R0.23 CC(O)CC(C)C(O)=O Amb18293277 [1,0,0,0,1,0|1,0,0]=3 1983 B8R0.23 CC(O)CC(N)C(O)=O Amb18642918 [1,0,0,0,1,0|1,0,0]=3 1984 B8R0.23 CC(S(=O)CC(=O)O)C Amb10608021 [1,0,0,0,1,0|2,0,0]=4 1985 B8R0.23 CC(S)CC(O)C(O)=O Amb25032270 [1,0,0,0,1,0|2,0,0]=4 1986 B8R0.23 CC(\C(=C\C(=O)O)\C)C Amb17506861 [1,0,0,0,1,0|0,0,2]=4 1987 B8R0.23 CN(C)CC(F)C(O)=O Amb25178248 [1,0,0,0,1,0|2,0,0]=4 1988 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [1,0,0,0,1,0|2,0,0]=4 1989 B8R0.23 CN(C)CC(N)C(O)=O Amb22352274 [1,0,0,0,1,0|1,0,0]=3 1990 B8R0.23 CN(C)CC(N)C(O)=O Amb23558085 [1,0,0,0,1,0|1,0,0]=3 1991 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb19889770 [1,0,0,0,1,0|1,0,0]=3 1992 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb22800468 [1,0,0,0,1,0|1,0,0]=3 1993 B8R0.23 CN(C)C[C@H](N)C(O)=O Amb24078627 [1,0,0,0,1,0|1,0,0]=3 1994 B8R0.23 CN(C)C[C@H](O)C(O)=O Amb24372674 [1,0,0,0,1,0|2,0,0]=4 1995 B8R0.23 CS(=N)CC(N)C(O)=O Amb24374643 [1,0,0,0,1,0|2,0,0]=4 1996 B8R0.23 CS(=O)CC(N)C(O)=O Amb18125279 [1,0,0,0,1,0|2,0,0]=4 1997 B8R0.23 CS(=O)C[C@@H](C(=O)O)N Amb16232229 [1,0,0,0,1,0|2,0,0]=4 1998 B8R0.23 CS(=O)C[C@@H](N)C(O)=O Amb22745418 [1,0,0,0,1,0|2,0,0]=4 1999 B8R0.23 C[C@@H](C(=O)O)CC(C)C Amb10844070 [1,0,0,0,1,0|0,0,0]=2 2000 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [1,0,0,0,1,0|0,0,0]=2 2001 B8R0.23 C[C@@H](CC(O)=O)C(Cl)Cl Amb24480304 [1,0,0,0,1,0|2,0,0]=4 2002 B8R0.23 C[C@@H](N)[C@@H](O)CC(O)=O Amb25188895 [1,0,0,0,1,0|2,0,0]=4 2003 B8R0.23 C[C@@H](O)C[C@H](N)C(O)=O Amb25162814 [1,0,0,0,1,0|1,0,0]=3 2004 B8R0.23 C[C@@H](O)[C@@H](O)CC(O)=O Amb25267600 [1,0,0,0,1,0|2,0,0]=4 2005 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22168848 [1,0,0,0,1,0|1,0,0]=3 2006 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22756696 [1,0,0,0,1,0|1,0,0]=3 2007 B8R0.23 C[C@H](C(=O)O)CC(C)C Amb10844071 [1,0,0,0,1,0|0,0,0]=2 2008 B8R0.23 C[C@H](C(=O)O)CN(C)C Amb10844031 [1,0,0,0,1,0|1,0,0]=3 2009 B8R0.23 C[C@H](Cl)C[C@H](N)C(O)=O Amb25849347 [1,0,0,0,1,0|1,0,0]=3 2010 B8R0.23 C[C@H](N)[C@@H](O)CC(O)=O Amb25727721 [1,0,0,0,1,0|2,0,0]=4 2011 B8R0.23 C[C@H](O)C[C@@H](C)C(O)=O Amb25114249 [1,0,0,0,1,0|1,0,0]=3 2012 B8R0.23 C[C@H](O)C[C@H](N)C(O)=O Amb24461394 [1,0,0,0,1,0|1,0,0]=3 2013 B8R0.23 C[S+](C)CC(N)C([O-])=O Amb25242630 [1,0,0,0,1,0|1,0,1]=4 2014 B8R0.23 C[S+](C)CC(O)C(O)=O Amb24373144 [1,0,0,0,1,0|2,0,0]=4 2015 B8R0.23 C\C(=C/C(C)C)\C(O)=O Amb18642616 [1,0,0,0,1,0|0,0,2]=4 2016 B8R0.23 ClC(C(=O)O)CC(C)C Amb17593753 [1,0,0,0,1,0|1,0,0]=3 2017 B8R0.23 F[C@H](C(=O)O)CC(C)C Amb10841083 [1,0,0,0,1,0|1,0,0]=3 2018 B8R0.23 NC(C(=O)O)CC(F)F Amb13952714 [1,0,0,0,1,0|2,0,0]=4 2019 B8R0.23 NC(C(=O)O)CC(F)F Amb13952720 [1,0,0,0,1,0|2,0,0]=4 2020 B8R0.23 NC(C(C)C)CC(=O)O Amb2436060 [1,0,0,0,1,0|0,0,0]=2 2021 B8R0.23 NC(CC(F)Cl)C(O)=O Amb24339513 [1,0,0,0,1,0|2,0,0]=4 2022 B8R0.23 NC(CC(O)=O)C(F)F Amb23570587 [1,0,0,0,1,0|2,0,0]=4 2023 B8R0.23 N[C@@H](C(=O)N)CC(C)C Amb16183944 [1,0,0,0,1,0|1,0,0]=3 2024 B8R0.23 N[C@@H](C(C)C)CC(=O)O Amb16184024 [1,0,0,0,1,0|0,0,0]=2 2025 B8R0.23 N[C@@H](CC(Cl)Cl)C(O)=O Amb24746791 [1,0,0,0,1,0|2,0,0]=4 2026 B8R0.23 N[C@H](C(=O)N)CC(C)C Amb10670112 [1,0,0,0,1,0|1,0,0]=3 2027 B8R0.23 N[C@H](C(C)C)CC(=O)O Amb16184030 [1,0,0,0,1,0|0,0,0]=2 2028 B8R0.23 N[C@H](CC(F)F)C(O)=O Amb25117310 [1,0,0,0,1,0|2,0,0]=4 2029 B8R0.23 OC(=O)C[C@@H]([C@@H](O)C)N Amb16184021 [1,0,0,0,1,0|1,0,0]=3 2030 B8R0.23 OC(C(C)C)CC(=O)O Amb17231878 [1,0,0,0,1,0|1,0,0]=3 2031 B8R0.23 O[C@H](C(=O)O)CC(C)C Amb16232074 [1,0,0,0,1,0|1,0,0]=3 2032 B8R0.23 [13CH3][13CH]([13CH3])[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337118 [1,0,0,0,1,0|0,0,0]=2 2033 B8R0.18 CC(Br)C(CC)C(O)=O Amb25351353 [0,0,0,0,2,0|2,0,0]=4 2034 B8R0.18 CC(C(C(=O)O)C#N)C Amb10066977 [0,0,0,0,2,0|0,0,2]=4 2035 B8R0.18 CC(C)C(C=C)C(O)=O Amb18642658 [0,0,0,0,2,0|1,0,1]=4 2036 B8R0.18 CC(C)C(C=O)C(O)=O Amb25122103 [0,0,0,0,2,0|1,0,1]=4 2037 B8R0.18 CC(C)C(CBr)C(O)=O Amb24429178 [0,0,0,0,2,0|1,0,0]=3 2038 B8R0.18 CC(C)C(CC)C(N)=O Amb25694336 [0,0,0,0,2,0|2,0,0]=4 2039 B8R0.18 CC(C)C(CC)C(O)=O Amb18972345 [0,0,0,0,2,0|1,0,0]=3 2040 B8R0.18 CC(C)C(CN)B(O)O Amb22831545 [0,0,0,0,2,0|1,0,1]=4 2041 B8R0.18 CC(C)C(CN)C(N)=O Amb18294193 [0,0,0,0,2,0|1,0,0]=3 2042 B8R0.18 CC(C)C(CN)C(O)=O Amb18987935 [0,0,0,0,2,0|0,0,0]=2 2043 B8R0.18 CC(C)C(CN)C(O)=O Amb19375052 [0,0,0,0,2,0|0,0,0]=2 2044 B8R0.18 CC(C)C(CO)C(C)=O Amb24370150 [0,0,0,0,2,0|2,0,0]=4 2045 B8R0.18 CC(C)C(CO)C(O)=O Amb24116921 [0,0,0,0,2,0|1,0,0]=3 2046 B8R0.18 CC(C)C(N=O)C(O)=O Amb25292210 [0,0,0,0,2,0|2,0,0]=4 2047 B8R0.18 CC(C)C(NBr)C(O)=O Amb24648440 [0,0,0,0,2,0|2,0,0]=4 2048 B8R0.18 CC(C)C(NC)C(O)=O Amb21961623 [0,0,0,0,2,0|2,0,0]=4 2049 B8R0.18 CC(C)C(NCl)C(O)=O Amb24480122 [0,0,0,0,2,0|2,0,0]=4 2050 B8R0.18 CC(C)C(NN)C(O)=O Amb18642886 [0,0,0,0,2,0|1,0,0]=3 2051 B8R0.18 CC(C)C(ON)C(O)=O Amb24477865 [0,0,0,0,2,0|1,0,0]=3 2052 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756745 [0,0,0,0,2,0|0,0,0]=2 2053 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756747 [0,0,0,0,2,0|0,0,0]=2 2054 B8R0.18 CC(C)[C@@H](CO)C(O)=O Amb24588987 [0,0,0,0,2,0|1,0,0]=3 2055 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22231334 [0,0,0,0,2,0|2,0,0]=4 2056 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22749002 [0,0,0,0,2,0|2,0,0]=4 2057 B8R0.18 CC(C)[C@@H](ON)C(O)=O Amb24117143 [0,0,0,0,2,0|1,0,0]=3 2058 B8R0.18 CC(C)[C@H](CC)C(C)=O Amb25064658 [0,0,0,0,2,0|2,0,0]=4 2059 B8R0.18 CC(C)[C@H](CN)C(O)=O Amb25283442 [0,0,0,0,2,0|0,0,0]=2 2060 B8R0.18 CC(C)[C@H](ON)C(O)=O Amb25785764 [0,0,0,0,2,0|1,0,0]=3 2061 B8R0.18 CC(O)C(CC)C(O)=O Amb18990651 [0,0,0,0,2,0|2,0,0]=4 2062 B8R0.18 CC(O)C(CO)C(O)=O Amb24759475 [0,0,0,0,2,0|2,0,0]=4 2063 B8R0.18 CC(O)C(NN)C(O)=O Amb18642940 [0,0,0,0,2,0|2,0,0]=4 2064 B8R0.18 CCC(C(O)=O)N(C)C Amb20627822 [0,0,0,0,2,0|2,0,0]=4 2065 B8R0.18 CC[C@@H](C(O)=O)N(C)C Amb25823446 [0,0,0,0,2,0|2,0,0]=4 2066 B8R0.18 CN(C)C(CF)C(O)=O Amb25216064 [0,0,0,0,2,0|2,0,0]=4 2067 B8R0.18 CN(C)C(CO)C(O)=O Amb24407402 [0,0,0,0,2,0|2,0,0]=4 2068 B8R0.18 CN(C)[C@@H](CF)C(O)=O Amb24407184 [0,0,0,0,2,0|2,0,0]=4 2069 B8R0.18 CN(C)[C@@H](CS)C(O)=O Amb24120376 [0,0,0,0,2,0|2,0,0]=4 2070 B8R0.18 CN(C)[C@H](CS)C(O)=O Amb24405547 [0,0,0,0,2,0|2,0,0]=4 2071 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,0,0,0,2,0|2,0,0]=4 2072 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,0,0,0,2,0|2,0,0]=4 2073 B8R0.18 C[C@@H](N)[C@@H](CC)C(O)=O Amb24709757 [0,0,0,0,2,0|2,0,0]=4 2074 B8R0.18 C[C@@H](O)[C@H](CN)C(O)=O Amb24715545 [0,0,0,0,2,0|1,0,0]=3 2075 B8R0.18 C[C@H](O)[C@H](NN)C(O)=O Amb25032229 [0,0,0,0,2,0|2,0,0]=4 2076 B8R0.18 SCC(C(=O)O)C(C)C Amb17593703 [0,0,0,0,2,0|1,0,0]=3 2077 B10R0.27 CCCC(CCC(O)=O)OC Amb23538337 [1,0,0,0,0,1|2,0,0]=4 2078 B10R0.96 CC(=O)NCC(C)CC(O)=O Amb25385229 [1,0,0,0,0,1|1,0,1]=4 2079 B10R0.96 CC(=O)NC[C@H](C)CC(O)=O Amb25384945 [1,0,0,0,0,1|1,0,1]=4 2080 B10R0.96 CC(C)=CCC(C)CC(O)=O Amb25381501 [1,0,0,0,0,1|0,0,1]=3 2081 B10R0.96 CC(C)=C[C@H](C)CCC(O)=O Amb25386227 [1,0,0,0,0,1|0,0,2]=4 2082 B10R0.96 CC(C)CC(C)CCC(O)=O Amb22641855 [1,0,0,0,0,1|0,0,0]=2 2083 B10R0.96 CC(C)CC(C)NNC(N)=O Amb24764883 [1,0,0,0,0,1|2,0,0]=4 2084 B10R0.96 CC(C)CC(C)\C=C\C(C)=O Amb24750733 [1,0,0,0,0,1|1,0,1]=4 2085 B10R0.96 CC(C)CC(C)\C=C\C(O)=O Amb24750727 [1,0,0,0,0,1|0,0,1]=3 2086 B10R0.96 CC(C)CC(O)CCC(O)=O Amb18797782 [1,0,0,0,0,1|1,0,0]=3 2087 B10R0.96 CC(C)CCC(C)NC(C)=O Amb25379480 [1,0,0,0,0,1|2,0,0]=4 2088 B10R0.96 CC(C)CN(C)\C=C\C(O)=O Amb24755180 [1,0,0,0,0,1|1,0,1]=4 2089 B10R0.96 CC(C)COC(C)NC(C)=O Amb25384745 [1,0,0,0,0,1|2,0,0]=4 2090 B10R0.96 CC(C)C[C@@H](N)\C=C\C(O)=O Amb25385180 [1,0,0,0,0,1|0,0,1]=3 2091 B10R0.96 CC(C)N=C(N)SCC(O)=O Amb25385226 [1,0,0,0,0,1|1,0,1]=4 2092 B10R0.96 CC(C)\C=C\C(N)CC(N)=O Amb24758206 [1,0,0,0,0,1|1,0,1]=4 2093 B10R0.96 CC(C)\C=C\C(N)CC(O)=O Amb25384149 [1,0,0,0,0,1|0,0,1]=3 2094 B10R0.96 CC(CC(=O)NCC(=O)O)C Amb1113772 [1,0,0,0,0,1|1,0,1]=4 2095 B10R0.96 CC(CC(C)C)=C=CC(O)=O Amb25094266 [1,0,0,0,0,1|0,0,2]=4 2096 B10R0.96 CC(CC(C)C)=CCC(O)=O Amb25385173 [1,0,0,0,0,1|0,0,1]=3 2097 B10R0.96 CC(CNC(=O)CC(=O)O)C Amb17400041 [1,0,0,0,0,1|1,0,1]=4 2098 B10R0.96 CC(CNC(C)C)=CC(O)=O Amb25381550 [1,0,0,0,0,1|0,0,2]=4 2099 B10R0.96 CN(C)\C=C\C(N)CC(O)=O Amb25384150 [1,0,0,0,0,1|1,0,1]=4 2100 B10R0.84 CC(C)=CCC(CC)C(O)=O Amb18125991 [0,0,0,0,1,1|1,0,1]=4 2101 B10R0.84 CC(C)=CCC(CO)C(O)=O Amb25380559 [0,0,0,0,1,1|1,0,1]=4 2102 B10R0.84 CC(C)=NOC(CN)C(O)=O Amb24754581 [0,0,0,0,1,1|1,0,1]=4 2103 B10R0.84 CC(C)C(CCC(O)=O)C#N Amb25386196 [0,0,0,0,1,1|0,0,2]=4 2104 B10R0.84 CC(C)C(CNC(C)=O)ON Amb24765834 [0,0,0,0,1,1|2,0,0]=4 2105 B10R0.84 CC(C)C(CNC(N)=O)ON Amb24766028 [0,0,0,0,1,1|2,0,0]=4 2106 B10R0.84 CC(C)CCC(C#N)C(O)=O Amb25386199 [0,0,0,0,1,1|0,0,2]=4