0 B9R0.1 C#CC(=O)CCCC(=O)Cl Amb24523161 [0,0,0,0,0,0|2,0,1]=3 1 B9R0.1 C#CC(=O)NCCC(N)=O Amb25279631 [0,0,0,0,0,0|3,0,1]=4 2 B9R0.1 C#CC(F)CCCC(O)=O Amb25340465 [0,0,0,0,0,0|2,0,2]=4 3 B9R0.1 C#C[C@H](F)CCCC(O)=O Amb25113496 [0,0,0,0,0,0|2,0,2]=4 4 B9R0.1 C=CC(=O)NCCC([O-])=O Amb20668483 [0,0,0,0,0,0|2,0,2]=4 5 B9R0.1 C=CC(=O)OCCC(O)=O Amb18644058 [0,0,0,0,0,0|2,0,1]=3 6 B9R0.1 C=CC(O)CCCC(O)=O Amb25137244 [0,0,0,0,0,0|1,0,3]=4 7 B9R0.1 C=C[C@@H](O)CCCC(O)=O Amb24352126 [0,0,0,0,0,0|1,0,3]=4 8 B9R0.1 CC(=C)CCCC(=O)C=C Amb25146598 [0,0,0,0,0,0|3,0,1]=4 9 B9R0.1 CC(=C)CCCC(=O)CC Amb25832230 [0,0,0,0,0,0|3,0,0]=3 10 B9R0.1 CC(=C)CCNC(=O)CC Amb24544729 [0,0,0,0,0,0|4,0,0]=4 11 B9R0.1 CC(=C)CCNC(=O)NC Amb25321294 [0,0,0,0,0,0|4,0,0]=4 12 B9R0.1 CC(=C)CNCC(=O)OC Amb25139895 [0,0,0,0,0,0|3,0,0]=3 13 B9R0.1 CC(=C)C\C=C\C(=O)OC Amb24657689 [0,0,0,0,0,0|2,0,2]=4 14 B9R0.1 CC(=C)\C=C\CC(=O)OC Amb24712606 [0,0,0,0,0,0|2,0,2]=4 15 B9R0.1 CC(=O)C#COC(=O)OC Amb24415049 [0,0,0,0,0,0|2,0,2]=4 16 B9R0.1 CC(=O)C=C=CC(=O)OC Amb25187269 [0,0,0,0,0,0|1,0,3]=4 17 B9R0.1 CC(=O)CCCC(=C)C=C Amb25755744 [0,0,0,0,0,0|3,0,1]=4 18 B9R0.1 CC(=O)CCCC(=N)NN Amb25146305 [0,0,0,0,0,0|4,0,0]=4 19 B9R0.1 CC(=O)CCCC(=O)CC Amb24093547 [0,0,0,0,0,0|2,0,0]=2 20 B9R0.1 CC(=O)CCCC(=O)NC Amb25790088 [0,0,0,0,0,0|2,0,0]=2 21 B9R0.1 CC(=O)CCOC(=O)CC Amb25318811 [0,0,0,0,0,0|3,0,0]=3 22 B9R0.1 CC(=O)CCOC(=O)CCl Amb24480607 [0,0,0,0,0,0|4,0,0]=4 23 B9R0.1 CC(=O)CCOC(=O)CO Amb24482823 [0,0,0,0,0,0|4,0,0]=4 24 B9R0.1 CC(=O)CCOC(=O)CS Amb25286689 [0,0,0,0,0,0|4,0,0]=4 25 B9R0.1 CC(=O)CSCC(=C)CC Amb24465878 [0,0,0,0,0,0|4,0,0]=4 26 B9R0.1 CC(=O)CSCC(=O)NC Amb25783382 [0,0,0,0,0,0|3,0,0]=3 27 B9R0.1 CC(=O)C\C=C\C(=O)OC Amb24670506 [0,0,0,0,0,0|1,0,2]=3 28 B9R0.1 CC(=O)NCCC(=O)CBr Amb24551664 [0,0,0,0,0,0|4,0,0]=4 29 B9R0.1 CC(=O)NCCC(=O)NC Amb25793084 [0,0,0,0,0,0|3,0,0]=3 30 B9R0.1 CC(=O)NCCC(=O)SC Amb25279099 [0,0,0,0,0,0|2,1,0]=3 31 B9R0.1 CC(=O)OCCC(=O)C=C Amb24408459 [0,0,0,0,0,0|3,0,1]=4 32 B9R0.1 CC(=O)OCCC(=O)CCl Amb25707775 [0,0,0,0,0,0|4,0,0]=4 33 B9R0.1 CC(=O)OCNC(=O)OC Amb25147326 [0,0,0,0,0,0|3,0,0]=3 34 B9R0.1 CC(=O)SCCC(=O)CC Amb24633438 [0,0,0,0,0,0|3,0,0]=3 35 B9R0.1 CC(=O)SCCC(=O)CCl Amb24436675 [0,0,0,0,0,0|4,0,0]=4 36 B9R0.1 CC(=O)\C=C\CC(=O)OC Amb25205440 [0,0,0,0,0,0|1,0,2]=3 37 B9R0.1 CC(=O)\C=C\NC(=O)OC Amb25288496 [0,0,0,0,0,0|2,0,2]=4 38 B9R0.1 CC(=O)\C=N\CC(=O)OC Amb25094290 [0,0,0,0,0,0|2,0,1]=3 39 B9R0.1 CC(C)=NOCC(=O)OC Amb24478437 [0,0,0,0,0,0|4,0,0]=4 40 B9R0.1 CC(CC)=NNCC(O)=O Amb25162373 [0,0,0,0,0,0|4,0,0]=4 41 B9R0.1 CC(CC)=NOCC(O)=O Amb25266480 [0,0,0,0,0,0|4,0,0]=4 42 B9R0.1 CC(CCCC(C)=O)=C=C Amb25689180 [0,0,0,0,0,0|3,0,1]=4 43 B9R0.1 CC(CCCC(O)=O)C#N Amb18643710 [0,0,0,0,0,0|3,0,1]=4 44 B9R0.1 CC(CCCC(O)=O)C=C Amb24716210 [0,0,0,0,0,0|2,0,2]=4 45 B9R0.1 CC(CCCC(O)=O)CO Amb25068017 [0,0,0,0,0,0|3,0,1]=4 46 B9R0.1 CC(CCl)CCCC(O)=O Amb18646189 [0,0,0,0,0,0|3,0,1]=4 47 B9R0.1 CC(CNCC(O)=O)=CCl Amb24482539 [0,0,0,0,0,0|4,0,0]=4 48 B9R0.1 CC(COCC(O)=O)=CCl Amb24482508 [0,0,0,0,0,0|4,0,0]=4 49 B9R0.1 CC(O)CCCC(=O)C=C Amb24478307 [0,0,0,0,0,0|2,0,2]=4 50 B9R0.1 CC(O)CCCC(=O)NN Amb24352284 [0,0,0,0,0,0|3,0,1]=4 51 B9R0.1 CCC(=C)CCCC(C)O Amb24529321 [0,0,0,0,0,0|3,0,1]=4 52 B9R0.1 CCC(=C)CNCC(N)=O Amb24706049 [0,0,0,0,0,0|4,0,0]=4 53 B9R0.1 CCC(=O)CCCS(C)=O Amb24452285 [0,0,0,0,0,0|3,0,0]=3 54 B9R0.1 CCC(=O)CCC[C@H](C)O Amb25723337 [0,0,0,0,0,0|2,0,1]=3 55 B9R0.1 CCC(=O)CSCC(N)=O Amb25229958 [0,0,0,0,0,0|3,0,0]=3 56 B9R0.1 CCC(=O)NCCC(=O)C Amb17102869 [0,0,0,0,0,0|3,0,0]=3 57 B9R0.1 CCC(=O)NCCC(=O)N Amb17231982 [0,0,0,0,0,0|3,0,0]=3 58 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,0,0,0,0,0|2,0,0]=2 59 B9R0.1 CCC(=O)NCCC(=S)N Amb17232333 [0,0,0,0,0,0|3,1,0]=4 60 B9R0.1 CCC(=O)NCCS(C)=O Amb24685610 [0,0,0,0,0,0|4,0,0]=4 61 B9R0.1 CCC(=O)NCC[C@@H](C)O Amb25795858 [0,0,0,0,0,0|3,0,1]=4 62 B9R0.1 CCC(=O)NCC[C@H](C)O Amb24386638 [0,0,0,0,0,0|3,0,1]=4 63 B9R0.1 CCC(=O)OCCC(C)O Amb24735173 [0,0,0,0,0,0|3,0,1]=4 64 B9R0.1 CCC(=O)OCCC(N)=O Amb24482884 [0,0,0,0,0,0|3,0,0]=3 65 B9R0.1 CCC(=O)OCOC(=O)Cl Amb25212596 [0,0,0,0,0,0|4,0,0]=4 66 B9R0.1 CCC(C)CCCC(C)=O Amb24424926 [0,0,0,0,0,0|3,0,1]=4 67 B9R0.1 CCC(C)CCCC(N)=O Amb24350177 [0,0,0,0,0,0|3,0,1]=4 68 B9R0.1 CCC(C)CCCC(O)=O Amb18124682 [0,0,0,0,0,0|2,0,1]=3 69 B9R0.1 CCC(C)CSCC(O)=O Amb18800668 [0,0,0,0,0,0|3,0,1]=4 70 B9R0.1 CCC(Cl)CCCC(=O)Cl Amb25088358 [0,0,0,0,0,0|3,0,1]=4 71 B9R0.1 CCC(F)CCCC(C)=O Amb25320248 [0,0,0,0,0,0|3,0,1]=4 72 B9R0.1 CCC(N)COCC(O)=O Amb18630610 [0,0,0,0,0,0|3,0,1]=4 73 B9R0.1 CCC(O)CCCC(C)=O Amb25146602 [0,0,0,0,0,0|2,0,2]=4 74 B9R0.1 CCC(O)CCCC(O)=O Amb18644263 [0,0,0,0,0,0|1,0,2]=3 75 B9R0.1 CCC(O)COCC(O)=O Amb25805810 [0,0,0,0,0,0|2,0,2]=4 76 B9R0.1 CCC(O)CSCC(O)=O Amb18792573 [0,0,0,0,0,0|2,0,2]=4 77 B9R0.1 CCS(=O)CCCC(O)=O Amb18788302 [0,0,0,0,0,0|2,0,0]=2 78 B9R0.1 CC[C@H](C)CCCC(C)=O Amb25128211 [0,0,0,0,0,0|3,0,1]=4 79 B9R0.1 CC\C(\C)=C/CCC(C)=O Amb25138109 [0,0,0,0,0,0|3,0,1]=4 80 B9R0.1 CN(CCCC(O)=O)C=O Amb19010086 [0,0,0,0,0,0|4,0,0]=4 81 B9R0.1 CNC(=O)CCCC(N)=O Amb24746424 [0,0,0,0,0,0|2,0,0]=2 82 B9R0.1 CNC(=O)CCCC([O-])=O Amb24271120 [0,0,0,0,0,0|1,0,1]=2 83 B9R0.1 CNC(=O)CCCN(C)C Amb24696256 [0,0,0,0,0,0|4,0,0]=4 84 B9R0.1 CNC(=O)CCNC(N)=O Amb24361117 [0,0,0,0,0,0|3,0,0]=3 85 B9R0.1 CNC(=O)CCNC(N)=S Amb18183468 [0,0,0,0,0,0|3,1,0]=4 86 B9R0.1 CNC(=O)CNCC(=C)Br Amb18303977 [0,0,0,0,0,0|4,0,0]=4 87 B9R0.1 CNC(=O)CNCC(=C)Cl Amb18303621 [0,0,0,0,0,0|4,0,0]=4 88 B9R0.1 CNC(=O)COCC(=O)O Amb17232024 [0,0,0,0,0,0|2,0,0]=2 89 B9R0.1 CNC(=O)CSCC(=C)Br Amb24271141 [0,0,0,0,0,0|4,0,0]=4 90 B9R0.1 CNC(=O)CSCC(=C)Cl Amb25099948 [0,0,0,0,0,0|4,0,0]=4 91 B9R0.1 CNC(=O)CSCC(C)O Amb24402730 [0,0,0,0,0,0|3,0,1]=4 92 B9R0.1 CNC(=O)CSC[C@H](C)O Amb25169392 [0,0,0,0,0,0|3,0,1]=4 93 B9R0.1 CNC(=O)NCCC(=O)O Amb1127025 [0,0,0,0,0,0|2,0,0]=2 94 B9R0.1 CNC(=O)NCCC(N)=N Amb25716347 [0,0,0,0,0,0|4,0,0]=4 95 B9R0.1 CNC(=O)NCCC(N)=O Amb24421939 [0,0,0,0,0,0|3,0,0]=3 96 B9R0.1 CNC(=O)NCC[C@@H](C)O Amb24482616 [0,0,0,0,0,0|3,0,1]=4 97 B9R0.1 CNC(=O)N\C=C\C(O)=O Amb22960481 [0,0,0,0,0,0|2,0,2]=4 98 B9R0.1 CNC(=O)SCCC(O)=O Amb25240640 [0,0,0,0,0,0|2,0,0]=2 99 B9R0.1 CNC(=S)NCCC(N)=O Amb25789137 [0,0,0,0,0,0|3,1,0]=4 100 B9R0.1 CNC(=S)NCCC(O)=O Amb24482274 [0,0,0,0,0,0|2,1,0]=3 101 B9R0.1 CNC(=S)SCCC(O)=O Amb25794447 [0,0,0,0,0,0|2,1,0]=3 102 B9R0.1 COC(=O)C=C=CC(O)=O Amb25694013 [0,0,0,0,0,0|0,0,3]=3 103 B9R0.1 COC(=O)CCCB(O)O Amb25676456 [0,0,0,0,0,0|1,0,1]=2 104 B9R0.1 COC(=O)CCCC(=C)Br Amb24717516 [0,0,0,0,0,0|2,0,0]=2 105 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [0,0,0,0,0,0|1,0,0]=1 106 B9R0.1 COC(=O)CCCC(C)Br Amb24346809 [0,0,0,0,0,0|2,0,1]=3 107 B9R0.1 COC(=O)CCCC(C)C Amb22586581 [0,0,0,0,0,0|2,0,1]=3 108 B9R0.1 COC(=O)CCCC(C)Cl Amb24626627 [0,0,0,0,0,0|2,0,1]=3 109 B9R0.1 COC(=O)CCCC(C)O Amb24414468 [0,0,0,0,0,0|1,0,1]=2 110 B9R0.1 COC(=O)CCCC(N)=N Amb24410040 [0,0,0,0,0,0|2,0,0]=2 111 B9R0.1 COC(=O)CCCC(N)=S Amb25360938 [0,0,0,0,0,0|1,1,0]=2 112 B9R0.1 COC(=O)CCCS(C)=O Amb18788307 [0,0,0,0,0,0|2,0,0]=2 113 B9R0.1 COC(=O)CCC[N+](=O)[O-] Amb1073683 [0,0,0,0,0,0|1,0,1]=2 114 B9R0.1 COC(=O)CCNC(=O)C Amb15691935 [0,0,0,0,0,0|2,0,0]=2 115 B9R0.1 COC(=O)CCNC(N)=N Amb24682015 [0,0,0,0,0,0|3,0,0]=3 116 B9R0.1 COC(=O)CCNC(N)=O Amb22740124 [0,0,0,0,0,0|2,0,0]=2 117 B9R0.1 COC(=O)CCNC(N)=S Amb18788132 [0,0,0,0,0,0|2,1,0]=3 118 B9R0.1 COC(=O)CCNN(C)C Amb24113609 [0,0,0,0,0,0|4,0,0]=4 119 B9R0.1 COC(=O)CCSC(C)C Amb18800665 [0,0,0,0,0,0|3,0,1]=4 120 B9R0.1 COC(=O)CCSC(F)F Amb25714489 [0,0,0,0,0,0|3,0,1]=4 121 B9R0.1 COC(=O)CNCC(=C)Br Amb25214424 [0,0,0,0,0,0|3,0,0]=3 122 B9R0.1 COC(=O)CNCC(=C)Cl Amb18800729 [0,0,0,0,0,0|3,0,0]=3 123 B9R0.1 COC(=O)CNCC(F)F Amb18179465 [0,0,0,0,0,0|3,0,1]=4 124 B9R0.1 COC(=O)CNC[C@H](C)O Amb25773564 [0,0,0,0,0,0|2,0,1]=3 125 B9R0.1 COC(=O)COCC(C)Cl Amb25257984 [0,0,0,0,0,0|3,0,1]=4 126 B9R0.1 COC(=O)COCC(N)=O Amb25734268 [0,0,0,0,0,0|2,0,0]=2 127 B9R0.1 COC(=O)COCC(O)=O Amb25305044 [0,0,0,0,0,0|1,0,0]=1 128 B9R0.1 COC(=O)CONC(N)=O Amb25147372 [0,0,0,0,0,0|3,0,0]=3 129 B9R0.1 COC(=O)CSCC(=C)Br Amb24445903 [0,0,0,0,0,0|3,0,0]=3 130 B9R0.1 COC(=O)CSCC(=C)Cl Amb25168594 [0,0,0,0,0,0|3,0,0]=3 131 B9R0.1 COC(=O)CSCC(=O)C Amb2444691 [0,0,0,0,0,0|2,0,0]=2 132 B9R0.1 COC(=O)CSCC(C)O Amb18792574 [0,0,0,0,0,0|2,0,1]=3 133 B9R0.1 COC(=O)CSCC(N)=O Amb18800701 [0,0,0,0,0,0|2,0,0]=2 134 B9R0.1 COC(=O)CSC[C@@H](C)O Amb24375131 [0,0,0,0,0,0|2,0,1]=3 135 B9R0.1 COC(=O)CSC[C@H](C)N Amb24396440 [0,0,0,0,0,0|3,0,1]=4 136 B9R0.1 COC(=O)CSC[C@H](C)O Amb24375132 [0,0,0,0,0,0|2,0,1]=3 137 B9R0.1 COC(=O)C\C=C\C(O)=O Amb25132100 [0,0,0,0,0,0|0,0,2]=2 138 B9R0.1 COC(=O)NCCC(C)C Amb17793051 [0,0,0,0,0,0|3,0,1]=4 139 B9R0.1 COC(=O)NCCC(C)N Amb25736003 [0,0,0,0,0,0|3,0,1]=4 140 B9R0.1 COC(=O)NCCC(C)O Amb24747341 [0,0,0,0,0,0|2,0,1]=3 141 B9R0.1 COC(=O)NCCC(F)F Amb25075026 [0,0,0,0,0,0|3,0,1]=4 142 B9R0.1 COC(=O)NCCC(N)=O Amb24459803 [0,0,0,0,0,0|2,0,0]=2 143 B9R0.1 COC(=O)NCCC(N)=S Amb18182596 [0,0,0,0,0,0|2,1,0]=3 144 B9R0.1 COC(=O)NCCN(C)C Amb25229032 [0,0,0,0,0,0|4,0,0]=4 145 B9R0.1 COC(=O)NCC[C@@H](C)O Amb24353280 [0,0,0,0,0,0|2,0,1]=3 146 B9R0.1 COC(=O)NN=CC(O)=O Amb24427251 [0,0,0,0,0,0|2,0,1]=3 147 B9R0.1 COC(=O)NNCC(O)=O Amb25317249 [0,0,0,0,0,0|2,0,0]=2 148 B9R0.1 COC(=O)NOCC(N)=O Amb24721208 [0,0,0,0,0,0|3,0,0]=3 149 B9R0.1 COC(=O)N\C=C/C(O)=O Amb25104759 [0,0,0,0,0,0|1,0,2]=3 150 B9R0.1 COC(=O)N\C=C\C(N)=O Amb25222616 [0,0,0,0,0,0|2,0,2]=4 151 B9R0.1 COC(=O)N\C=C\C(O)=O Amb24550444 [0,0,0,0,0,0|1,0,2]=3 152 B9R0.1 COC(=O)\C=C/NC(N)=O Amb24624664 [0,0,0,0,0,0|2,0,2]=4 153 B9R0.1 COC(=O)\C=C\CC(C)O Amb24396746 [0,0,0,0,0,0|1,0,3]=4 154 B9R0.1 COC(=S)NCCC(N)=S Amb25707962 [0,0,0,0,0,0|2,2,0]=4 155 B9R0.1 COC(=S)NN=CC(O)=O Amb24711749 [0,0,0,0,0,0|2,1,1]=4 156 B9R0.1 COC(=S)N\N=C/C(O)=O Amb24068314 [0,0,0,0,0,0|2,1,1]=4 157 B9R0.1 COC(=S)N\N=C\C(O)=O Amb24100367 [0,0,0,0,0,0|2,1,1]=4 158 B9R0.1 COC(=S)SCCC(N)=O Amb25172010 [0,0,0,0,0,0|2,1,0]=3 159 B9R0.1 COC(=S)S\C=C\C(O)=O Amb24443125 [0,0,0,0,0,0|1,1,2]=4 160 B9R0.1 COC(C)CCCC(C)=O Amb25146522 [0,0,0,0,0,0|2,0,1]=3 161 B9R0.1 COC(C)CCCC(O)=O Amb25728362 [0,0,0,0,0,0|1,0,1]=2 162 B9R0.1 COC(C)CCOC(=O)Cl Amb22168236 [0,0,0,0,0,0|3,0,1]=4 163 B9R0.1 COC(C)CCOC(C)=O Amb19958959 [0,0,0,0,0,0|3,0,1]=4 164 B9R0.1 COC(C)CCOC(N)=O Amb25679672 [0,0,0,0,0,0|3,0,1]=4 165 B9R0.1 COC(C)CNCC(O)=O Amb25695493 [0,0,0,0,0,0|2,0,1]=3 166 B9R0.1 CON(C)CCOC(N)=O Amb24478870 [0,0,0,0,0,0|4,0,0]=4 167 B9R0.1 CO[13C](=O)CCC[13C](=O)O Amb17618084 [0,0,0,0,0,0|0,0,0]=0 168 B9R0.1 CO[13C](=O)CCC[13C](=O)[13CH3] Amb17617715 [0,0,0,0,0,0|1,0,0]=1 169 B9R0.1 CSC(=S)NCCC(N)=O Amb25772856 [0,0,0,0,0,0|2,2,0]=4 170 B9R0.1 CSC(=S)NCCC(O)=O Amb25708472 [0,0,0,0,0,0|1,2,0]=3 171 B9R0.1 CSC(C)CCCC(O)=O Amb25265803 [0,0,0,0,0,0|1,1,1]=3 172 B9R0.1 CSC(C)CNCC(O)=O Amb25137618 [0,0,0,0,0,0|2,1,1]=4 173 B9R0.1 C[C@@H](CCCC(O)=O)C=C Amb24447465 [0,0,0,0,0,0|2,0,2]=4 174 B9R0.1 C[C@H](CCCC(O)=O)C=C Amb25367325 [0,0,0,0,0,0|2,0,2]=4 175 B9R0.1 C\C(=C\CCC(O)=O)\C=C Amb18643583 [0,0,0,0,0,0|2,0,2]=4 176 B9R0.1 C\C(\CCCC(O)=O)=C\C Amb25063828 [0,0,0,0,0,0|2,0,0]=2 177 B9R0.1 C\C(\CNCC(O)=O)=C/C Amb24351586 [0,0,0,0,0,0|3,0,0]=3 178 B9R0.1 C\C(\CNCC(O)=O)=C\C Amb25175094 [0,0,0,0,0,0|3,0,0]=3 179 B9R0.1 C\C(\COCC(O)=O)=C\C Amb25293393 [0,0,0,0,0,0|3,0,0]=3 180 B9R0.1 NC(=O)CCNC(=O)CN Amb21929344 [0,0,0,0,0,0|4,0,0]=4 181 B9R0.1 NC(=O)CCNC(=O)CO Amb25739339 [0,0,0,0,0,0|4,0,0]=4 182 B9R0.1 NC(=O)CCSC(=O)CN Amb25824263 [0,0,0,0,0,0|4,0,0]=4 183 B9R0.1 NC(=O)CSCC(=O)NN Amb24632664 [0,0,0,0,0,0|4,0,0]=4 184 B9R0.1 NC(=O)NCCC(=O)NO Amb25796572 [0,0,0,0,0,0|4,0,0]=4 185 B9R0.1 NC(=O)SCCC(=O)NN Amb24707302 [0,0,0,0,0,0|4,0,0]=4 186 B9R0.1 NC(CCCC(O)=O)=NO Amb24383149 [0,0,0,0,0,0|3,0,0]=3 187 B9R0.1 NC(CCCC(O)=O)C=O Amb25075707 [0,0,0,0,0,0|3,0,1]=4 188 B9R0.1 NC(CS)CCCC(O)=O Amb25706315 [0,0,0,0,0,0|3,0,1]=4 189 B9R0.1 NCC(=O)CCCC(O)=O Amb18202122 [0,0,0,0,0,0|2,0,0]=2 190 B9R0.1 NCC(=O)CCCC(O)=O Amb22035333 [0,0,0,0,0,0|2,0,0]=2 191 B9R0.1 NCC(=O)NNCC(O)=O Amb25142422 [0,0,0,0,0,0|4,0,0]=4 192 B9R0.1 NCC(N)CCCC(O)=O Amb24375177 [0,0,0,0,0,0|3,0,1]=4 193 B9R0.1 NC[C@@H](N)CCCC(O)=O Amb25147297 [0,0,0,0,0,0|3,0,1]=4 194 B9R0.1 NNC(=N)SCCC(O)=O Amb24502294 [0,0,0,0,0,0|4,0,0]=4 195 B9R0.1 NNC(=O)CCCC(O)=O Amb25809648 [0,0,0,0,0,0|2,0,0]=2 196 B9R0.1 NNC(=O)COCC(O)=O Amb25133545 [0,0,0,0,0,0|3,0,0]=3 197 B9R0.1 NNC(=O)SCCC(O)=O Amb24482179 [0,0,0,0,0,0|3,0,0]=3 198 B9R0.1 N[C@@H](CS)CCCC(O)=O Amb25288626 [0,0,0,0,0,0|3,0,1]=4 199 B9R0.1 N[C@H](CS)CCCC(O)=O Amb24482180 [0,0,0,0,0,0|3,0,1]=4 200 B9R0.1 N\C(\CSCC(O)=O)=C/N Amb24069132 [0,0,0,0,0,0|4,0,0]=4 201 B9R0.1 N\C(\NCCC(O)=O)=N/N Amb24682101 [0,0,0,0,0,0|4,0,0]=4 202 B9R0.1 O=NN(CCCC(=O)O)C Amb17618588 [0,0,0,0,0,0|4,0,0]=4 203 B9R0.1 OC(=O)CCCC(Cl)CCl Amb18649051 [0,0,0,0,0,0|3,0,1]=4 204 B9R0.1 OC(=O)CCCN(O)C=O Amb25320259 [0,0,0,0,0,0|3,0,1]=4 205 B9R0.1 OC(=O)CCNC(=O)CBr Amb17609911 [0,0,0,0,0,0|3,0,0]=3 206 B9R0.1 OC(=O)CCNC(=O)CO Amb24478846 [0,0,0,0,0,0|3,0,0]=3 207 B9R0.1 OC(=O)CCNC(=O)CS Amb24754483 [0,0,0,0,0,0|3,0,0]=3 208 B9R0.1 OC(=O)COCC(Cl)=CCl Amb25146950 [0,0,0,0,0,0|4,0,0]=4 209 B9R0.1 OC(=O)CONC(=O)CCl Amb25825072 [0,0,0,0,0,0|4,0,0]=4 210 B9R0.1 OC(=O)CSCC(Cl)=CCl Amb24658465 [0,0,0,0,0,0|4,0,0]=4 211 B8R0.6 BrCCCCC(=O)NC Amb17235862 [1,0,0,0,0,0|2,0,1]=4 212 B8R0.6 C#CC(=O)CCCCO Amb25838830 [1,0,0,0,0,0|1,0,2]=4 213 B8R0.6 C=C(CCCC=O)C=O Amb25338086 [1,0,0,0,0,0|3,0,0]=4 214 B8R0.6 C=C=CCCC(=O)OC Amb10605302 [1,0,0,0,0,0|1,0,2]=4 215 B8R0.6 C=CC(=C)CCCC=O Amb18642214 [1,0,0,0,0,0|2,0,1]=4 216 B8R0.6 C=CCCCC(=O)C#C Amb25251962 [1,0,0,0,0,0|2,0,1]=4 217 B8R0.6 C=CCCCC(=O)C#N Amb25807418 [1,0,0,0,0,0|3,0,0]=4 218 B8R0.6 C=CCCCC(=O)CO Amb25114937 [1,0,0,0,0,0|3,0,0]=4 219 B8R0.6 C=CCCCC(=O)NN Amb24745072 [1,0,0,0,0,0|3,0,0]=4 220 B8R0.6 C=CCCCC(=O)NN Amb25332027 [1,0,0,0,0,0|3,0,0]=4 221 B8R0.6 C=CCCCC(=O)NO Amb25742329 [1,0,0,0,0,0|3,0,0]=4 222 B8R0.6 CC(CCCC=O)=C=C Amb25309689 [1,0,0,0,0,0|2,0,1]=4 223 B8R0.6 CCC(=C)CCCC=O Amb18642469 [1,0,0,0,0,0|2,0,0]=3 224 B8R0.6 CCC(=C)CCCCO Amb25057130 [1,0,0,0,0,0|2,0,1]=4 225 B8R0.6 CCC(=O)CCCC#N Amb25139954 [1,0,0,0,0,0|2,0,1]=4 226 B8R0.6 CCC(=O)CCCC=O Amb18642643 [1,0,0,0,0,0|1,0,0]=2 227 B8R0.6 CCC(=O)CCCCF Amb25842980 [1,0,0,0,0,0|2,0,1]=4 228 B8R0.6 CCC(=O)CCCCN Amb25757344 [1,0,0,0,0,0|2,0,1]=4 229 B8R0.6 CCC(=O)CCCNC Amb24411172 [1,0,0,0,0,0|3,0,0]=4 230 B8R0.6 CCC(=O)CCCSC Amb24433713 [1,0,0,0,0,0|3,0,0]=4 231 B8R0.6 CCC(=O)CNCC=C Amb24603096 [1,0,0,0,0,0|3,0,0]=4 232 B8R0.6 CCC(=O)NCCC=C Amb10562815 [1,0,0,0,0,0|3,0,0]=4 233 B8R0.6 CCC(=O)NCCC=O Amb17102166 [1,0,0,0,0,0|2,0,0]=3 234 B8R0.6 CCC(=O)OCCC=C Amb25315116 [1,0,0,0,0,0|3,0,0]=4 235 B8R0.6 CCC(=O)OCCC=O Amb18642741 [1,0,0,0,0,0|2,0,0]=3 236 B8R0.6 CCC(C)CCCC=O Amb18642680 [1,0,0,0,0,0|2,0,1]=4 237 B8R0.6 CCC(O)CCCC=O Amb25290333 [1,0,0,0,0,0|1,0,2]=4 238 B8R0.6 CCCCCC(=O)NC Amb24106949 [1,0,0,0,0,0|2,0,1]=4 239 B8R0.6 CCCCCC(=O)SC Amb22168308 [1,0,0,0,0,0|1,1,1]=4 240 B8R0.6 CCS(=O)CCCCO Amb24354490 [1,0,0,0,0,0|2,0,1]=4 241 B8R0.6 CCS(=O)CCNC=O Amb24481774 [1,0,0,0,0,0|3,0,0]=4 242 B8R0.6 CC\C(\C)=C\CCC=O Amb25779371 [1,0,0,0,0,0|2,0,1]=4 243 B8R0.6 CNC(=O)CCCSC Amb18411875 [1,0,0,0,0,0|3,0,0]=4 244 B8R0.6 CNC(=O)CSCC=C Amb18411972 [1,0,0,0,0,0|3,0,0]=4 245 B8R0.6 CNC(=O)CSCC=O Amb25683635 [1,0,0,0,0,0|2,0,0]=3 246 B8R0.6 CNCCCC(=O)NC Amb18303609 [1,0,0,0,0,0|3,0,0]=4 247 B8R0.6 CNCCCC(=O)NC Amb22098814 [1,0,0,0,0,0|3,0,0]=4 248 B8R0.6 CNCCNC(=O)OC Amb19027453 [1,0,0,0,0,0|3,0,0]=4 249 B8R0.6 COC(=N)CCCCCl Amb25300747 [1,0,0,0,0,0|2,0,1]=4 250 B8R0.6 COC(=O)C#CCCO Amb22230912 [1,0,0,0,0,0|0,0,3]=4 251 B8R0.6 COC(=O)CCCC=C Amb22730759 [1,0,0,0,0,0|1,0,0]=2 252 B8R0.6 COC(=O)CCCCN Amb18642844 [1,0,0,0,0,0|1,0,1]=3 253 B8R0.6 COC(=O)CCCCO Amb22641583 [1,0,0,0,0,0|0,0,1]=2 254 B8R0.6 COC(=O)CCCON Amb25266351 [1,0,0,0,0,0|2,0,0]=3 255 B8R0.6 COC(=O)CCCSC Amb19878350 [1,0,0,0,0,0|2,0,0]=3 256 B8R0.6 COC(=O)CCC[Zn]Br Amb22898091 [1,0,0,0,0,0|2,0,0]=3 257 B8R0.6 COC(=O)CCN=[N+]=[N-] Amb22900901 [1,0,0,0,0,0|3,0,0]=4 258 B8R0.6 COC(=O)CCNC=O Amb22234963 [1,0,0,0,0,0|1,0,0]=2 259 B8R0.6 COC(=O)COCC=O Amb25094456 [1,0,0,0,0,0|1,0,0]=2 260 B8R0.6 COC(=O)COCCN Amb24401799 [1,0,0,0,0,0|2,0,1]=4 261 B8R0.6 COC(=O)COCCO Amb24113538 [1,0,0,0,0,0|1,0,1]=3 262 B8R0.6 COC(=O)CSCCBr Amb25662052 [1,0,0,0,0,0|2,0,1]=4 263 B8R0.6 COC(=O)CSCCCl Amb24340126 [1,0,0,0,0,0|2,0,1]=4 264 B8R0.6 COC(=O)CSCCF Amb25821146 [1,0,0,0,0,0|2,0,1]=4 265 B8R0.6 COC(=O)CSCCN Amb19268671 [1,0,0,0,0,0|2,0,1]=4 266 B8R0.6 COC(=O)C\C=C\CO Amb24404592 [1,0,0,0,0,0|0,0,3]=4 267 B8R0.6 COC(=O)NCCC#C Amb24477847 [1,0,0,0,0,0|2,0,1]=4 268 B8R0.6 COC(=O)NCCC=O Amb18642833 [1,0,0,0,0,0|1,0,0]=2 269 B8R0.6 COC(=O)NCCSC Amb24379130 [1,0,0,0,0,0|3,0,0]=4 270 B8R0.6 COC(=O)NOCCO Amb24570213 [1,0,0,0,0,0|2,0,1]=4 271 B8R0.6 COC(=O)N\C=C\C=O Amb18642693 [1,0,0,0,0,0|1,0,2]=4 272 B8R0.6 COC(=O)OCCCBr Amb25361096 [1,0,0,0,0,0|2,0,1]=4 273 B8R0.6 COC(=O)OCCCF Amb24088642 [1,0,0,0,0,0|2,0,1]=4 274 B8R0.6 COC(=O)O\C=C\C=O Amb24710105 [1,0,0,0,0,0|1,0,2]=4 275 B8R0.6 COC(=O)\C=C/NC=O Amb24399087 [1,0,0,0,0,0|1,0,2]=4 276 B8R0.6 COC(=O)\C=C\CNO Amb25710722 [1,0,0,0,0,0|1,0,2]=4 277 B8R0.6 COC(=O)\C=C\NC=O Amb25024658 [1,0,0,0,0,0|1,0,2]=4 278 B8R0.6 COC(=S)CCCCCl Amb25145676 [1,0,0,0,0,0|1,1,1]=4 279 B8R0.6 COC(=S)SCCC=C Amb24645785 [1,0,0,0,0,0|2,1,0]=4 280 B8R0.6 COC(C)CCCCO Amb25835593 [1,0,0,0,0,0|1,0,2]=4 281 B8R0.6 COC(C)CCNC=O Amb24625265 [1,0,0,0,0,0|2,0,1]=4 282 B8R0.6 COCCCC(=N)OC Amb25127148 [1,0,0,0,0,0|3,0,0]=4 283 B8R0.6 CSC(=O)NCCCO Amb24680355 [1,0,0,0,0,0|1,1,1]=4 284 B8R0.6 CSCSCC(=O)OC Amb25162165 [1,0,0,0,0,0|3,0,0]=4 285 B8R0.6 C[ClH]C(=O)CCCCBr Amb25242949 [1,0,0,0,0,0|2,0,1]=4 286 B8R0.6 C\C=C\CCC(=O)NC Amb25339401 [1,0,0,0,0,0|2,0,1]=4 287 B8R0.6 NCCCCC(=O)OC Amb13951283 [1,0,0,0,0,0|1,0,1]=3 288 B8R0.6 O=CCCCC(=O)C=O Amb25093725 [1,0,0,0,0,0|2,0,0]=3 289 B8R0.6 O=CCCOC(=O)CBr Amb24727827 [1,0,0,0,0,0|3,0,0]=4 290 B8R0.6 OCCCCC(=O)NC Amb17231874 [1,0,0,0,0,0|1,0,1]=3 291 B8R0.6 [C-]#[N+]CCNC(=O)OC Amb24728450 [1,0,0,0,0,0|3,0,0]=4 292 B8R0.7 BrCCCCCC(=O)O Amb2081955 [1,0,0,0,0,0|2,0,1]=4 293 B8R0.7 C=CNCCCC(O)=O Amb25146209 [1,0,0,0,0,0|2,0,1]=4 294 B8R0.7 CC#CCCCC(C)=O Amb24591411 [1,0,0,0,0,0|2,0,1]=4 295 B8R0.7 CC#CCSCC(O)=O Amb19021078 [1,0,0,0,0,0|2,0,1]=4 296 B8R0.7 CC(=O)CCCC=C=C Amb24620056 [1,0,0,0,0,0|2,0,1]=4 297 B8R0.7 CCCCCCC([O-])=O Amb22729026 [1,0,0,0,0,0|1,0,2]=4 298 B8R0.7 CCCCCCS(O)=O Amb25213753 [1,0,0,0,0,0|2,0,1]=4 299 B8R0.7 CCCCSCC(=O)O Amb1138789 [1,0,0,0,0,0|2,0,1]=4 300 B8R0.7 CCCNCCC(=O)O Amb2372065 [1,0,0,0,0,0|2,0,1]=4 301 B8R0.7 CCCNCCC(O)=O Amb18633174 [1,0,0,0,0,0|2,0,1]=4 302 B8R0.7 CCNCCCC(C)=O Amb24093735 [1,0,0,0,0,0|3,0,0]=4 303 B8R0.7 CCNCCCC(N)=O Amb24709859 [1,0,0,0,0,0|3,0,0]=4 304 B8R0.7 CCOCCCC(N)=O Amb25841206 [1,0,0,0,0,0|3,0,0]=4 305 B8R0.7 CCOCOCC(O)=O Amb25682215 [1,0,0,0,0,0|3,0,0]=4 306 B8R0.7 CCOCSCC(O)=O Amb25147004 [1,0,0,0,0,0|3,0,0]=4 307 B8R0.7 CC\C=C/CCC(C)=O Amb25691996 [1,0,0,0,0,0|2,0,1]=4 308 B8R0.7 CC\C=C/CCC(N)=O Amb24658221 [1,0,0,0,0,0|2,0,1]=4 309 B8R0.7 CC\C=C/CCC(O)=O Amb25831265 [1,0,0,0,0,0|1,0,1]=3 310 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [1,0,0,0,0,0|2,0,1]=4 311 B8R0.7 CC\C=C\CCC(O)=O Amb18642608 [1,0,0,0,0,0|1,0,1]=3 312 B8R0.7 CC\C=C\SCC(O)=O Amb25188909 [1,0,0,0,0,0|2,0,1]=4 313 B8R0.7 CNCCCCC(=O)O Amb10605773 [1,0,0,0,0,0|1,0,1]=3 314 B8R0.7 CNCCCCC(C)=O Amb18642717 [1,0,0,0,0,0|2,0,1]=4 315 B8R0.7 CNCCCCC(O)=O Amb24340485 [1,0,0,0,0,0|1,0,1]=3 316 B8R0.7 CNCCNCC(O)=O Amb25211792 [1,0,0,0,0,0|2,0,1]=4 317 B8R0.7 CNCCOCC(O)=O Amb18630741 [1,0,0,0,0,0|2,0,1]=4 318 B8R0.7 COCCCCC(C)O Amb25235448 [1,0,0,0,0,0|1,0,2]=4 319 B8R0.7 COCCCCC(N)=N Amb25761704 [1,0,0,0,0,0|2,0,1]=4 320 B8R0.7 COCCCCC(N)=S Amb25762220 [1,0,0,0,0,0|1,1,1]=4 321 B8R0.7 COCCCNC(=O)N Amb1105274 [1,0,0,0,0,0|2,0,1]=4 322 B8R0.7 COCCCOC(C)=O Amb22732978 [1,0,0,0,0,0|2,0,1]=4 323 B8R0.7 COCCNCC(=O)N Amb13951972 [1,0,0,0,0,0|2,0,1]=4 324 B8R0.7 COCCNCC(O)=O Amb19514667 [1,0,0,0,0,0|1,0,1]=3 325 B8R0.7 COCC\C=C\C(O)=O Amb24532833 [1,0,0,0,0,0|0,0,3]=4 326 B8R0.7 COCOCCC(C)=O Amb25809981 [1,0,0,0,0,0|2,0,1]=4 327 B8R0.7 CONCCCC(C)O Amb24361285 [1,0,0,0,0,0|2,0,1]=4 328 B8R0.7 CONCCCC(O)=O Amb24647348 [1,0,0,0,0,0|1,0,0]=2 329 B8R0.7 CO\C=C\C=C/C(O)=O Amb25856553 [1,0,0,0,0,0|0,0,3]=4 330 B8R0.7 CSCCCCC(=O)O Amb17503764 [1,0,0,0,0,0|0,1,1]=3 331 B8R0.7 CSCCNCC(O)=O Amb24401934 [1,0,0,0,0,0|1,1,1]=4 332 B8R0.7 CSSCCCC(O)=O Amb25269470 [1,0,0,0,0,0|1,1,0]=3 333 B8R0.7 C\C=C/CCCC(O)=O Amb25314407 [1,0,0,0,0,0|1,0,0]=2 334 B8R0.7 C\C=C/OCCC(C)=O Amb25188590 [1,0,0,0,0,0|3,0,0]=4 335 B8R0.7 C\C=C\CC#CC(O)=O Amb24599409 [1,0,0,0,0,0|1,0,2]=4 336 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [1,0,0,0,0,0|2,0,0]=3 337 B8R0.7 C\C=C\CCCC(N)=O Amb24358851 [1,0,0,0,0,0|2,0,0]=3 338 B8R0.7 C\C=C\CCCC(O)=O Amb18642615 [1,0,0,0,0,0|1,0,0]=2 339 B8R0.7 C\C=C\COCC(C)=O Amb25771575 [1,0,0,0,0,0|3,0,0]=4 340 B8R0.7 C\C=C\COCC(N)=O Amb24573219 [1,0,0,0,0,0|3,0,0]=4 341 B8R0.7 C\C=C\C\C=C\C(O)=O Amb24688696 [1,0,0,0,0,0|1,0,2]=4 342 B8R0.7 C\C=C\OCCC(C)=O Amb24631670 [1,0,0,0,0,0|3,0,0]=4 343 B8R0.7 N#CCCCCC(=O)O Amb17593332 [1,0,0,0,0,0|2,0,1]=4 344 B8R0.7 NC(=O)CCC\C=C\Br Amb24480015 [1,0,0,0,0,0|3,0,0]=4 345 B8R0.7 NC(=O)CCC\C=C\Cl Amb24409832 [1,0,0,0,0,0|3,0,0]=4 346 B8R0.7 NCCCCCC(=O)O Amb17607928 [1,0,0,0,0,0|2,0,1]=4 347 B8R0.7 NCCCCCC(=O)O Amb1905625 [1,0,0,0,0,0|2,0,1]=4 348 B8R0.7 NC\C=C\CCC(O)=O Amb24411351 [1,0,0,0,0,0|2,0,1]=4 349 B8R0.7 NOCCCCC(=O)O Amb10975955 [1,0,0,0,0,0|1,0,1]=3 350 B8R0.7 OC(=O)CCCCC=O Amb18642763 [1,0,0,0,0,0|2,0,1]=4 351 B8R0.7 OC(=O)CCCCCCl Amb18796646 [1,0,0,0,0,0|2,0,1]=4 352 B8R0.7 OC(=O)CCCCCI Amb22736492 [1,0,0,0,0,0|2,0,1]=4 353 B8R0.7 OC(=O)CCCCCS Amb18644374 [1,0,0,0,0,0|2,0,1]=4 354 B8R0.7 OC(=O)CCCNC=O Amb18305404 [1,0,0,0,0,0|3,0,0]=4 355 B8R0.7 OC(=O)CCC\C=C\Br Amb24518554 [1,0,0,0,0,0|2,0,0]=3 356 B8R0.7 OC(=O)CCC\C=C\Cl Amb18644381 [1,0,0,0,0,0|2,0,0]=3 357 B8R0.7 OC(=O)CC\C=C\C#C Amb10605297 [1,0,0,0,0,0|1,0,2]=4 358 B8R0.7 OC(=O)CC\C=C\C=C Amb10605294 [1,0,0,0,0,0|1,0,2]=4 359 B8R0.7 OC(=O)CC\C=C\CBr Amb24635578 [1,0,0,0,0,0|2,0,1]=4 360 B8R0.7 OC\C=C\CCC(O)=O Amb24639124 [1,0,0,0,0,0|2,0,1]=4 361 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [1,0,0,0,0,0|3,0,0]=4 362 B8R0.28 C=C(Br)CNCC(O)=O Amb18303844 [1,0,0,0,0,0|2,0,1]=4 363 B8R0.28 C=C(Br)CSCC(O)=O Amb25369923 [1,0,0,0,0,0|2,0,1]=4 364 B8R0.28 C=C(F)CCCC(O)=O Amb22641515 [1,0,0,0,0,0|1,0,1]=3 365 B8R0.28 CC(=C)CCCC(C)=C Amb22228385 [1,0,0,0,0,0|3,0,0]=4 366 B8R0.28 CC(=C)CCCC(C)=O Amb17739959 [1,0,0,0,0,0|2,0,0]=3 367 B8R0.28 CC(=C)CCOC(N)=O Amb24760559 [1,0,0,0,0,0|3,0,0]=4 368 B8R0.28 CC(=C)\C=C\CC(O)=O Amb18642409 [1,0,0,0,0,0|1,0,2]=4 369 B8R0.28 CC(=N)NCCC(O)=O Amb25836109 [1,0,0,0,0,0|2,0,0]=3 370 B8R0.28 CC(=O)CCC=C(F)F Amb24478042 [1,0,0,0,0,0|2,0,1]=4 371 B8R0.28 CC(=O)CCCB(O)O Amb24068595 [1,0,0,0,0,0|1,0,1]=3 372 B8R0.28 CC(=O)CCCC(=C)O Amb24422924 [1,0,0,0,0,0|1,0,0]=2 373 B8R0.28 CC(=O)CCCC(=O)Cl Amb24752758 [1,0,0,0,0,0|1,0,0]=2 374 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [1,0,0,0,0,0|0,0,0]=1 375 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [1,0,0,0,0,0|1,0,0]=2 376 B8R0.28 CC(=O)CCCC(Cl)Cl Amb24480288 [1,0,0,0,0,0|2,0,1]=4 377 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [1,0,0,0,0,0|1,0,0]=2 378 B8R0.28 CC(=O)CCC[N+]([O-])=O Amb18203187 [1,0,0,0,0,0|1,0,1]=3 379 B8R0.28 CC(=O)CCNC(=O)C Amb17102868 [1,0,0,0,0,0|2,0,0]=3 380 B8R0.28 CC(=O)CC\C=C(/Cl)\C Amb17593664 [1,0,0,0,0,0|2,0,1]=4 381 B8R0.28 CC(=O)CNCC(C)=O Amb22168687 [1,0,0,0,0,0|2,0,0]=3 382 B8R0.28 CC(=O)CNCC(O)=O Amb24375747 [1,0,0,0,0,0|1,0,0]=2 383 B8R0.28 CC(=O)COCC(N)=O Amb24070191 [1,0,0,0,0,0|2,0,0]=3 384 B8R0.28 CC(=O)CSCC(=C)Br Amb24421359 [1,0,0,0,0,0|3,0,0]=4 385 B8R0.28 CC(=O)CSCC(C)=O Amb25244895 [1,0,0,0,0,0|2,0,0]=3 386 B8R0.28 CC(=O)CSCC([O-])=O Amb20622616 [1,0,0,0,0,0|1,0,1]=3 387 B8R0.28 CC(=O)C\C=C\C(=O)O Amb16232091 [1,0,0,0,0,0|0,0,2]=3 388 B8R0.28 CC(=O)NCCC(=S)N Amb17232012 [1,0,0,0,0,0|2,1,0]=4 389 B8R0.28 CC(=O)OCCC(O)=O Amb18642866 [1,0,0,0,0,0|1,0,0]=2 390 B8R0.28 CC(=O)OCCS(C)=O Amb24481662 [1,0,0,0,0,0|3,0,0]=4 391 B8R0.28 CC(=O)SCCB(O)O Amb25854421 [1,0,0,0,0,0|2,0,1]=4 392 B8R0.28 CC(=O)SCCC(N)=O Amb24552735 [1,0,0,0,0,0|2,0,0]=3 393 B8R0.28 CC(=O)SCNC(C)=O Amb24662115 [1,0,0,0,0,0|3,0,0]=4 394 B8R0.28 CC(=O)\C=C/CC(C)=O Amb25072729 [1,0,0,0,0,0|1,0,2]=4 395 B8R0.28 CC(=O)\C=C\CC(C)=O Amb25238337 [1,0,0,0,0,0|1,0,2]=4 396 B8R0.28 CC(=O)\C=N/CC(O)=O Amb25347610 [1,0,0,0,0,0|1,0,1]=3 397 B8R0.28 CC(=S)NCCC(C)=O Amb24682550 [1,0,0,0,0,0|2,1,0]=4 398 B8R0.28 CC(=S)SCCC(O)=O Amb24480281 [1,0,0,0,0,0|1,1,0]=3 399 B8R0.28 CC(Br)=CCCC(O)=O Amb25200944 [1,0,0,0,0,0|1,0,1]=3 400 B8R0.28 CC(Br)CCCC(=O)Cl Amb25364942 [1,0,0,0,0,0|2,0,1]=4 401 B8R0.28 CC(Br)CCCC(C)=O Amb24340312 [1,0,0,0,0,0|2,0,1]=4 402 B8R0.28 CC(Br)CCCC(O)=O Amb24480052 [1,0,0,0,0,0|1,0,1]=3 403 B8R0.28 CC(C)=CCCC(N)=O Amb24655596 [1,0,0,0,0,0|2,0,1]=4 404 B8R0.28 CC(C)CCCC(=O)Cl Amb24477882 [1,0,0,0,0,0|2,0,1]=4 405 B8R0.28 CC(C)CCCC(N)=O Amb24579456 [1,0,0,0,0,0|2,0,1]=4 406 B8R0.28 CC(C)CNCC(O)=O Amb19373106 [1,0,0,0,0,0|2,0,1]=4 407 B8R0.28 CC(CCCC(=O)O)O Amb2371277 [1,0,0,0,0,0|0,0,2]=3 408 B8R0.28 CC(CCCC(=O)[O-])O Amb17615415 [1,0,0,0,0,0|0,0,3]=4 409 B8R0.28 CC(CSCC(=O)O)C Amb1134811 [1,0,0,0,0,0|2,0,1]=4 410 B8R0.28 CC(Cl)=CCCC(C)=O Amb25274421 [1,0,0,0,0,0|2,0,1]=4 411 B8R0.28 CC(Cl)CCCC(C)=O Amb25724389 [1,0,0,0,0,0|2,0,1]=4 412 B8R0.28 CC(Cl)CCCC(O)=O Amb24740888 [1,0,0,0,0,0|1,0,1]=3 413 B8R0.28 CC(Cl)COCC(O)=O Amb24480258 [1,0,0,0,0,0|2,0,1]=4 414 B8R0.28 CC(N)CCCC(O)=O Amb22059416 [1,0,0,0,0,0|1,0,1]=3 415 B8R0.28 CC(N)COCC(O)=O Amb25368702 [1,0,0,0,0,0|2,0,1]=4 416 B8R0.28 CC(NCCC(=O)O)C Amb1106349 [1,0,0,0,0,0|2,0,1]=4 417 B8R0.28 CC(O)CCCC(C)=C Amb24478673 [1,0,0,0,0,0|2,0,1]=4 418 B8R0.28 CC(O)CCCC(C)=O Amb24340114 [1,0,0,0,0,0|1,0,1]=3 419 B8R0.28 CC(O)CCCC(N)=O Amb24622764 [1,0,0,0,0,0|1,0,2]=4 420 B8R0.28 CC(O)CCSC(C)=O Amb25846896 [1,0,0,0,0,0|2,0,1]=4 421 B8R0.28 CC(O)CNCC(C)=O Amb24589662 [1,0,0,0,0,0|2,0,1]=4 422 B8R0.28 CC(O)CSCC(O)=O Amb19005278 [1,0,0,0,0,0|1,0,2]=4 423 B8R0.28 CN(C)NCCC(O)=O Amb24113891 [1,0,0,0,0,0|3,0,0]=4 424 B8R0.28 CS(=O)CCCC(N)=S Amb24629819 [1,0,0,0,0,0|2,1,0]=4 425 B8R0.28 CS(=O)CCCC(O)=O Amb18306076 [1,0,0,0,0,0|1,0,0]=2 426 B8R0.28 CS(=O)C\C=C\C(O)=O Amb24586059 [1,0,0,0,0,0|1,0,2]=4 427 B8R0.28 CS(=O)NOCC(O)=O Amb24588744 [1,0,0,0,0,0|3,0,0]=4 428 B8R0.28 C[C@@H](N)CCCC(O)=O Amb24435680 [1,0,0,0,0,0|1,0,1]=3 429 B8R0.28 C[C@@H](N)COCC(O)=O Amb24641471 [1,0,0,0,0,0|2,0,1]=4 430 B8R0.28 C[C@@H](O)CCOC(C)=O Amb25357488 [1,0,0,0,0,0|2,0,1]=4 431 B8R0.28 C[C@H](N)COCC(O)=O Amb25305053 [1,0,0,0,0,0|2,0,1]=4 432 B8R0.28 C[C@H](O)CCCC(O)=O Amb25842809 [1,0,0,0,0,0|0,0,2]=3 433 B8R0.28 NC(=N)CCCC(O)=O Amb25757878 [1,0,0,0,0,0|2,0,0]=3 434 B8R0.28 NC(=N)CNCC(O)=O Amb25062019 [1,0,0,0,0,0|3,0,0]=4 435 B8R0.28 NC(=O)CCCC(N)=N Amb25173064 [1,0,0,0,0,0|3,0,0]=4 436 B8R0.28 NC(=O)CCCC(N)=O Amb24098550 [1,0,0,0,0,0|2,0,0]=3 437 B8R0.28 NC(=O)CCC[N+]([O-])=O Amb22432425 [1,0,0,0,0,0|2,0,1]=4 438 B8R0.28 NC(=O)CCOP(O)=O Amb24668254 [1,0,0,0,0,0|3,0,0]=4 439 B8R0.28 NC(=O)CSCC(=O)Cl Amb25288065 [1,0,0,0,0,0|3,0,0]=4 440 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [1,0,0,0,0,0|2,0,0]=3 441 B8R0.28 O=C(Cl)CNCC(=O)Cl Amb25360798 [1,0,0,0,0,0|3,0,0]=4 442 B8R0.28 O=C(Cl)COCC(=O)Cl Amb22228240 [1,0,0,0,0,0|3,0,0]=4 443 B8R0.28 OC(=O)C#CCC(O)=O Amb25850643 [1,0,0,0,0,0|0,0,2]=3 444 B8R0.28 OC(=O)C=C=CC(=O)O Amb17593335 [1,0,0,0,0,0|0,0,3]=4 445 B8R0.28 OC(=O)CCC=C(C)C Amb10601609 [1,0,0,0,0,0|1,0,1]=3 446 B8R0.28 OC(=O)CCC=C(F)F Amb25224993 [1,0,0,0,0,0|2,0,1]=4 447 B8R0.28 OC(=O)CCCC(=O)Br Amb24480005 [1,0,0,0,0,0|1,0,0]=2 448 B8R0.28 OC(=O)CCCC(Cl)Cl Amb24479944 [1,0,0,0,0,0|2,0,1]=4 449 B8R0.28 OC(=O)CCCC(F)F Amb24117996 [1,0,0,0,0,0|2,0,1]=4 450 B8R0.28 OC(=O)CCCC(O)=O Amb22351480 [1,0,0,0,0,0|0,0,0]=1 451 B8R0.28 OC(=O)CCCC(O)=O Amb22351829 [1,0,0,0,0,0|0,0,0]=1 452 B8R0.28 OC(=O)CCCP(O)=O Amb24480161 [1,0,0,0,0,0|1,0,0]=2 453 B8R0.28 OC(=O)CCNC(=O)C Amb1104704 [1,0,0,0,0,0|1,0,0]=2 454 B8R0.28 OC(=O)CCNC(S)=S Amb25765722 [1,0,0,0,0,0|1,2,0]=4 455 B8R0.28 OC(=O)CCSC(=N)N Amb1043190 [1,0,0,0,0,0|3,0,0]=4 456 B8R0.28 OC(=O)CCSC(=O)C Amb17607685 [1,0,0,0,0,0|1,0,0]=2 457 B8R0.28 OC(=O)CNC=P(O)=O Amb24558051 [1,0,0,0,0,0|2,0,1]=4 458 B8R0.28 OC(=O)CNCP(O)=O Amb24557425 [1,0,0,0,0,0|2,0,0]=3 459 B8R0.28 OC(=O)COCC(=O)Cl Amb25372456 [1,0,0,0,0,0|2,0,0]=3 460 B8R0.28 OC(=O)C\C=C\C(=O)O Amb1154189 [1,0,0,0,0,0|0,0,2]=3 461 B8R0.28 OC(=O)O[Sr]OC(O)=O Amb22353408 [1,0,0,0,0,0|3,0,0]=4 462 B8R0.28 OC(=S)COCC(O)=O Amb22262972 [1,0,0,0,0,0|1,1,0]=3 463 B8R0.28 OC(O)CCCC(O)=O Amb25205498 [1,0,0,0,0,0|0,0,2]=3 464 B8R0.28 O[13C](=O)CCC[13C](=O)O Amb17614793 [1,0,0,0,0,0|0,0,0]=1 465 B8R0.28 [O-]C(=O)CCCC([O-])=O Amb22729768 [1,0,0,0,0,0|0,0,2]=3 466 B8R0.28 [O-]C(=O)CNCC([O-])=O Amb20246814 [1,0,0,0,0,0|1,0,2]=4 467 B8R0.28 [O-]C(=O)CNCC([O-])=O Amb22351624 [1,0,0,0,0,0|1,0,2]=4 468 B8R0.28 [O-][N+](=O)CCCC(O)=O Amb24711043 [1,0,0,0,0,0|1,0,1]=3 469 B8R0.28 [O-][N+](=O)OCCC(O)=O Amb21953424 [1,0,0,0,0,0|2,0,1]=4 470 B10R0.3 C#CCC(=O)NCCC(O)=O Amb24754737 [0,1,0,0,0,0|2,0,1]=4 471 B10R0.3 CC#CC(=O)CCCC(O)=O Amb25385757 [0,1,0,0,0,0|1,0,0]=2 472 B10R0.3 CC#CC(=O)NCCC(N)=O Amb24431634 [0,1,0,0,0,0|3,0,0]=4 473 B10R0.3 CC#CC(=O)NOCC(O)=O Amb24758415 [0,1,0,0,0,0|3,0,0]=4 474 B10R0.3 CC(=O)CCCC(=O)C#CC Amb24765188 [0,1,0,0,0,0|2,0,0]=3 475 B10R0.3 CC(=O)NCCC(=O)OCC Amb18800084 [0,1,0,0,0,0|2,0,0]=3 476 B10R0.3 CC(=O)NNCC(=O)OCC Amb24103449 [0,1,0,0,0,0|3,0,0]=4 477 B10R0.3 CCCC(C)CCCC(O)=O Amb20669051 [0,1,0,0,0,0|2,0,1]=4 478 B10R0.3 CCNC(=O)CCNC(N)=O Amb25381809 [0,1,0,0,0,0|3,0,0]=4 479 B10R0.3 CCNC(=O)CSCC(=O)O Amb1133975 [0,1,0,0,0,0|2,0,0]=3 480 B10R0.3 CCNC(=O)NCCC(=O)O Amb1136873 [0,1,0,0,0,0|2,0,0]=3 481 B10R0.3 CCOC(=O)NN=CC(O)=O Amb25382516 [0,1,0,0,0,0|2,0,1]=4 482 B10R0.3 CCOC(=O)N\C=C\C(O)=O Amb24602365 [0,1,0,0,0,0|1,0,2]=4 483 B10R0.3 COCC(=O)NCCC(=O)O Amb1121155 [0,1,0,0,0,0|1,0,0]=2 484 B10R0.3 CONC(=O)CCNC(=O)C Amb16970858 [0,1,0,0,0,0|2,0,0]=3 485 B10R0.3 CONC(=O)NCCC(C)O Amb25382925 [0,1,0,0,0,0|2,0,1]=4 486 B10R0.3 CONC(=O)NCCC(N)=O Amb25382924 [0,1,0,0,0,0|2,0,0]=3 487 B10R0.3 CONC(=O)NCCS(C)=O Amb24751024 [0,1,0,0,0,0|3,0,0]=4 488 B10R0.3 CONC(=O)NCC[C@@H](C)O Amb24751025 [0,1,0,0,0,0|2,0,1]=4 489 B10R0.3 CONC(=O)NCC[C@H](C)O Amb24751027 [0,1,0,0,0,0|2,0,1]=4 490 B10R0.3 C\C=C\C(=O)NCCC(N)=O Amb25382017 [0,1,0,0,0,0|3,0,0]=4 491 B10R0.3 N#CNC(=O)CCCC(O)=O Amb24761900 [0,1,0,0,0,0|1,0,1]=3 492 B10R0.3 N#CNC(=O)COCC(O)=O Amb24761901 [0,1,0,0,0,0|2,0,1]=4 493 B10R0.44 CC(=O)C=C(C)CC(=O)OC Amb24765325 [0,1,0,0,0,0|1,0,2]=4 494 B10R0.44 CC(=O)CC(=O)CC(=O)OC Amb18048464 [0,1,0,0,0,0|1,0,1]=3 495 B10R0.44 CC(=O)CN(C)CC(=O)NC Amb18183265 [0,1,0,0,0,0|3,0,0]=4 496 B10R0.44 CC(=O)CS(=O)CC(=O)NC Amb24754701 [0,1,0,0,0,0|3,0,0]=4 497 B10R0.44 CC(=O)NC(C)CC(=O)OC Amb25383511 [0,1,0,0,0,0|2,0,0]=3 498 B10R0.44 CC(=O)N[C@@H](C)CC(=O)OC Amb25383526 [0,1,0,0,0,0|2,0,0]=3 499 B10R0.44 CC(=O)N[C@H](C)CC(=O)OC Amb25383524 [0,1,0,0,0,0|2,0,0]=3 500 B10R0.44 CC(=O)\C=C(/O)\CC(=O)OC Amb24765282 [0,1,0,0,0,0|1,0,2]=4 501 B10R0.44 CC(C)=CC(O)CC(=O)OC Amb25386130 [0,1,0,0,0,0|2,0,1]=4 502 B10R0.44 CC(CC(O)=O)NC(=O)CN Amb19010286 [0,1,0,0,0,0|3,0,0]=4 503 B10R0.44 CCC(=O)C\C(\O)=C\C(O)=O Amb24765013 [0,1,0,0,0,0|1,0,2]=4 504 B10R0.44 CNC(=O)CC(C)CC(O)=O Amb19035066 [0,1,0,0,0,0|1,0,0]=2 505 B10R0.44 CNC(=O)CN(C)CC(N)=O Amb18800097 [0,1,0,0,0,0|3,0,0]=4 506 B10R0.44 CNC(=O)CS(=O)CC(N)=O Amb24751072 [0,1,0,0,0,0|3,0,0]=4 507 B10R0.44 CNC(=O)CS(=O)CC(O)=O Amb18796112 [0,1,0,0,0,0|2,0,0]=3 508 B10R0.44 CNC(=O)NC(C)CC(O)=O Amb18290552 [0,1,0,0,0,0|2,0,0]=3 509 B10R0.44 COC(=O)CC(=C)NC(N)=O Amb25123959 [0,1,0,0,0,0|2,0,1]=4 510 B10R0.44 COC(=O)CC(C)C[N+]([O-])=O Amb20623014 [0,1,0,0,0,0|1,0,1]=3 511 B10R0.44 COC(=O)C\C(\Cl)=C/C(O)=O Amb25384860 [0,1,0,0,0,0|0,0,2]=3 512 B10R0.44 COC(=O)NC(=O)CC(O)=O Amb25835485 [0,1,0,0,0,0|1,0,1]=3 513 B10R0.44 COC(=O)NC(C)CC(N)=O Amb24764840 [0,1,0,0,0,0|2,0,0]=3 514 B10R0.44 COC(=O)NC(C)CC(N)=S Amb18186015 [0,1,0,0,0,0|2,1,0]=4 515 B10R0.44 COC(=O)\C=C(/N)\CC([O-])=O Amb24764498 [0,1,0,0,0,0|0,0,3]=4 516 B10R0.44 COC(=O)\C=C(\N)/CC(N)=O Amb24764526 [0,1,0,0,0,0|1,0,2]=4 517 B10R0.44 COC(=O)\C=C(\N)/CC([O-])=O Amb24764622 [0,1,0,0,0,0|0,0,3]=4 518 B10R0.44 C\C(\CC(=O)OC)=C\C(O)=O Amb25385158 [0,1,0,0,0,0|0,0,2]=3 519 B10R0.57 CC(=C=CC(O)=O)C(=O)OC Amb24700645 [0,1,0,0,0,0|0,0,3]=4 520 B10R0.57 CC(=O)C\C=C(/C)\C(=O)OC Amb24765181 [0,1,0,0,0,0|1,0,2]=4 521 B10R0.57 CC(=O)NCC(=C)C(=O)OC Amb24766342 [0,1,0,0,0,0|2,0,1]=4 522 B10R0.57 CC(=O)NCC(Br)C(=O)OC Amb25382333 [0,1,0,0,0,0|2,0,0]=3 523 B10R0.57 CC(=O)NCC(C)C(=O)NC Amb25103297 [0,1,0,0,0,0|3,0,0]=4 524 B10R0.57 CC(=O)NCC(C)C(=O)OC Amb25385897 [0,1,0,0,0,0|2,0,0]=3 525 B10R0.57 CC(=O)NCC(Cl)C(=O)OC Amb25384848 [0,1,0,0,0,0|2,0,0]=3 526 B10R0.57 CC(=O)NCC(I)C(=O)OC Amb25382334 [0,1,0,0,0,0|2,0,0]=3 527 B10R0.57 CC(=O)NC[C@@H](C)C(=O)OC Amb25383898 [0,1,0,0,0,0|2,0,0]=3 528 B10R0.57 CC(=O)NC[C@@H](N)C(=O)OC Amb25385079 [0,1,0,0,0,0|2,0,0]=3 529 B10R0.57 CC(=O)NC[C@@H](O)C(=O)OC Amb24765401 [0,1,0,0,0,0|2,0,0]=3 530 B10R0.57 CC(=O)NC[C@H](C)C(=O)OC Amb24765397 [0,1,0,0,0,0|2,0,0]=3 531 B10R0.57 CC(=O)NC[C@H](O)C(=O)OC Amb25382700 [0,1,0,0,0,0|2,0,0]=3 532 B10R0.57 CC(=O)NNC(C)C(=O)OC Amb25382721 [0,1,0,0,0,0|3,0,0]=4 533 B10R0.57 CC(=O)OCC(=C)C(=O)OC Amb22496541 [0,1,0,0,0,0|2,0,1]=4 534 B10R0.57 CC(=O)SC[C@@H](C)C(=O)OC Amb22801683 [0,1,0,0,0,0|2,0,0]=3 535 B10R0.57 CC(=O)\C=C\C(C)C(=O)OC Amb24765182 [0,1,0,0,0,0|1,0,2]=4 536 B10R0.57 CC(C)=CC[C@@H](N)C(=O)OC Amb24764707 [0,1,0,0,0,0|2,0,1]=4 537 B10R0.57 CC(C)=CC[C@H](N)C(=O)OC Amb24764709 [0,1,0,0,0,0|2,0,1]=4 538 B10R0.57 CC(N)=NCC(C)C(=O)OC Amb24762644 [0,1,0,0,0,0|3,0,0]=4 539 B10R0.57 CN(C(=O)CC)CCC(=O)O Amb17400039 [0,1,0,0,0,0|2,0,0]=3 540 B10R0.57 CN(CCC(O)=O)C(=O)C#C Amb18984978 [0,1,0,0,0,0|2,0,1]=4 541 B10R0.57 CNC(=O)C(N)CCC(N)=O Amb24762716 [0,1,0,0,0,0|2,0,0]=3 542 B10R0.57 CNC(=O)N(C)CCC(O)=O Amb18977475 [0,1,0,0,0,0|2,0,0]=3 543 B10R0.57 COC(=O)C(=O)NCC(N)=O Amb24757424 [0,1,0,0,0,0|2,0,1]=4 544 B10R0.57 COC(=O)C(=O)NCC(O)=O Amb25385135 [0,1,0,0,0,0|1,0,1]=3 545 B10R0.57 COC(=O)C(C)CCC(O)=O Amb22008198 [0,1,0,0,0,0|0,0,0]=1 546 B10R0.57 COC(=O)C(C)CN=C(N)N Amb24762645 [0,1,0,0,0,0|3,0,0]=4 547 B10R0.57 COC(=O)C(O)CNC(N)=O Amb25382332 [0,1,0,0,0,0|2,0,0]=3 548 B10R0.57 COC(=O)[C@@H](CCC(=O)N)N Amb10844892 [0,1,0,0,0,0|1,0,0]=2 549 B10R0.57 COC(=O)[C@@H](N)CCC(O)=O Amb22754032 [0,1,0,0,0,0|0,0,0]=1 550 B10R0.57 C\C(=C/CC(O)=O)\C(=O)OC Amb18126096 [0,1,0,0,0,0|0,0,2]=3 551 B10R0.57 NC(=O)CCC(N)C(=O)NO Amb25385851 [0,1,0,0,0,0|3,0,0]=4 552 B10R0.57 NC(=O)CC[C@H](N)C(=O)NO Amb24764528 [0,1,0,0,0,0|3,0,0]=4 553 B10R0.57 NC(C(=O)O[Na])CCC(=O)O Amb16224798 [0,1,0,0,0,0|1,0,0]=2 554 B10R0.57 NC(CCC(O)=O)C(=O)O[Na] Amb22730975 [0,1,0,0,0,0|1,0,0]=2 555 B10R0.59 CCC(=O)CCCC(=O)OC Amb17593954 [0,1,0,0,0,0|1,0,0]=2 556 B10R0.59 CCC(=O)NCCC(=O)NN Amb25382598 [0,1,0,0,0,0|3,0,0]=4 557 B10R0.59 CCC(=O)NCCC(=O)OC Amb18800081 [0,1,0,0,0,0|2,0,0]=3 558 B10R0.59 CCC(=O)NCCC(N)=NO Amb18182416 [0,1,0,0,0,0|3,0,0]=4 559 B10R0.59 CNC(=N)NCCC(=O)OC Amb18182413 [0,1,0,0,0,0|3,0,0]=4 560 B10R0.59 CNC(=O)CCCC(=O)NC Amb25384409 [0,1,0,0,0,0|2,0,0]=3 561 B10R0.59 CNC(=O)CCCC(=O)NO Amb24766551 [0,1,0,0,0,0|1,0,0]=2 562 B10R0.59 CNC(=O)CCNC(=O)C=C Amb18799667 [0,1,0,0,0,0|3,0,0]=4 563 B10R0.59 CNC(=O)CCNC(=O)CBr Amb25381754 [0,1,0,0,0,0|3,0,0]=4 564 B10R0.59 CNC(=O)CCNC(=O)CC Amb25378864 [0,1,0,0,0,0|3,0,0]=4 565 B10R0.59 CNC(=O)CCNC(=O)CCl Amb18809133 [0,1,0,0,0,0|3,0,0]=4 566 B10R0.59 CNC(=O)CCNC(=O)CN Amb18800103 [0,1,0,0,0,0|3,0,0]=4 567 B10R0.59 CNC(=O)CCNC(=O)NN Amb18800330 [0,1,0,0,0,0|3,0,0]=4 568 B10R0.59 CNC(=O)CCNC(=S)OC Amb25384758 [0,1,0,0,0,0|2,1,0]=4 569 B10R0.59 CNC(=O)CCNC(N)=NO Amb18800336 [0,1,0,0,0,0|3,0,0]=4 570 B10R0.59 CNC(=O)COCC(=O)NC Amb22372031 [0,1,0,0,0,0|3,0,0]=4 571 B10R0.59 CNC(=O)CSCC(=O)NN Amb25382410 [0,1,0,0,0,0|3,0,0]=4 572 B10R0.59 CNC(=O)CSCC(N)=NO Amb24754687 [0,1,0,0,0,0|3,0,0]=4 573 B10R0.59 COC(=O)CCCC(=O)C=C Amb22756818 [0,1,0,0,0,0|1,0,0]=2 574 B10R0.59 COC(=O)CCCC(=O)CCl Amb22395264 [0,1,0,0,0,0|1,0,0]=2 575 B10R0.59 COC(=O)CCCC(=O)OC Amb22338529 [0,1,0,0,0,0|0,0,0]=1 576 B10R0.59 COC(=O)CCCC(=O)OC Amb22363108 [0,1,0,0,0,0|0,0,0]=1 577 B10R0.59 COC(=O)CCNC(=O)C#C Amb18177384 [0,1,0,0,0,0|2,0,0]=3 578 B10R0.59 COC(=O)CCNC(=S)NN Amb18790837 [0,1,0,0,0,0|2,1,0]=4 579 B10R0.59 COC(=O)C\C=C\C(=O)OC Amb13777320 [0,1,0,0,0,0|0,0,2]=3 580 B10R0.59 COC(=O)NCCC(N)=NO Amb18797939 [0,1,0,0,0,0|2,0,0]=3 581 B10R0.59 C\C(\C=O)=C/NCC(=O)OC Amb25385908 [0,1,0,0,0,0|2,0,1]=4 582 B10R0.59 C\C(\C=O)=C\NCC(=O)OC Amb25385907 [0,1,0,0,0,0|2,0,1]=4 583 B10R0.59 O=C(CNCC(=O)O[Na])O[Na] Amb22360666 [0,1,0,0,0,0|2,0,0]=3 584 B10R0.59 O=NN(CCCC(=O)OC)C Amb17618590 [0,1,0,0,0,0|2,0,0]=3 585 B10R0.59 ONC(=O)CCCC(=O)NO Amb25383708 [0,1,0,0,0,0|2,0,0]=3 586 B10R0.60 CNC(=O)CCCS(C)(=O)=O Amb17954205 [0,1,0,0,0,0|2,0,1]=4 587 B10R0.60 CNC(=O)CNCP(O)(O)=O Amb24766244 [0,1,0,0,0,0|3,0,0]=4 588 B10R0.60 COC(=O)CCCC(F)(F)F Amb24093747 [0,1,0,0,0,0|2,0,1]=4 589 B10R0.60 COC(=O)CCCP(O)(O)=O Amb22831922 [0,1,0,0,0,0|1,0,0]=2 590 B10R0.60 COC(=O)CCCS(C)(=O)=O Amb18181103 [0,1,0,0,0,0|1,0,1]=3 591 B10R0.60 COC(=O)CCCS(N)(=O)=O Amb18796421 [0,1,0,0,0,0|1,0,1]=3 592 B10R0.60 COC(=O)CCC[N+](C)(C)C Amb15691776 [0,1,0,0,0,0|3,0,0]=4 593 B10R0.60 COC(=O)CCNS(C)(=O)=O Amb18186811 [0,1,0,0,0,0|2,0,1]=4 594 B10R0.60 COC(=O)CNCP(O)(O)=O Amb22388775 [0,1,0,0,0,0|2,0,0]=3 595 B10R0.60 COC(=O)NCCP(=O)(F)F Amb25384360 [0,1,0,0,0,0|3,0,0]=4 596 B10R0.60 COC(=O)NCCS(=O)(=O)C Amb16971518 [0,1,0,0,0,0|2,0,1]=4 597 B10R0.60 COC(=O)NCCS(N)(=O)=O Amb18796567 [0,1,0,0,0,0|2,0,1]=4 598 B10R0.65 CCC(CCCC(=O)O)(C)C Amb16233621 [0,1,0,0,0,0|2,0,1]=4 599 B10R0.65 CCS(=O)(=O)NCCC(=O)O Amb1119258 [0,1,0,0,0,0|3,0,0]=4 600 B10R0.65 COC(C)(C)CNCC(O)=O Amb23536459 [0,1,0,0,0,0|2,0,1]=4 601 B10R0.82 C#CC(=O)NCC(O)C(O)=O Amb24661769 [0,1,0,0,0,0|2,0,1]=4 602 B10R0.82 C#CC(=O)NC[C@H](N)C(O)=O Amb25210877 [0,1,0,0,0,0|2,0,1]=4 603 B10R0.82 C#CC(=O)OCC(N)C(O)=O Amb25386039 [0,1,0,0,0,0|2,0,1]=4 604 B10R0.82 C=CC(=O)NCC(N)C(O)=O Amb24767302 [0,1,0,0,0,0|2,0,1]=4 605 B10R0.82 CC(=C)C(C)CNC(=O)OC Amb25383553 [0,1,0,0,0,0|3,0,0]=4 606 B10R0.82 CC(=O)C(=O)NCC(=O)OC Amb25385804 [0,1,0,0,0,0|2,0,1]=4 607 B10R0.82 CC(=O)C(C)CNC(=O)OC Amb25385867 [0,1,0,0,0,0|2,0,0]=3 608 B10R0.82 CC(=O)C(C)SCC(=O)NC Amb24754693 [0,1,0,0,0,0|3,0,0]=4 609 B10R0.82 CC(=O)N(C)CCC(=O)NC Amb25383471 [0,1,0,0,0,0|3,0,0]=4 610 B10R0.82 CC(=O)\C(\C)=C\CC(=O)OC Amb24766642 [0,1,0,0,0,0|1,0,2]=4 611 B10R0.82 CC(CNC(=O)C#C)C(O)=O Amb18299989 [0,1,0,0,0,0|2,0,1]=4 612 B10R0.82 CC(CNC(=O)C=C)C(O)=O Amb19027694 [0,1,0,0,0,0|2,0,1]=4 613 B10R0.82 CC(CNC(=O)CN)C(O)=O Amb18313397 [0,1,0,0,0,0|3,0,0]=4 614 B10R0.82 CC(CNC(=O)OC)C(C)O Amb25385869 [0,1,0,0,0,0|2,0,1]=4 615 B10R0.82 CCC(=O)CCC(C)[N+]([O-])=O Amb22436809 [0,1,0,0,0,0|2,0,1]=4 616 B10R0.82 CCC(=O)NCC(C)C(O)=O Amb19027634 [0,1,0,0,0,0|2,0,0]=3 617 B10R0.82 CCC(=O)NCC(O)C(N)=O Amb24761543 [0,1,0,0,0,0|3,0,0]=4 618 B10R0.82 CCC(=O)NC[C@H](N)C(O)=O Amb25383897 [0,1,0,0,0,0|2,0,0]=3 619 B10R0.82 CCC(C)CCC(C)C(O)=O Amb22641847 [0,1,0,0,0,0|2,0,1]=4 620 B10R0.82 CCS(=O)CCC(N)C(O)=O Amb22730104 [0,1,0,0,0,0|2,0,0]=3 621 B10R0.82 CN=[N+]([O-])CCC(N)C(O)=O Amb25384605 [0,1,0,0,0,0|2,0,1]=4 622 B10R0.82 CN=[N+]([O-])CC[C@H](N)C(O)=O Amb25384249 [0,1,0,0,0,0|2,0,1]=4 623 B10R0.82 CNC(=O)CCC(=O)C(O)=O Amb25385153 [0,1,0,0,0,0|1,0,1]=3 624 B10R0.82 CNC(=O)CCC(N)C(O)=O Amb18645293 [0,1,0,0,0,0|1,0,0]=2 625 B10R0.82 CNC(=O)CN[C@@H](C)C(O)=O Amb25383665 [0,1,0,0,0,0|2,0,0]=3 626 B10R0.82 CNC(=O)CN[C@H](C)C(O)=O Amb25383671 [0,1,0,0,0,0|2,0,0]=3 627 B10R0.82 CNC(=O)CSC(C)C(N)=O Amb24753690 [0,1,0,0,0,0|3,0,0]=4 628 B10R0.82 CNC(=O)CSC(F)C(O)=O Amb25382404 [0,1,0,0,0,0|2,0,0]=3 629 B10R0.82 CNC(=O)NCC(C)C(O)=O Amb18300018 [0,1,0,0,0,0|2,0,0]=3 630 B10R0.82 CNC(=O)NCC(N)C(O)=O Amb25806000 [0,1,0,0,0,0|2,0,0]=3 631 B10R0.82 CNC(=O)NCC(O)C(N)=O Amb24709903 [0,1,0,0,0,0|3,0,0]=4 632 B10R0.82 CNC(=O)NC[C@H](N)C(O)=O Amb25361972 [0,1,0,0,0,0|2,0,0]=3 633 B10R0.82 CNC(=O)OCC(N)C(O)=O Amb25385001 [0,1,0,0,0,0|2,0,0]=3 634 B10R0.82 CNC(=O)SCC(N)C(O)=O Amb25383453 [0,1,0,0,0,0|2,0,0]=3 635 B10R0.82 CNC(=O)SC[C@@H](C(=O)O)N Amb17617278 [0,1,0,0,0,0|2,0,0]=3 636 B10R0.82 CNC(=O)SC[C@@H](N)C(O)=O Amb19133092 [0,1,0,0,0,0|2,0,0]=3 637 B10R0.82 COC(=O)CC[C@@H](C(=O)O)[NH3+] Amb10574405 [0,1,0,0,0,0|0,0,0]=1 638 B10R0.82 COC(=O)CC[C@@H](C)C(O)=O Amb22801605 [0,1,0,0,0,0|0,0,0]=1 639 B10R0.82 COC(=O)CC[C@@H](N)C(N)=O Amb22801394 [0,1,0,0,0,0|1,0,0]=2 640 B10R0.82 COC(=O)CC[C@@H](N)C(O)=O Amb22746068 [0,1,0,0,0,0|0,0,0]=1 641 B10R0.82 COC(=O)CC[C@H](C(=O)O)N Amb16183875 [0,1,0,0,0,0|0,0,0]=1 642 B10R0.82 COC(=O)CC[C@H](N)C(N)=O Amb22432474 [0,1,0,0,0,0|1,0,0]=2 643 B10R0.82 COC(=O)CC[C@H](N)C(O)=O Amb22336436 [0,1,0,0,0,0|0,0,0]=1 644 B10R0.82 COC(=O)NCC(C)C(N)=S Amb18804574 [0,1,0,0,0,0|2,1,0]=4 645 B10R0.82 COC(=O)NCC(C)C(O)=O Amb19027704 [0,1,0,0,0,0|1,0,0]=2 646 B10R0.82 COC(=O)NCC(O)C(N)=O Amb24755696 [0,1,0,0,0,0|2,0,0]=3 647 B10R0.82 COC(=O)NC[C@H](N)C(O)=O Amb25383797 [0,1,0,0,0,0|1,0,0]=2 648 B10R0.82 COC(=O)\C=C\C(N)C(O)=O Amb25385682 [0,1,0,0,0,0|0,0,2]=3 649 B10R0.82 C\C(=C\CC(=O)OC)\C(O)=O Amb25385213 [0,1,0,0,0,0|0,0,2]=3 650 B10R0.82 C\N=[N+](\[O-])/CC[C@H](N)C(O)=O Amb25379956 [0,1,0,0,0,0|2,0,1]=4 651 B10R0.82 NC(CCC(=O)CCl)C(O)=O Amb21929315 [0,1,0,0,0,0|2,0,0]=3 652 B10R0.82 NC(CCC(=O)NO)C(O)=O Amb22350145 [0,1,0,0,0,0|2,0,0]=3 653 B10R0.82 NNC(=O)CC[C@@H](N)C(O)=O Amb22800002 [0,1,0,0,0,0|2,0,0]=3 654 B10R0.82 NNC(=O)CC[C@H](N)C(O)=O Amb25379957 [0,1,0,0,0,0|2,0,0]=3 655 B10R0.82 N[C@@H](CNC(=O)C=O)C(O)=O Amb25383912 [0,1,0,0,0,0|3,0,0]=4 656 B10R0.82 N[C@@H](CNC(=O)CCl)C(O)=O Amb25386345 [0,1,0,0,0,0|3,0,0]=4 657 B10R0.82 N[C@@H](CNC(=O)CI)C(O)=O Amb25383795 [0,1,0,0,0,0|3,0,0]=4 658 B10R0.98 CC(=O)CCNC(=O)C(C)C Amb17102871 [0,1,0,0,0,0|3,0,0]=4 659 B10R0.98 CC(=O)NCCC(=O)N(C)C Amb25379220 [0,1,0,0,0,0|3,0,0]=4 660 B10R0.98 CC(C(=O)NCCC(=O)N)C Amb17232246 [0,1,0,0,0,0|3,0,0]=4 661 B10R0.98 CC(C(=O)NCCC(=O)O)C Amb1114300 [0,1,0,0,0,0|2,0,0]=3 662 B10R0.98 CC(Cl)C(=O)NCCC(O)=O Amb19011374 [0,1,0,0,0,0|2,0,0]=3 663 B10R0.98 CC(N)C(=O)NOCC(O)=O Amb25384930 [0,1,0,0,0,0|3,0,0]=4 664 B10R0.98 CC(O)C(=O)NCCC(N)=O Amb24766280 [0,1,0,0,0,0|3,0,0]=4 665 B10R0.98 CC(S)C(=O)NCCC(N)=O Amb24751266 [0,1,0,0,0,0|3,0,0]=4 666 B10R0.98 CN(C)C(=O)CCNC(N)=O Amb18183325 [0,1,0,0,0,0|3,0,0]=4 667 B10R0.98 CN(C)C(=O)C\C=C\C(O)=O Amb25385033 [0,1,0,0,0,0|1,0,2]=4 668 B10R0.98 CN(C)C(=O)NCCC(O)=O Amb18973180 [0,1,0,0,0,0|2,0,0]=3 669 B10R0.98 CN(C)C(=S)NCCC(O)=O Amb22051637 [0,1,0,0,0,0|2,1,0]=4 670 B10R0.98 C[C@@H](N)C(=O)NCCC(N)=O Amb18792076 [0,1,0,0,0,0|3,0,0]=4 671 B10R0.98 C[C@@H](N)C(=O)NCCC(O)=O Amb18792210 [0,1,0,0,0,0|2,0,0]=3 672 B10R0.98 C[C@H](N)C(=O)NOCC(O)=O Amb24068962 [0,1,0,0,0,0|3,0,0]=4 673 B10R0.98 NC(=N)C(=O)NCCC(O)=O Amb25382159 [0,1,0,0,0,0|3,0,0]=4 674 B10R0.98 OC(=O)CCCC(Cl)=C(Cl)Cl Amb25385953 [0,1,0,0,0,0|3,0,0]=4 675 B10R0.98 OC(=O)CCNC(=O)C(F)F Amb24761671 [0,1,0,0,0,0|3,0,0]=4 676 B10R1.13 CC(=O)C1CCC(=O)C=C1 Amb25718503 [0,0,0,1,0,0|2,0,1]=4 677 B10R1.13 CC(=O)C1CCC(=O)OC1 Amb25092970 [0,0,0,1,0,0|1,0,0]=2 678 B10R1.13 CC(=O)C1CCC(Br)=CC1 Amb25756617 [0,0,0,1,0,0|3,0,0]=4 679 B10R1.13 CC(C)C1CCC(=O)OC1 Amb25701848 [0,0,0,1,0,0|2,0,1]=4 680 B10R1.13 CC1CCC(CN1)C(O)=O Amb18643999 [0,0,0,1,0,0|2,0,1]=4 681 B10R1.13 CC1OCC(CO1)C(O)=O Amb25723862 [0,0,0,1,0,0|2,0,1]=4 682 B10R1.13 CC=1CCC(CC1)C(=O)Cl Amb24654574 [0,0,0,1,0,0|3,0,0]=4 683 B10R1.13 CC=1CCC(CC1)C(O)=O Amb18124574 [0,0,0,1,0,0|2,0,0]=3 684 B10R1.13 CC=1CC[C@@H](CC1)C(=O)Cl Amb24709289 [0,0,0,1,0,0|3,0,0]=4 685 B10R1.13 CC=1CC[C@@H](CC1)C(O)=O Amb24746758 [0,0,0,1,0,0|2,0,0]=3 686 B10R1.13 CC=1CC[C@H](CC1)C(C)=O Amb24721964 [0,0,0,1,0,0|3,0,0]=4 687 B10R1.13 CC=1CC[C@H](CC1)C(O)=O Amb24505311 [0,0,0,1,0,0|2,0,0]=3 688 B10R1.13 CC=1COC(CC1)C(O)=O Amb25836036 [0,0,0,1,0,0|3,0,0]=4 689 B10R1.13 CN1CCC(CC1)C(=O)O Amb2236137 [0,0,0,1,0,0|3,0,0]=4 690 B10R1.13 CN1CCC(CC1)C(=O)O Amb2237314 [0,0,0,1,0,0|3,0,0]=4 691 B10R1.13 CN1CCC(CC1)C(O)=O Amb22491433 [0,0,0,1,0,0|3,0,0]=4 692 B10R1.13 CN1CCC(CC1)C(O)=O Amb22491939 [0,0,0,1,0,0|3,0,0]=4 693 B10R1.13 CN1CCC(CN1)C(O)=O Amb25311512 [0,0,0,1,0,0|3,0,0]=4 694 B10R1.13 C[C@@H]1CC[C@@H](CC1)C(=O)O Amb10843977 [0,0,0,1,0,0|2,0,1]=4 695 B10R1.13 C[C@@H]1CC[C@@H](CN1)C(O)=O Amb24620510 [0,0,0,1,0,0|2,0,1]=4 696 B10R1.13 C[C@@H]1CC[C@H](CN1)C(O)=O Amb24059653 [0,0,0,1,0,0|2,0,1]=4 697 B10R1.13 C[C@@H]1CN[C@@H](CO1)C(O)=O Amb24694579 [0,0,0,1,0,0|2,0,1]=4 698 B10R1.13 C[C@H](O)C1CCC(=O)CC1 Amb24401648 [0,0,0,1,0,0|2,0,1]=4 699 B10R1.13 C[C@H]1CC[C@H](CN1)C(O)=O Amb24580654 [0,0,0,1,0,0|2,0,1]=4 700 B10R1.13 C[C@H]1CN[C@@H](CO1)C(O)=O Amb24699378 [0,0,0,1,0,0|2,0,1]=4 701 B10R1.13 NC(=O)C1CCC(=O)CC1 Amb21964140 [0,0,0,1,0,0|2,0,0]=3 702 B10R1.13 NC(=O)C1CCC(=O)NC1 Amb20668378 [0,0,0,1,0,0|2,0,0]=3 703 B10R1.13 NC(=O)C1CCC(F)=CC1 Amb24411550 [0,0,0,1,0,0|3,0,0]=4 704 B10R1.13 NC=1CCC(CN1)C(=O)Cl Amb24547094 [0,0,0,1,0,0|3,0,0]=4 705 B10R1.13 NC=1NCC(CN1)C(O)=O Amb24063113 [0,0,0,1,0,0|3,0,0]=4 706 B10R1.13 N[C@@H]1CC[C@@H](CC1)C(=O)O Amb10070763 [0,0,0,1,0,0|2,0,1]=4 707 B10R1.13 O=C1CCC(CC1)C(=O)Cl Amb10071440 [0,0,0,1,0,0|2,0,0]=3 708 B10R1.13 O=C1CCN(CC1)C(=O)C Amb2582739 [0,0,0,1,0,0|3,0,0]=4 709 B10R1.13 O=C1CCN(CC1)C(=O)N Amb1158070 [0,0,0,1,0,0|3,0,0]=4 710 B10R1.13 OC(=O)C1CC=C(F)CN1 Amb25175831 [0,0,0,1,0,0|3,0,0]=4 711 B10R1.13 OC(=O)C1CCC(=C)CC1 Amb15695314 [0,0,0,1,0,0|2,0,0]=3 712 B10R1.13 OC(=O)C1CCC(=O)CN1 Amb21960863 [0,0,0,1,0,0|2,0,0]=3 713 B10R1.13 OC(=O)C1CCC(=O)CO1 Amb23596936 [0,0,0,1,0,0|2,0,0]=3 714 B10R1.13 OC(=O)C1CCC(=O)CS1 Amb23596925 [0,0,0,1,0,0|2,0,0]=3 715 B10R1.13 OC(=O)C1CCC(=O)NN1 Amb23441127 [0,0,0,1,0,0|2,0,0]=3 716 B10R1.13 OC(=O)C1CCC(=O)SC1 Amb24637279 [0,0,0,1,0,0|0,1,0]=2 717 B10R1.13 OC(=O)C1CCC(CC1)[*] Amb20246716 [0,0,0,1,0,0|2,0,1]=4 718 B10R1.13 OC(=O)C1CCC(Cl)=CC1 Amb18645430 [0,0,0,1,0,0|2,0,0]=3 719 B10R1.13 OC(=O)C1CCC(Cl)CC1 Amb18126347 [0,0,0,1,0,0|2,0,1]=4 720 B10R1.13 OC(=O)C1CCC(F)CC1 Amb20670645 [0,0,0,1,0,0|2,0,1]=4 721 B10R1.13 OC(=O)C1CCC(S)NC1 Amb24635693 [0,0,0,1,0,0|1,1,1]=4 722 B10R1.13 OC(=O)C1CCS(=O)CC1 Amb25295426 [0,0,0,1,0,0|2,0,0]=3 723 B10R1.13 OC(=O)C1CNC(=O)CN1 Amb22235954 [0,0,0,1,0,0|2,0,0]=3 724 B10R1.13 OC(=O)C1CNC(=O)CN1 Amb22641428 [0,0,0,1,0,0|2,0,0]=3 725 B10R1.13 OC(=O)C=1CCC(=O)CC1 Amb24656398 [0,0,0,1,0,0|1,0,2]=4 726 B10R1.13 OC(=O)C=1CCC(=O)NC1 Amb22011873 [0,0,0,1,0,0|1,0,2]=4 727 B10R1.13 OC(=O)[C@@H]1CCC(=O)CN1 Amb24655763 [0,0,0,1,0,0|2,0,0]=3 728 B10R1.13 OC(=O)[C@@H]1CC[C@@H](Cl)CC1 Amb24482268 [0,0,0,1,0,0|2,0,1]=4 729 B10R1.13 OC(=O)[C@@H]1CNC(=O)CN1 Amb22746776 [0,0,0,1,0,0|2,0,0]=3 730 B10R1.13 OC(=O)[C@@H]1CNC(=O)CN1 Amb22756547 [0,0,0,1,0,0|2,0,0]=3 731 B10R1.13 OC(=O)[C@H]1CC[C@@H](Cl)CC1 Amb25295435 [0,0,0,1,0,0|2,0,1]=4 732 B10R1.13 OC(=O)[C@H]1CC[C@@H](S)CC1 Amb25109333 [0,0,0,1,0,0|1,1,1]=4 733 B10R1.13 OC(=O)[C@H]1CNC(=O)CN1 Amb24423079 [0,0,0,1,0,0|2,0,0]=3 734 B10R1.13 O[C@@H]1CC[C@H](CC1)C(O)=O Amb22387641 [0,0,0,1,0,0|1,0,2]=4 735 B10R1.13 O[C@H]1CC[C@H](CC1)C(O)=O Amb22387642 [0,0,0,1,0,0|1,0,2]=4 736 B10R1.14 C#CC(=O)C1CCC(=O)O1 Amb25145515 [0,0,0,1,0,0|1,0,1]=3 737 B10R1.14 C=C(CBr)[C@@H]1CCC(=O)O1 Amb25771675 [0,0,0,1,0,0|3,0,0]=4 738 B10R1.14 C=C(CCl)[C@@H]1CCC(=O)O1 Amb25757919 [0,0,0,1,0,0|3,0,0]=4 739 B10R1.14 C=CC(=O)C1CC(=O)CC1 Amb24379029 [0,0,0,1,0,0|2,0,1]=4 740 B10R1.14 CC(=CCl)[C@@H]1CCC(=O)O1 Amb24595368 [0,0,0,1,0,0|3,0,0]=4 741 B10R1.14 CC(OC)C1CNC(=O)O1 Amb24574509 [0,0,0,1,0,0|2,0,1]=4 742 B10R1.14 CC1CCC(N1)C(=O)OC Amb23440861 [0,0,0,1,0,0|2,0,1]=4 743 B10R1.14 CC1CCC(O1)C(=O)CC Amb24379971 [0,0,0,1,0,0|2,0,1]=4 744 B10R1.14 CC1CCC(O1)C(=O)NC Amb25717042 [0,0,0,1,0,0|2,0,1]=4 745 B10R1.14 CC1CCC([NH2+]1)C(=O)OC Amb23440874 [0,0,0,1,0,0|2,0,1]=4 746 B10R1.14 CC1CC[C@H](N1)C(=O)OC Amb25843220 [0,0,0,1,0,0|2,0,1]=4 747 B10R1.14 CC=1CCC(C1)C(=O)OC Amb24527976 [0,0,0,1,0,0|2,0,0]=3 748 B10R1.14 CC=1CNC(C1)C(=O)OC Amb24455170 [0,0,0,1,0,0|3,0,0]=4 749 B10R1.14 CC=1CSC(N1)C(=O)OC Amb24061365 [0,0,0,1,0,0|3,0,0]=4 750 B10R1.14 CC=1C[C@@H](CC1)C(=O)OC Amb24614987 [0,0,0,1,0,0|2,0,1]=4 751 B10R1.14 CC=1C[C@H](CC1)C(=O)OC Amb25337148 [0,0,0,1,0,0|2,0,1]=4 752 B10R1.14 CCC(=O)C1CC(=O)CC1 Amb25729690 [0,0,0,1,0,0|2,0,0]=3 753 B10R1.14 CCC(=O)C1CCC(=O)O1 Amb25206074 [0,0,0,1,0,0|1,0,0]=2 754 B10R1.14 CCC(=O)[C@@H]1CCC(=O)O1 Amb24737567 [0,0,0,1,0,0|1,0,0]=2 755 B10R1.14 CCC(=O)[C@H]1CCC(=O)O1 Amb25059732 [0,0,0,1,0,0|1,0,0]=2 756 B10R1.14 CCC(O)C1CCC(=O)O1 Amb25296052 [0,0,0,1,0,0|1,0,2]=4 757 B10R1.14 CCS(=O)C1CC(=O)CC1 Amb24438423 [0,0,0,1,0,0|3,0,0]=4 758 B10R1.14 CNC(=O)C1CC(=O)SC1 Amb25307359 [0,0,0,1,0,0|3,0,0]=4 759 B10R1.14 CNC(=O)C1CCC(=O)N1 Amb24505177 [0,0,0,1,0,0|2,0,0]=3 760 B10R1.14 CNC(=O)C1CNC(=O)C1 Amb24682056 [0,0,0,1,0,0|3,0,0]=4 761 B10R1.14 CNC(=O)C1CNC(=O)N1 Amb25205590 [0,0,0,1,0,0|3,0,0]=4 762 B10R1.14 CNC(=O)C1COC(=O)N1 Amb25838388 [0,0,0,1,0,0|3,0,0]=4 763 B10R1.14 CNC(=O)C1CSC(=O)N1 Amb24448817 [0,0,0,1,0,0|3,0,0]=4 764 B10R1.14 CNC(=O)[C@@H]1CCC(=O)N1 Amb24479092 [0,0,0,1,0,0|2,0,0]=3 765 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 Amb24442752 [0,0,0,1,0,0|1,0,0]=2 766 B10R1.14 COC(=O)C1=CNC(=O)O1 Amb24383979 [0,0,0,1,0,0|1,0,2]=4 767 B10R1.14 COC(=O)C1CC(=C)CC1 Amb25853444 [0,0,0,1,0,0|2,0,0]=3 768 B10R1.14 COC(=O)C1CC(=O)C=C1 Amb22001854 [0,0,0,1,0,0|1,0,2]=4 769 B10R1.14 COC(=O)C1CC(=O)CO1 Amb22755134 [0,0,0,1,0,0|2,0,0]=3 770 B10R1.14 COC(=O)C1CC(=O)CS1 Amb18199422 [0,0,0,1,0,0|2,0,0]=3 771 B10R1.14 COC(=O)C1CC(=S)SC1 Amb24361842 [0,0,0,1,0,0|2,1,0]=4 772 B10R1.14 COC(=O)C1CC(CN1)O Amb1088852 [0,0,0,1,0,0|2,0,1]=4 773 B10R1.14 COC(=O)C1CC(CN1)O Amb1152079 [0,0,0,1,0,0|2,0,1]=4 774 B10R1.14 COC(=O)C1CC(O)CO1 Amb24648233 [0,0,0,1,0,0|2,0,1]=4 775 B10R1.14 COC(=O)C1CCC(=O)C1 Amb10067354 [0,0,0,1,0,0|1,0,0]=2 776 B10R1.14 COC(=O)C1CCC(=O)O1 Amb22230883 [0,0,0,1,0,0|0,0,0]=1 777 B10R1.14 COC(=O)C1CCC(C)O1 Amb17939078 [0,0,0,1,0,0|1,0,1]=3 778 B10R1.14 COC(=O)C1CCC(Cl)C1 Amb24482447 [0,0,0,1,0,0|2,0,1]=4 779 B10R1.14 COC(=O)C1CCC(F)C1 Amb23456070 [0,0,0,1,0,0|2,0,1]=4 780 B10R1.14 COC(=O)C1CCC(N)C1 Amb22001889 [0,0,0,1,0,0|2,0,1]=4 781 B10R1.14 COC(=O)C1CCC(N)C1 Amb22491847 [0,0,0,1,0,0|2,0,1]=4 782 B10R1.14 COC(=O)C1CCC(O)C1 Amb22755872 [0,0,0,1,0,0|1,0,1]=3 783 B10R1.14 COC(=O)C1CCC(O)O1 Amb24440696 [0,0,0,1,0,0|0,0,2]=3 784 B10R1.14 COC(=O)C1COC(=O)N1 Amb22432172 [0,0,0,1,0,0|2,0,0]=3 785 B10R1.14 COC(=O)C1COC(=O)O1 Amb25174271 [0,0,0,1,0,0|1,0,0]=2 786 B10R1.14 COC(=O)C1COC(Cl)=N1 Amb25376444 [0,0,0,1,0,0|3,0,0]=4 787 B10R1.14 COC(=O)C1CSC(=O)N1 Amb25808207 [0,0,0,1,0,0|2,0,0]=3 788 B10R1.14 COC(=O)C1CSC(=S)N1 Amb25774448 [0,0,0,1,0,0|2,1,0]=4 789 B10R1.14 COC(=O)C1C[C@@H](O)CN1 Amb24729826 [0,0,0,1,0,0|2,0,1]=4 790 B10R1.14 COC(=O)C1OC(O)CS1 Amb25137201 [0,0,0,1,0,0|1,0,2]=4 791 B10R1.14 COC(=O)C=1CCC(=O)C1 Amb22757122 [0,0,0,1,0,0|1,0,1]=3 792 B10R1.14 COC(=O)C=1CCC(O)C1 Amb25373876 [0,0,0,1,0,0|1,0,2]=4 793 B10R1.14 COC(=O)C=1COC(=O)C1 Amb25760743 [0,0,0,1,0,0|2,0,1]=4 794 B10R1.14 COC(=O)N1CC(=O)CC1 Amb21964722 [0,0,0,1,0,0|2,0,0]=3 795 B10R1.14 COC(=O)N1CC(O)CC1 Amb24457006 [0,0,0,1,0,0|2,0,1]=4 796 B10R1.14 COC(=O)N1C[C@H](O)CC1 Amb24479237 [0,0,0,1,0,0|2,0,1]=4 797 B10R1.14 COC(=O)[C@@H]1CC(=O)CC1 Amb23440273 [0,0,0,1,0,0|1,0,0]=2 798 B10R1.14 COC(=O)[C@@H]1CC(O)CN1 Amb25045942 [0,0,0,1,0,0|2,0,1]=4 799 B10R1.14 COC(=O)[C@@H]1CCC(=O)O1 Amb22226740 [0,0,0,1,0,0|0,0,0]=1 800 B10R1.14 COC(=O)[C@@H]1CCC(=S)N1 Amb24066743 [0,0,0,1,0,0|1,1,0]=3 801 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 Amb24183379 [0,0,0,1,0,0|2,0,1]=4 802 B10R1.14 COC(=O)[C@@H]1CC[C@@H](O)N1 Amb25247552 [0,0,0,1,0,0|1,0,1]=3 803 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 Amb23440272 [0,0,0,1,0,0|2,0,1]=4 804 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 Amb22746119 [0,0,0,1,0,0|1,0,1]=3 805 B10R1.14 COC(=O)[C@@H]1CNC(=O)N1 Amb23598431 [0,0,0,1,0,0|2,0,0]=3 806 B10R1.14 COC(=O)[C@@H]1COC(=O)N1 Amb22746545 [0,0,0,1,0,0|2,0,0]=3 807 B10R1.14 COC(=O)[C@@H]1COC(=S)N1 Amb24741844 [0,0,0,1,0,0|2,1,0]=4 808 B10R1.14 COC(=O)[C@@H]1CSC(=O)N1 Amb24452632 [0,0,0,1,0,0|2,0,0]=3 809 B10R1.14 COC(=O)[C@@H]1CSC(=S)N1 Amb25275562 [0,0,0,1,0,0|2,1,0]=4 810 B10R1.14 COC(=O)[C@@H]1C[C@H](C[NH2+]1)O Amb10601653 [0,0,0,1,0,0|2,0,1]=4 811 B10R1.14 COC(=O)[C@@H]1C[C@H](C[NH2+]1)O Amb10604591 [0,0,0,1,0,0|2,0,1]=4 812 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 Amb22230437 [0,0,0,1,0,0|2,0,1]=4 813 B10R1.14 COC(=O)[C@@H]1O[C@@H](O)CS1 Amb24613917 [0,0,0,1,0,0|1,0,2]=4 814 B10R1.14 COC(=O)[C@H]1CC(=O)CN1 Amb24642943 [0,0,0,1,0,0|2,0,0]=3 815 B10R1.14 COC(=O)[C@H]1CC(=O)NC1 Amb24479010 [0,0,0,1,0,0|2,0,0]=3 816 B10R1.14 COC(=O)[C@H]1CC(O)CN1 Amb24544095 [0,0,0,1,0,0|2,0,1]=4 817 B10R1.14 COC(=O)[C@H]1CCC(=O)O1 Amb22225396 [0,0,0,1,0,0|0,0,0]=1 818 B10R1.14 COC(=O)[C@H]1CCC(N)=N1 Amb25347208 [0,0,0,1,0,0|2,0,0]=3 819 B10R1.14 COC(=O)[C@H]1CC[C@@H](N)C1 Amb25230396 [0,0,0,1,0,0|2,0,1]=4 820 B10R1.14 COC(=O)[C@H]1CC[C@H](F)N1 Amb25174995 [0,0,0,1,0,0|2,0,1]=4 821 B10R1.14 COC(=O)[C@H]1CN(C)CC1 Amb24334710 [0,0,0,1,0,0|3,0,0]=4 822 B10R1.14 COC(=O)[C@H]1CNC(=O)N1 Amb25340401 [0,0,0,1,0,0|2,0,0]=3 823 B10R1.14 COC(=O)[C@H]1CNC(=O)O1 Amb24759470 [0,0,0,1,0,0|1,0,0]=2 824 B10R1.14 COC(=O)[C@H]1COC(=O)N1 Amb19929331 [0,0,0,1,0,0|2,0,0]=3 825 B10R1.14 COC(=O)[C@H]1COC(=S)N1 Amb24638764 [0,0,0,1,0,0|2,1,0]=4 826 B10R1.14 COC(=O)[C@H]1CSC(=S)N1 Amb24340335 [0,0,0,1,0,0|2,1,0]=4 827 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O Amb10069258 [0,0,0,1,0,0|2,0,1]=4 828 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CO1 Amb25176771 [0,0,0,1,0,0|2,0,1]=4 829 B10R1.14 COC(=O)[C@H]1C[C@H](O)CO1 Amb25176770 [0,0,0,1,0,0|2,0,1]=4 830 B10R1.14 C[C@@H]1CC[C@@H](O1)C(=O)OC Amb24630211 [0,0,0,1,0,0|1,0,1]=3 831 B10R1.14 C[C@H]1CC[C@H](C1)C(=O)OC Amb24578320 [0,0,0,1,0,0|2,0,1]=4 832 B10R1.14 C[C@H]1CC[C@H](O1)C(=O)NC Amb24619489 [0,0,0,1,0,0|2,0,1]=4 833 B10R1.14 C[C@H]1CC[C@H](O1)C(=O)OC Amb25366304 [0,0,0,1,0,0|1,0,1]=3 834 B10R1.14 NNC(=O)C1CCC(=O)N1 Amb1781033 [0,0,0,1,0,0|3,0,0]=4 835 B10R1.14 NNC(=O)C1CCC(=O)N1 Amb25318372 [0,0,0,1,0,0|3,0,0]=4 836 B10R1.14 NNC(=O)[C@@H]1CCC(=O)N1 Amb24483983 [0,0,0,1,0,0|3,0,0]=4 837 B10R1.14 NNC(=O)[C@@H]1CCC(=O)N1 Amb24715891 [0,0,0,1,0,0|3,0,0]=4 838 B10R1.14 NNC(=O)[C@H]1CCC(=O)N1 Amb25848117 [0,0,0,1,0,0|3,0,0]=4 839 B10R1.14 O=C1CC[C@H](O1)C(=O)CCl Amb24505271 [0,0,0,1,0,0|2,0,0]=3 840 B10R1.14 ONC(=O)C1CCC(=O)N1 Amb24377086 [0,0,0,1,0,0|3,0,0]=4 841 B10R1.31 CCC1=NC(CS1)C(O)=O Amb24529169 [0,0,0,1,0,0|3,0,0]=4 842 B10R1.31 CCC1=NCC(O1)C(O)=O Amb25291179 [0,0,0,1,0,0|2,0,1]=4 843 B10R1.31 CCC1CCC(N1)C(O)=O Amb24694112 [0,0,0,1,0,0|2,0,1]=4 844 B10R1.31 CCC1CCC(O1)C(O)=O Amb20668759 [0,0,0,1,0,0|1,0,2]=4 845 B10R1.31 CCC1CC[C@H](N1)C(O)=O Amb24376251 [0,0,0,1,0,0|2,0,1]=4 846 B10R1.31 CCC=1CCC(N1)C(O)=O Amb23560251 [0,0,0,1,0,0|2,0,0]=3 847 B10R1.31 CCC=1NCC(N1)C(O)=O Amb24558927 [0,0,0,1,0,0|3,0,0]=4 848 B10R1.31 CCN1CCC(C1)C(=O)O Amb10607746 [0,0,0,1,0,0|3,0,0]=4 849 B10R1.31 CCN1C[C@@H](CC1)C(O)=O Amb24733745 [0,0,0,1,0,0|3,0,0]=4 850 B10R1.31 CNC1CC(CC1)C(O)=O Amb23454119 [0,0,0,1,0,0|2,0,1]=4 851 B10R1.31 COC1CC(CC1)C(O)=O Amb24399167 [0,0,0,1,0,0|1,0,1]=3 852 B10R1.31 COC1CCC(O1)C(C)=O Amb24645446 [0,0,0,1,0,0|1,0,2]=4 853 B10R1.31 COC1CNC(C1)C(O)=O Amb18124718 [0,0,0,1,0,0|2,0,1]=4 854 B10R1.31 CO[C@@H]1CN[C@@H](C1)C(O)=O Amb24514992 [0,0,0,1,0,0|2,0,1]=4 855 B10R1.31 CO[C@@H]1CN[C@H](C1)C(O)=O Amb24112984 [0,0,0,1,0,0|2,0,1]=4 856 B10R1.31 CO[C@H]1CN[C@H](C1)C(O)=O Amb25231723 [0,0,0,1,0,0|2,0,1]=4 857 B10R1.31 NN=C1CCC(C1)C(O)=O Amb25734466 [0,0,0,1,0,0|3,0,0]=4 858 B10R1.31 N\N=C\1/CCC(C1)C(O)=O Amb23453110 [0,0,0,1,0,0|3,0,0]=4 859 B10R1.31 OC(=O)C1CC(CC1)=NO Amb24569321 [0,0,0,1,0,0|3,0,0]=4 860 B10R1.31 OC(=O)C1C\C(\CC1)=N\O Amb23453115 [0,0,0,1,0,0|3,0,0]=4 861 B10R1.31 OC(=O)[C@H]1CC(CC1)=NO Amb25367253 [0,0,0,1,0,0|3,0,0]=4 862 B10R1.54 C=C1CC(CC(O)=O)CC1 Amb25354325 [0,0,0,1,0,0|2,0,0]=3 863 B10R1.54 CC(=C)CC1CC(=O)CC1 Amb24632315 [0,0,0,1,0,0|3,0,0]=4 864 B10R1.54 CC(=O)CC1CC(=O)C=C1 Amb25838767 [0,0,0,1,0,0|2,0,1]=4 865 B10R1.54 CC(=O)CC1CCC(=O)N1 Amb18831756 [0,0,0,1,0,0|3,0,0]=4 866 B10R1.54 CC(=O)CC1CCC(=O)O1 Amb25146882 [0,0,0,1,0,0|3,0,0]=4 867 B10R1.54 CC(=O)C[C@H]1CC(=O)CC1 Amb25768398 [0,0,0,1,0,0|2,0,0]=3 868 B10R1.54 CC(=O)NC1CC(=O)OC1 Amb25276428 [0,0,0,1,0,0|2,0,0]=3 869 B10R1.54 CC(=O)N[C@@H]1CC(=O)OC1 Amb24644279 [0,0,0,1,0,0|2,0,0]=3 870 B10R1.54 CC(=O)N[C@H]1CC(=O)OC1 Amb24396581 [0,0,0,1,0,0|2,0,0]=3 871 B10R1.54 CC(=O)OC1CC(=O)CC1 Amb25767701 [0,0,0,1,0,0|3,0,0]=4 872 B10R1.54 CC(=O)OC1CC(=O)NC1 Amb25710818 [0,0,0,1,0,0|3,0,0]=4 873 B10R1.54 CC(=O)OC1CC(=O)OC1 Amb22730362 [0,0,0,1,0,0|2,0,0]=3 874 B10R1.54 CC(=O)O[C@@H]1CC(=O)OC1 Amb22225179 [0,0,0,1,0,0|2,0,0]=3 875 B10R1.54 CC(=O)S[C@@H]1CC(=O)NC1 Amb24592595 [0,0,0,1,0,0|3,0,0]=4 876 B10R1.54 CC(=O)S[C@H]1CC(=O)NC1 Amb25798924 [0,0,0,1,0,0|3,0,0]=4 877 B10R1.54 CC1CC(CC1)CC(O)=O Amb18643912 [0,0,0,1,0,0|2,0,1]=4 878 B10R1.54 CN1CC(CC(O)=O)CC1 Amb21857556 [0,0,0,1,0,0|3,0,0]=4 879 B10R1.54 C[C@H](O)C[C@@H]1COC(=O)N1 Amb24567006 [0,0,0,1,0,0|2,0,1]=4 880 B10R1.54 NC(=O)CC1CCC(=O)N1 Amb24480789 [0,0,0,1,0,0|3,0,0]=4 881 B10R1.54 NC(=O)CC1COC(=O)N1 Amb24707993 [0,0,0,1,0,0|2,0,0]=3 882 B10R1.54 NC(=O)CN1CC(=O)CC1 Amb24539912 [0,0,0,1,0,0|3,0,0]=4 883 B10R1.54 NC(=O)NC1CC(=O)NC1 Amb25140616 [0,0,0,1,0,0|3,0,0]=4 884 B10R1.54 N[C@@H]1CC[C@@H](C1)CC(=O)O Amb10066892 [0,0,0,1,0,0|2,0,1]=4 885 B10R1.54 N[C@@H]1CC[C@H](C1)CC(=O)O Amb10066890 [0,0,0,1,0,0|2,0,1]=4 886 B10R1.54 N[C@H]1CC[C@@H](C1)CC(=O)O Amb10066891 [0,0,0,1,0,0|2,0,1]=4 887 B10R1.54 N[C@H]1CC[C@H](C1)CC(=O)O Amb10066912 [0,0,0,1,0,0|2,0,1]=4 888 B10R1.54 OC(=O)CC1CC(=O)C=C1 Amb25831069 [0,0,0,1,0,0|1,0,1]=3 889 B10R1.54 OC(=O)CC1CC(=O)CC1 Amb18643816 [0,0,0,1,0,0|1,0,0]=2 890 B10R1.54 OC(=O)CC1CC(=O)NC1 Amb18831602 [0,0,0,1,0,0|1,0,0]=2 891 B10R1.54 OC(=O)CC1CC(=O)OC1 Amb20669416 [0,0,0,1,0,0|0,0,0]=1 892 B10R1.54 OC(=O)CC1CCC(=O)N1 Amb2372619 [0,0,0,1,0,0|2,0,0]=3 893 B10R1.54 OC(=O)CC1CCC(F)C1 Amb24679226 [0,0,0,1,0,0|2,0,1]=4 894 B10R1.54 OC(=O)CC1CNC(=O)O1 Amb18644185 [0,0,0,1,0,0|2,0,0]=3 895 B10R1.54 OC(=O)CC1CSC(=N)N1 Amb17688035 [0,0,0,1,0,0|2,1,0]=4 896 B10R1.54 OC(=O)CC1CSC(=O)S1 Amb25108490 [0,0,0,1,0,0|1,1,0]=3 897 B10R1.54 OC(=O)CC1NC(=O)CS1 Amb24482236 [0,0,0,1,0,0|3,0,0]=4 898 B10R1.54 OC(=O)CC=1CC(=O)ON1 Amb18202495 [0,0,0,1,0,0|1,0,1]=3 899 B10R1.54 OC(=O)CN1CC(=O)CC1 Amb22496571 [0,0,0,1,0,0|2,0,0]=3 900 B10R1.54 OC(=O)CN1CCC(=O)N1 Amb25208783 [0,0,0,1,0,0|3,0,0]=4 901 B10R1.54 OC(=O)C[C@@H]1CC(=O)C=C1 Amb24746679 [0,0,0,1,0,0|1,0,1]=3 902 B10R1.54 OC(=O)C[C@@H]1CC(=O)CC1 Amb22898751 [0,0,0,1,0,0|1,0,0]=2 903 B10R1.54 OC(=O)C[C@@H]1CCC(=O)N1 Amb22587587 [0,0,0,1,0,0|2,0,0]=3 904 B10R1.54 OC(=O)C[C@@H]1CCC(=O)O1 Amb22746828 [0,0,0,1,0,0|2,0,0]=3 905 B10R1.54 OC(=O)C[C@@H]1CNC(=O)O1 Amb25147304 [0,0,0,1,0,0|2,0,0]=3 906 B10R1.54 OC(=O)C[C@H]1C=CC(=O)O1 Amb25069009 [0,0,0,1,0,0|2,0,1]=4 907 B10R1.54 OC(=O)C[C@H]1CC(=O)CC1 Amb24480441 [0,0,0,1,0,0|1,0,0]=2 908 B10R1.54 OC(=O)C[C@H]1CC(=O)NC1 Amb24410373 [0,0,0,1,0,0|1,0,0]=2 909 B10R1.54 OC(=O)C[C@H]1CCC(=O)N1 Amb22587585 [0,0,0,1,0,0|2,0,0]=3 910 B10R1.54 OC(=O)C[C@H]1CNC(=O)O1 Amb24529265 [0,0,0,1,0,0|2,0,0]=3 911 B10R1.54 OC(=O)C[C@H]1COC(=O)N1 Amb25744486 [0,0,0,1,0,0|1,0,0]=2 912 B10R1.54 [O-][N+](=O)CC1CC(=O)CC1 Amb21964316 [0,0,0,1,0,0|2,0,1]=4 913 B10R1.79 O=C1CCCC(=O)NCC1 Amb24427297 [0,0,0,1,0,0|2,0,0]=3 914 B10R1.79 O=C1CCCS(=O)CCC1 Amb25146577 [0,0,0,1,0,0|3,0,0]=4 915 B10R1.79 O=C1CCNC(=O)CCN1 Amb23403556 [0,0,0,1,0,0|3,0,0]=4 916 B10R1.127 OC(=O)CCCN1CCC1 Amb24454983 [0,0,0,1,0,0|3,0,0]=4 917 B10R1.150 COC(=O)CC1CC(=O)C1 Amb22001609 [0,0,0,1,0,0|1,0,0]=2 918 B10R1.150 COC(=O)CC1CC(=O)N1 Amb24117255 [0,0,0,1,0,0|1,0,0]=2 919 B10R1.150 COC(=O)CC=1NC(=O)N1 Amb25375063 [0,0,0,1,0,0|2,0,1]=4 920 B10R1.150 COC(=O)C[C@@H]1CC(=O)N1 Amb25142433 [0,0,0,1,0,0|1,0,0]=2 921 B10R1.150 COC(=O)C[C@H]1CC(=O)N1 Amb25076739 [0,0,0,1,0,0|1,0,0]=2 922 B10R1.150 COC(=O)NC1CC(O)C1 Amb24581937 [0,0,0,1,0,0|2,0,1]=4 923 B10R1.150 COC(=O)SC1CC(=O)N1 Amb24378134 [0,0,0,1,0,0|2,0,0]=3 924 B10R1.150 CSC(=O)SC1CC(=O)N1 Amb24378125 [0,0,0,1,0,0|2,1,0]=4 925 B10R1.168 CCC1CC(CC(O)=O)C1 Amb24585666 [0,0,0,1,0,0|2,0,1]=4 926 B10R1.168 COC1CN(C1)CC(O)=O Amb24598054 [0,0,0,1,0,0|2,0,1]=4 927 B10R1.194 C=C1C(CCC1=O)C(N)=O Amb24529259 [0,0,0,1,0,0|2,0,1]=4 928 B10R1.194 C=C1C(CCC1=O)C(O)=O Amb18643488 [0,0,0,1,0,0|1,0,1]=3 929 B10R1.194 C=C1C(COC1=O)C(O)=O Amb18643787 [0,0,0,1,0,0|2,0,1]=4 930 B10R1.194 C=C1CCC(C1N)C(O)=O Amb25690409 [0,0,0,1,0,0|3,0,0]=4 931 B10R1.194 CC(=C)[C@H]1CCC(=O)C1C Amb24691418 [0,0,0,1,0,0|3,0,0]=4 932 B10R1.194 CC(=O)C1CCC(=O)C1C Amb25834380 [0,0,0,1,0,0|2,0,0]=3 933 B10R1.194 CC(=O)N1CCC(=O)C1C Amb25044271 [0,0,0,1,0,0|3,0,0]=4 934 B10R1.194 CC(=O)[C@@H]1COC(=O)[C@@H]1C Amb18202639 [0,0,0,1,0,0|3,0,0]=4 935 B10R1.194 CC(=O)[C@H]1COC(=O)[C@@H]1C Amb25273006 [0,0,0,1,0,0|3,0,0]=4 936 B10R1.194 CC1C(CCC1=O)C(=O)Cl Amb25735280 [0,0,0,1,0,0|2,0,0]=3 937 B10R1.194 CC1C(CCC1=O)C(N)=O Amb24394485 [0,0,0,1,0,0|2,0,0]=3 938 B10R1.194 CC1C(CCC1=O)C(O)=O Amb18643836 [0,0,0,1,0,0|1,0,0]=2 939 B10R1.194 CC1C(CCC1O)C(O)=O Amb24543785 [0,0,0,1,0,0|1,0,2]=4 940 B10R1.194 CC1C(NCC1=O)C(N)=O Amb24598927 [0,0,0,1,0,0|3,0,0]=4 941 B10R1.194 CC1C(NCC1=O)C(O)=O Amb25054606 [0,0,0,1,0,0|2,0,0]=3 942 B10R1.194 CC1CCC(C(O)=O)N1C Amb25141608 [0,0,0,1,0,0|2,0,1]=4 943 B10R1.194 CC1[C@H](CCC1=O)C(O)=O Amb24538053 [0,0,0,1,0,0|1,0,0]=2 944 B10R1.194 CC=1CC[C@@H](C(C)=O)C1C Amb25707506 [0,0,0,1,0,0|3,0,0]=4 945 B10R1.194 CC=1CC[C@H](C(C)=O)C1C Amb24524367 [0,0,0,1,0,0|3,0,0]=4 946 B10R1.194 CC=1SCC(C(O)=O)[N+]1C Amb25139598 [0,0,0,1,0,0|3,0,0]=4 947 B10R1.194 CN1C(CCC1=N)C(N)=O Amb25125856 [0,0,0,1,0,0|3,0,0]=4 948 B10R1.194 CN1C(CCC1=O)C(=O)Cl Amb25359871 [0,0,0,1,0,0|2,0,0]=3 949 B10R1.194 CN1C(CCC1=O)C(O)=O Amb18279438 [0,0,0,1,0,0|1,0,0]=2 950 B10R1.194 CN1C(CCC1O)C(O)=O Amb24669369 [0,0,0,1,0,0|1,0,2]=4 951 B10R1.194 CN1C(CN=C1N)C(O)=O Amb24713732 [0,0,0,1,0,0|3,0,0]=4 952 B10R1.194 CN1C(COC1=O)C(O)=O Amb25800781 [0,0,0,1,0,0|2,0,0]=3 953 B10R1.194 CN1[C@@H](CCC1=N)C(O)=O Amb24529279 [0,0,0,1,0,0|2,0,0]=3 954 B10R1.194 CN1[C@@H](CCC1=O)C(N)=O Amb24648406 [0,0,0,1,0,0|2,0,0]=3 955 B10R1.194 CN1[C@@H](CCC1=O)C(O)=O Amb22756511 [0,0,0,1,0,0|1,0,0]=2 956 B10R1.194 CN1[C@H](CCC1=O)C(O)=O Amb24480932 [0,0,0,1,0,0|1,0,0]=2 957 B10R1.194 C[C@@H]1CC[C@@H](C(O)=O)N1C Amb24715908 [0,0,0,1,0,0|2,0,1]=4 958 B10R1.194 C[C@@H]1CC[C@@H]([C@H]1C)C(O)=O Amb24562854 [0,0,0,1,0,0|2,0,1]=4 959 B10R1.194 C[C@@H]1CC[C@H](C(O)=O)N1C Amb24667763 [0,0,0,1,0,0|2,0,1]=4 960 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(O)=O Amb24545060 [0,0,0,1,0,0|3,0,0]=4 961 B10R1.194 C[C@@H]1[C@@H](COC1=O)C(O)=O Amb25174801 [0,0,0,1,0,0|2,0,0]=3 962 B10R1.194 C[C@@H]1[C@H](C=CC1=O)C(O)=O Amb24514916 [0,0,0,1,0,0|1,0,2]=4 963 B10R1.194 C[C@@H]1[C@H](CCN1C)C(O)=O Amb18202481 [0,0,0,1,0,0|3,0,0]=4 964 B10R1.194 C[C@@H]1[C@H](NCC1=O)C(N)=O Amb25189706 [0,0,0,1,0,0|3,0,0]=4 965 B10R1.194 C[C@@H]1[C@H](NCC1=O)C(O)=O Amb18831599 [0,0,0,1,0,0|2,0,0]=3 966 B10R1.194 C[C@H]1CC[C@@H](C(O)=O)N1C Amb24715909 [0,0,0,1,0,0|2,0,1]=4 967 B10R1.194 C[C@H]1CC[C@H](C(O)=O)N1C Amb24539499 [0,0,0,1,0,0|2,0,1]=4 968 B10R1.194 C[C@H]1CC[C@H]([C@H]1C)C(O)=O Amb25260395 [0,0,0,1,0,0|2,0,1]=4 969 B10R1.194 C[C@H]1[C@@H](CC[C@@H]1O)C(O)=O Amb25174798 [0,0,0,1,0,0|1,0,2]=4 970 B10R1.194 C[C@H]1[C@H](CCN1C)C(O)=O Amb25227695 [0,0,0,1,0,0|3,0,0]=4 971 B10R1.194 C[C@H]1[C@H](COC1=O)C(O)=O Amb24562397 [0,0,0,1,0,0|2,0,0]=3 972 B10R1.194 NC1C(CNC1=O)C(O)=O Amb25683449 [0,0,0,1,0,0|3,0,0]=4 973 B10R1.194 NC1C(COC1=O)C(O)=O Amb25147505 [0,0,0,1,0,0|3,0,0]=4 974 B10R1.194 N[C@@H]1[C@H](CNC1=O)C(O)=O Amb25230623 [0,0,0,1,0,0|3,0,0]=4 975 B10R1.194 OC(=O)C1=C(C)S(=O)CC1 Amb17593998 [0,0,0,1,0,0|2,0,1]=4 976 B10R1.194 OC(=O)[C@@H]1CCC(=O)N1Cl Amb24078370 [0,0,0,1,0,0|2,0,0]=3 977 B10R1.197 COC1CCCC(=O)CC1 Amb25723338 [0,0,0,1,0,0|2,0,1]=4 978 B10R1.197 COC=1CCC(=O)CCC1 Amb24432189 [0,0,0,1,0,0|2,0,1]=4 979 B10R1.223 CCC1(C)CC1CC(O)=O Amb24679546 [0,0,0,1,0,0|2,0,1]=4 980 B10R1.277 CC=1CC(=O)CCCC1C Amb25830563 [0,0,0,1,0,0|3,0,0]=4 981 B10R1.350 NC1(CCCC(O)=O)CC1 Amb18831585 [0,0,0,1,0,0|2,0,1]=4 982 B10R1.350 OC(=O)CCCC1(C)CC1 Amb16232020 [0,0,0,1,0,0|2,0,1]=4 983 B10R1.408 CC(=C)C1CC1C(=O)CC Amb25128861 [0,0,0,1,0,0|3,0,0]=4 984 B10R1.408 CC(=C)[C@@H]1C[C@H]1C(=O)OC Amb24626564 [0,0,0,1,0,0|2,0,0]=3 985 B10R1.408 CC(=O)[C@@H]1C[C@@H]1C(=O)OC Amb25377828 [0,0,0,1,0,0|1,0,0]=2 986 B10R1.408 CC(=O)[C@@H]1C[C@H]1C(=O)OC Amb25179679 [0,0,0,1,0,0|1,0,0]=2 987 B10R1.408 CC(=O)[C@H]1OC1C(=O)OC Amb25705146 [0,0,0,1,0,0|2,0,0]=3 988 B10R1.408 CC(C)=C1CC1C(=O)OC Amb24096007 [0,0,0,1,0,0|2,0,1]=4 989 B10R1.408 CC(OC)C1CC1C(C)=O Amb25228633 [0,0,0,1,0,0|2,0,1]=4 990 B10R1.408 CCC(=O)C1OC1C(N)=O Amb24392096 [0,0,0,1,0,0|3,0,0]=4 991 B10R1.408 CCC(=O)[C@H]1O[C@H]1C(N)=O Amb25174861 [0,0,0,1,0,0|3,0,0]=4 992 B10R1.408 CNC(=O)C1CC1C(=O)O Amb17606124 [0,0,0,1,0,0|1,0,0]=2 993 B10R1.408 CNC(=O)C1CC1[N+]([O-])=O Amb25069521 [0,0,0,1,0,0|2,0,1]=4 994 B10R1.408 CNC(=O)[C@@H]1C[C@@H]1C(O)=O Amb25775433 [0,0,0,1,0,0|1,0,0]=2 995 B10R1.408 CNC(=O)[C@@H]1C[C@H]1C(O)=O Amb24055632 [0,0,0,1,0,0|1,0,0]=2 996 B10R1.408 COC(=O)C1CC1B(O)O Amb24314268 [0,0,0,1,0,0|1,0,1]=3 997 B10R1.408 COC(=O)C1CC1C(=O)Cl Amb25104983 [0,0,0,1,0,0|1,0,0]=2 998 B10R1.408 COC(=O)C1CC1C(O)=O Amb19314991 [0,0,0,1,0,0|0,0,0]=1 999 B10R1.408 COC(=O)C1OC1C(N)=O Amb25201928 [0,0,0,1,0,0|2,0,0]=3 1000 B10R1.408 COC(=O)C1OC1C(O)=O Amb25072766 [0,0,0,1,0,0|1,0,0]=2 1001 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)Cl Amb25306534 [0,0,0,1,0,0|1,0,0]=2 1002 B10R1.408 COC(=O)[C@@H]1C[C@@H]1[N+]([O-])=O Amb24664527 [0,0,0,1,0,0|1,0,1]=3 1003 B10R1.408 COC(=O)[C@@H]1C[C@H]1C(O)=O Amb24183508 [0,0,0,1,0,0|0,0,0]=1 1004 B10R1.408 COC(=O)[C@@H]1C[C@H]1[N+]([O-])=O Amb24434174 [0,0,0,1,0,0|1,0,1]=3 1005 B10R1.408 COC(=O)[C@@H]1O[C@@H]1C(O)=O Amb25799079 [0,0,0,1,0,0|1,0,0]=2 1006 B10R1.408 COC(=O)[C@@H]1O[C@H]1C(O)=O Amb25174796 [0,0,0,1,0,0|1,0,0]=2 1007 B10R1.408 COC(=O)[C@H]1O[C@@H]1C(O)=O Amb24745530 [0,0,0,1,0,0|1,0,0]=2 1008 B10R1.408 COC(=O)[C@H]1O[C@H]1C(O)=O Amb24601831 [0,0,0,1,0,0|1,0,0]=2 1009 B10R1.408 OC(=O)[C@H]1C[C@H]1C(=O)CBr Amb25179520 [0,0,0,1,0,0|2,0,0]=3 1010 B10R1.416 CCC(=O)C1CCS1(=O)=O Amb25270479 [0,0,0,1,0,0|2,0,1]=4 1011 B10R1.416 COC(=O)C1CCC1(F)F Amb24482932 [0,0,0,1,0,0|2,0,1]=4 1012 B10R1.428 COC(=O)CC1CC1(C)C Amb24654059 [0,0,0,1,0,0|2,0,1]=4 1013 B10R1.428 COC(=O)CC1CC1(Cl)Cl Amb25069522 [0,0,0,1,0,0|2,0,1]=4 1014 B10R1.485 COC1(C)CC(=O)CCC1 Amb25373406 [0,0,0,1,0,0|2,0,1]=4 1015 B8R0.9 BC(=O)NCC(=O)OC Amb22343192 [0,0,0,0,1,0|2,0,0]=3 1016 B8R0.9 BC(=O)NCC(=O)OC Amb25264831 [0,0,0,0,1,0|2,0,0]=3 1017 B8R0.9 BOC(O)=CCC(O)=O Amb25179903 [0,0,0,0,1,0|1,0,2]=4 1018 B8R0.9 C=C(CCC(O)=O)C#N Amb24465180 [0,0,0,0,1,0|3,0,0]=4 1019 B8R0.9 C=C(CCC(O)=O)C=C Amb18642412 [0,0,0,0,1,0|2,0,1]=4 1020 B8R0.9 C=CC(=O)CCC(O)=O Amb22055999 [0,0,0,0,1,0|1,0,1]=3 1021 B8R0.9 CC(=O)C#CC(=O)OC Amb25031911 [0,0,0,0,1,0|1,0,2]=4 1022 B8R0.9 CC(=O)CCC(=C)CC Amb24433642 [0,0,0,0,1,0|3,0,0]=4 1023 B8R0.9 CC(=O)CCC(=O)C=C Amb10562681 [0,0,0,0,1,0|2,0,1]=4 1024 B8R0.9 CC(=O)CCC(=O)C=O Amb25224384 [0,0,0,0,1,0|3,0,0]=4 1025 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,0,0,0,1,0|3,0,0]=4 1026 B8R0.9 CC(=O)CNC(=O)CC Amb25292227 [0,0,0,0,1,0|3,0,0]=4 1027 B8R0.9 CC(=O)CNC(=O)NC Amb25228227 [0,0,0,0,1,0|3,0,0]=4 1028 B8R0.9 CC(=O)COC(=O)OC Amb25177471 [0,0,0,0,1,0|2,0,0]=3 1029 B8R0.9 CC(=O)CSC(=O)OC Amb25318847 [0,0,0,0,1,0|2,0,0]=3 1030 B8R0.9 CC(=O)NCC(=O)CC Amb23555728 [0,0,0,0,1,0|3,0,0]=4 1031 B8R0.9 CC(=O)NCC(=S)OC Amb25041236 [0,0,0,0,1,0|2,1,0]=4 1032 B8R0.9 CC(=O)NNC(=O)OC Amb24677256 [0,0,0,0,1,0|3,0,0]=4 1033 B8R0.9 CC(=O)\C=C/C(=O)OC Amb25031885 [0,0,0,0,1,0|1,0,2]=4 1034 B8R0.9 CC(=O)\C=C\C(=O)OC Amb22336182 [0,0,0,0,1,0|1,0,2]=4 1035 B8R0.9 CC(CCC(O)=O)=NN Amb24579336 [0,0,0,0,1,0|3,0,0]=4 1036 B8R0.9 CC(CCC(O)=O)=NO Amb25138471 [0,0,0,0,1,0|3,0,0]=4 1037 B8R0.9 CCC(=O)CCB(O)O Amb24736642 [0,0,0,0,1,0|2,0,1]=4 1038 B8R0.9 CCC(=O)CCC(=O)C Amb17593347 [0,0,0,0,1,0|2,0,0]=3 1039 B8R0.9 CCC(=O)CCC(=O)Cl Amb24420925 [0,0,0,0,1,0|2,0,0]=3 1040 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,0,0,0,1,0|1,0,0]=2 1041 B8R0.9 CCC(=O)CCC(N)=O Amb24669836 [0,0,0,0,1,0|2,0,0]=3 1042 B8R0.9 CCC(=O)CCP(O)=O Amb24748238 [0,0,0,0,1,0|2,0,0]=3 1043 B8R0.9 CCC(=O)CC[N+]([O-])=O Amb25236332 [0,0,0,0,1,0|2,0,1]=4 1044 B8R0.9 CCC(=O)NCC(=O)N Amb17231864 [0,0,0,0,1,0|3,0,0]=4 1045 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,0,0,0,1,0|2,0,0]=3 1046 B8R0.9 CCC(=O)OCC(O)=O Amb18642872 [0,0,0,0,1,0|2,0,0]=3 1047 B8R0.9 CCC(=O)\C=C\C(O)=O Amb18642585 [0,0,0,0,1,0|1,0,2]=4 1048 B8R0.9 CCC(=S)SCC(O)=O Amb24480232 [0,0,0,0,1,0|2,1,0]=4 1049 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,0,0,0,1,0|2,0,1]=4 1050 B8R0.9 CCC(Cl)=CCC(O)=O Amb24580821 [0,0,0,0,1,0|2,0,1]=4 1051 B8R0.9 CCC(N)CCC(O)=O Amb21961489 [0,0,0,0,1,0|2,0,1]=4 1052 B8R0.9 CCS(=O)CCC(C)=O Amb25765620 [0,0,0,0,1,0|3,0,0]=4 1053 B8R0.9 CC[C@@H](N)CCC(O)=O Amb25065764 [0,0,0,0,1,0|2,0,1]=4 1054 B8R0.9 CC[C@H](N)CCC(O)=O Amb25835678 [0,0,0,0,1,0|2,0,1]=4 1055 B8R0.9 CC[S+](C)CCC(O)=O Amb25794477 [0,0,0,0,1,0|3,0,0]=4 1056 B8R0.9 CNC(=N)NCC(O)=O Amb24655458 [0,0,0,0,1,0|3,0,0]=4 1057 B8R0.9 CNC(=N)SCC(O)=O Amb24403395 [0,0,0,0,1,0|3,0,0]=4 1058 B8R0.9 CNC(=O)CCC(=O)C Amb17334107 [0,0,0,0,1,0|2,0,0]=3 1059 B8R0.9 CNC(=O)CCC(=O)N Amb17334114 [0,0,0,0,1,0|2,0,0]=3 1060 B8R0.9 CNC(=O)CCC(O)C Amb17334125 [0,0,0,0,1,0|2,0,1]=4 1061 B8R0.9 CNC(=O)CCS(C)=O Amb24476726 [0,0,0,0,1,0|3,0,0]=4 1062 B8R0.9 CNC(=O)CNC(O)=O Amb24740399 [0,0,0,0,1,0|2,0,0]=3 1063 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,0,0,0,1,0|2,0,0]=3 1064 B8R0.9 CNC(=O)NCC(N)=O Amb24481795 [0,0,0,0,1,0|3,0,0]=4 1065 B8R0.9 CNC(=O)SCC(O)=O Amb24763198 [0,0,0,0,1,0|2,0,0]=3 1066 B8R0.9 CNC(=S)SCC(O)=O Amb24649902 [0,0,0,0,1,0|2,1,0]=4 1067 B8R0.9 CNC(C)CCC(O)=O Amb25339418 [0,0,0,0,1,0|2,0,1]=4 1068 B8R0.9 COC(=N)CNC(N)=O Amb24515695 [0,0,0,0,1,0|3,0,0]=4 1069 B8R0.9 COC(=O)C#CC(O)=O Amb22492669 [0,0,0,0,1,0|0,0,2]=3 1070 B8R0.9 COC(=O)CCB(O)O Amb25705142 [0,0,0,0,1,0|1,0,1]=3 1071 B8R0.9 COC(=O)CCC(=O)C Amb13777321 [0,0,0,0,1,0|1,0,0]=2 1072 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,0,0,0,1,0|2,0,1]=4 1073 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,0,0,0,1,0|2,0,1]=4 1074 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,0,0,0,1,0|2,0,1]=4 1075 B8R0.9 COC(=O)CCC(Cl)Cl Amb25295532 [0,0,0,0,1,0|2,0,1]=4 1076 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,0,0,0,1,0|1,0,0]=2 1077 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,0,0,0,1,0|1,1,0]=3 1078 B8R0.9 COC(=O)CCS([O-])=O Amb21520328 [0,0,0,0,1,0|1,0,1]=3 1079 B8R0.9 COC(=O)CC[C@@H](C)Cl Amb24480241 [0,0,0,0,1,0|2,0,1]=4 1080 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,0,0,0,1,0|2,0,1]=4 1081 B8R0.9 COC(=O)CC[C@@H](C)O Amb22388487 [0,0,0,0,1,0|1,0,1]=3 1082 B8R0.9 COC(=O)CC[C@H](C)O Amb24351118 [0,0,0,0,1,0|1,0,1]=3 1083 B8R0.9 COC(=O)CNC(=O)N Amb1126846 [0,0,0,0,1,0|2,0,0]=3 1084 B8R0.9 COC(=O)CNS(C)=O Amb24536728 [0,0,0,0,1,0|3,0,0]=4 1085 B8R0.9 COC(=O)CSC(C)O Amb25032211 [0,0,0,0,1,0|2,0,1]=4 1086 B8R0.9 COC(=O)CSC(N)=N Amb20676059 [0,0,0,0,1,0|3,0,0]=4 1087 B8R0.9 COC(=O)CSC(N)=O Amb24672643 [0,0,0,0,1,0|2,0,0]=3 1088 B8R0.9 COC(=O)NCC(N)=N Amb24436947 [0,0,0,0,1,0|3,0,0]=4 1089 B8R0.9 COC(=O)NC[C@H](C)O Amb25111936 [0,0,0,0,1,0|2,0,1]=4 1090 B8R0.9 COC(=O)\C=C\C(=O)Cl Amb25060248 [0,0,0,0,1,0|1,0,2]=4 1091 B8R0.9 COC(=O)\C=C\C(=O)O Amb10071357 [0,0,0,0,1,0|0,0,2]=3 1092 B8R0.9 COC(=O)\C=C\C(N)=O Amb24458702 [0,0,0,0,1,0|1,0,2]=4 1093 B8R0.9 COC(=O)\C=C\C([O-])=O Amb24121535 [0,0,0,0,1,0|0,0,3]=4 1094 B8R0.9 COC(=S)NCC(O)=O Amb25146013 [0,0,0,0,1,0|1,1,0]=3 1095 B8R0.9 COC(C)CCC(O)=O Amb24271104 [0,0,0,0,1,0|1,0,1]=3 1096 B8R0.9 COC(C)OCC(O)=O Amb24417299 [0,0,0,0,1,0|2,0,1]=4 1097 B8R0.9 COP(O)CCC(O)=O Amb22734636 [0,0,0,0,1,0|1,0,1]=3 1098 B8R0.9 CO[C@H](C)CCC(O)=O Amb24383667 [0,0,0,0,1,0|1,0,1]=3 1099 B8R0.9 CSC(=S)OCC(O)=O Amb25065342 [0,0,0,0,1,0|1,2,0]=4 1100 B8R0.9 CSC(=S)SCC(O)=O Amb24479938 [0,0,0,0,1,0|1,2,0]=4 1101 B8R0.9 CSC(C)CCC(O)=O Amb22059071 [0,0,0,0,1,0|1,1,1]=4 1102 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,0,0,0,1,0|2,0,1]=4 1103 B8R0.9 C\C(\CC)=C/CC(O)=O Amb22011800 [0,0,0,0,1,0|2,0,1]=4 1104 B8R0.9 C\C(\CCC(C)=O)=C/C Amb25768510 [0,0,0,0,1,0|3,0,0]=4 1105 B8R0.9 C\C(\CCC(C)=O)=C\C Amb24610198 [0,0,0,0,1,0|3,0,0]=4 1106 B8R0.9 C\C(\CCC(O)=O)=C\C Amb24681032 [0,0,0,0,1,0|2,0,0]=3 1107 B8R0.9 C\C(\CCC(O)=O)=N\N Amb24382718 [0,0,0,0,1,0|3,0,0]=4 1108 B8R0.9 C\C=C(/Br)\CCC(O)=O Amb25685237 [0,0,0,0,1,0|2,0,0]=3 1109 B8R0.9 C\C=C(\Br)/CCC(O)=O Amb25210030 [0,0,0,0,1,0|2,0,0]=3 1110 B8R0.9 C\C=C(\F)/CCC(O)=O Amb24670842 [0,0,0,0,1,0|2,0,0]=3 1111 B8R0.9 NC(=O)CCC(=O)N=O Amb24445359 [0,0,0,0,1,0|3,0,0]=4 1112 B8R0.9 NC(=O)CCC(=O)NBr Amb24390936 [0,0,0,0,1,0|3,0,0]=4 1113 B8R0.9 NC(=O)CCC(=O)NCl Amb24425513 [0,0,0,0,1,0|3,0,0]=4 1114 B8R0.9 NC(=O)CCC(=O)NO Amb24340146 [0,0,0,0,1,0|3,0,0]=4 1115 B8R0.9 NCC(=O)CC[13C](O)=O Amb22367280 [0,0,0,0,1,0|2,0,0]=3 1116 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,0,0,0,1,0|3,0,0]=4 1117 B8R0.9 NCC(=O)OCC(O)=O Amb25710415 [0,0,0,0,1,0|3,0,0]=4 1118 B8R0.9 NCC(=O)[13CH2]CC(=O)O Amb17608125 [0,0,0,0,1,0|2,0,0]=3 1119 B8R0.9 NNC(=O)CCC(O)=O Amb22270256 [0,0,0,0,1,0|2,0,0]=3 1120 B8R0.9 NNC(=O)CNC(O)=O Amb25093417 [0,0,0,0,1,0|3,0,0]=4 1121 B8R0.9 N[13CH2]C(=O)CCC(O)=O Amb22367582 [0,0,0,0,1,0|2,0,0]=3 1122 B8R0.9 OC(=O)CCC(=O)C=O Amb18642737 [0,0,0,0,1,0|2,0,0]=3 1123 B8R0.9 OC(=O)CCC(=O)CBr Amb18652012 [0,0,0,0,1,0|2,0,0]=3 1124 B8R0.9 OC(=O)CCC(=O)CCl Amb25736440 [0,0,0,0,1,0|2,0,0]=3 1125 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [0,0,0,0,1,0|2,0,0]=3 1126 B8R0.9 OC(=O)CNC(=O)C=O Amb25328169 [0,0,0,0,1,0|3,0,0]=4 1127 B8R0.9 OC(=O)CNC(=O)CBr Amb18130258 [0,0,0,0,1,0|3,0,0]=4 1128 B8R0.9 OC(=O)CNC(=O)CCl Amb1144436 [0,0,0,0,1,0|3,0,0]=4 1129 B8R0.9 OC(=O)CNC(=O)CO Amb18124375 [0,0,0,0,1,0|3,0,0]=4 1130 B8R0.9 OC(=O)CNC(=O)NO Amb25228420 [0,0,0,0,1,0|3,0,0]=4 1131 B8R0.9 OC(=O)COC(=O)CCl Amb18644547 [0,0,0,0,1,0|3,0,0]=4 1132 B8R0.9 OC(=O)\C=C\C(=O)O[Na] Amb22337964 [0,0,0,0,1,0|1,0,2]=4 1133 B8R0.9 OC(=O)\C=C\C(=O)O[Na] Amb22338796 [0,0,0,0,1,0|1,0,2]=4 1134 B8R0.9 OC(CCC(O)=O)=NO Amb24745795 [0,0,0,0,1,0|2,0,1]=4 1135 B10R0.55 C#CC(=O)NCCCC(N)=O Amb25382616 [0,0,0,0,0,1|2,0,1]=4 1136 B10R0.55 CC(=O)CCCCC(=O)OC Amb21858863 [0,0,0,0,0,1|1,0,0]=2 1137 B10R0.55 CC(=O)NCCCC(=O)NN Amb24750804 [0,0,0,0,0,1|3,0,0]=4 1138 B10R0.55 CC(=O)NCCNC(=O)CC Amb25378967 [0,0,0,0,0,1|3,0,0]=4 1139 B10R0.55 CC(=O)NC\C=C\C(=O)OC Amb25384760 [0,0,0,0,0,1|1,0,2]=4 1140 B10R0.55 CC(=O)N\C=C\CC(=O)OC Amb25207177 [0,0,0,0,0,1|1,0,2]=4 1141 B10R0.55 CCC(=O)NCCCC(=O)O Amb1121482 [0,0,0,0,0,1|1,0,0]=2 1142 B10R0.55 CCC(C)CCCCC(O)=O Amb24271145 [0,0,0,0,0,1|2,0,1]=4 1143 B10R0.55 CNC(=N)NCCCC(N)=O Amb18797347 [0,0,0,0,0,1|3,0,0]=4 1144 B10R0.55 CNC(=O)CN\C=C\C(O)=O Amb25715609 [0,0,0,0,0,1|1,0,2]=4 1145 B10R0.55 CNC(=O)CS\C=C\C(O)=O Amb25382402 [0,0,0,0,0,1|1,0,2]=4 1146 B10R0.55 CNC(=O)NCCCC(O)=O Amb18305512 [0,0,0,0,0,1|1,0,0]=2 1147 B10R0.55 CNC(=O)NCCNC(N)=O Amb24582050 [0,0,0,0,0,1|3,0,0]=4 1148 B10R0.55 CNC(=O)NC\C=C\C(O)=O Amb25209406 [0,0,0,0,0,1|1,0,2]=4 1149 B10R0.55 COC(=O)C#CCCC(=O)Cl Amb25810819 [0,0,0,0,0,1|1,0,1]=3 1150 B10R0.55 COC(=O)C#CCCC(C)O Amb24354410 [0,0,0,0,0,1|1,0,2]=4 1151 B10R0.55 COC(=O)C#CCCC(O)=O Amb24487874 [0,0,0,0,0,1|0,0,1]=2 1152 B10R0.55 COC(=O)C#CCOC(N)=O Amb24424082 [0,0,0,0,0,1|1,0,2]=4 1153 B10R0.55 COC(=O)C/C=C/OC(C)=O Amb17778579 [0,0,0,0,0,1|1,0,2]=4 1154 B10R0.55 COC(=O)CCCCC(C)C Amb22887139 [0,0,0,0,0,1|2,0,1]=4 1155 B10R0.55 COC(=O)CCCCC(C)N Amb19515545 [0,0,0,0,0,1|2,0,1]=4 1156 B10R0.55 COC(=O)CCCCC([O-])=O Amb22230948 [0,0,0,0,0,1|0,0,1]=2 1157 B10R0.55 COC(=O)CCCNC(N)=N Amb22360026 [0,0,0,0,0,1|2,0,0]=3 1158 B10R0.55 COC(=O)CN\C=C\C(O)=O Amb25381551 [0,0,0,0,0,1|0,0,2]=3 1159 B10R0.55 COC(=O)NCC#CC(O)=O Amb24487929 [0,0,0,0,0,1|0,0,2]=3 1160 B10R0.55 COC(=O)\C=C\C=CC(O)=O Amb25384110 [0,0,0,0,0,1|0,0,3]=4 1161 B10R0.55 COC(=O)\C=C\C=C\C(=O)O Amb17593891 [0,0,0,0,0,1|0,0,3]=4 1162 B10R0.55 COC(=O)\C=C\NCC(N)=O Amb25381544 [0,0,0,0,0,1|1,0,2]=4 1163 B10R0.55 NC(=O)CCCNC(=O)NN Amb18179961 [0,0,0,0,0,1|3,0,0]=4 1164 B10R0.55 NCC(=O)NCCCC(O)=O Amb18182502 [0,0,0,0,0,1|2,0,0]=3 1165 B7R0.1 CCNCCCC=O Amb24481334 [2,0,0,0,0,0|2,0,0]=4 1166 B7R0.1 COCCCCCO Amb19374978 [2,0,0,0,0,0|0,0,2]=4 1167 B7R0.1 COCCSCC=O Amb24464910 [2,0,0,0,0,0|1,0,1]=4 1168 B7R0.1 COCOCCC=O Amb25804170 [2,0,0,0,0,0|1,0,1]=4 1169 B7R0.1 CON=CCCC=O Amb25277284 [2,0,0,0,0,0|1,0,1]=4 1170 B7R0.1 CONCCCC=C Amb24332287 [2,0,0,0,0,0|2,0,0]=4 1171 B7R0.1 CONCCCCO Amb24481428 [2,0,0,0,0,0|1,0,1]=4 1172 B7R0.1 CO\C=C\CCC=O Amb18641790 [2,0,0,0,0,0|0,0,1]=3 1173 B7R0.1 CO\N=C\CCC=O Amb25785571 [2,0,0,0,0,0|1,0,1]=4 1174 B7R0.1 CSCCCCC=O Amb25760866 [2,0,0,0,0,0|0,1,1]=4 1175 B7R0.1 C\C=C/CCCC=O Amb24483048 [2,0,0,0,0,0|1,0,0]=3 1176 B7R0.1 C\C=C/CSCC=O Amb24666778 [2,0,0,0,0,0|2,0,0]=4 1177 B7R0.1 C\C=C\CCCC=C Amb24700388 [2,0,0,0,0,0|2,0,0]=4 1178 B7R0.1 C\C=C\CCCC=O Amb18641700 [2,0,0,0,0,0|1,0,0]=3 1179 B7R0.1 C\C=C\CCCCO Amb24634714 [2,0,0,0,0,0|1,0,1]=4 1180 B7R0.1 C\C=C\CCCNO Amb25252150 [2,0,0,0,0,0|2,0,0]=4 1181 B7R0.1 C\C=C\COCC=O Amb24579425 [2,0,0,0,0,0|2,0,0]=4 1182 B7R0.1 O=CCCCC#CC Amb17593142 [2,0,0,0,0,0|1,0,1]=4 1183 B7R0.1 ON=CCCCC=O Amb25303136 [2,0,0,0,0,0|2,0,0]=4 1184 B7R0.1 O\N=C\CCCC=O Amb24663073 [2,0,0,0,0,0|2,0,0]=4 1185 B7R0.3 C=CC(=O)CCCO Amb25284731 [2,0,0,0,0,0|1,0,1]=4 1186 B7R0.3 CCC(=O)CCC=O Amb18641783 [2,0,0,0,0,0|1,0,0]=3 1187 B7R0.3 CCC(=O)CCCBr Amb25765636 [2,0,0,0,0,0|2,0,0]=4 1188 B7R0.3 CCC(=O)CCCF Amb25101437 [2,0,0,0,0,0|2,0,0]=4 1189 B7R0.3 CCC(=O)CCCN Amb18833012 [2,0,0,0,0,0|2,0,0]=4 1190 B7R0.3 CCC(=O)CCCO Amb24629709 [2,0,0,0,0,0|1,0,0]=3 1191 B7R0.3 CCC(=O)CNC=O Amb23442770 [2,0,0,0,0,0|2,0,0]=4 1192 B7R0.3 CCC(=O)NCC=O Amb17102054 [2,0,0,0,0,0|2,0,0]=4 1193 B7R0.3 CCC(=O)OCC=O Amb25779377 [2,0,0,0,0,0|2,0,0]=4 1194 B7R0.3 CCCCC(=N)OC Amb17617956 [2,0,0,0,0,0|1,0,1]=4 1195 B7R0.3 CCCCC(=N)OC Amb25353357 [2,0,0,0,0,0|1,0,1]=4 1196 B7R0.3 CCCCC(=O)SC Amb25225724 [2,0,0,0,0,0|0,1,1]=4 1197 B7R0.3 CCCC[14C](=O)O[Na] Amb22734535 [2,0,0,0,0,0|1,0,1]=4 1198 B7R0.3 CCCNC(=O)OC Amb17797997 [2,0,0,0,0,0|1,0,1]=4 1199 B7R0.3 CCNCC(=O)OC Amb19514718 [2,0,0,0,0,0|1,0,1]=4 1200 B7R0.3 CCS(=O)CCCO Amb25226262 [2,0,0,0,0,0|2,0,0]=4 1201 B7R0.3 CNC(=O)CCC=C Amb25041195 [2,0,0,0,0,0|1,0,1]=4 1202 B7R0.3 CNC(=O)CCCBr Amb24552452 [2,0,0,0,0,0|2,0,0]=4 1203 B7R0.3 CNC(=O)CCCCl Amb1137464 [2,0,0,0,0,0|2,0,0]=4 1204 B7R0.3 CNC(=O)CCCO Amb17231829 [2,0,0,0,0,0|1,0,0]=3 1205 B7R0.3 CNC(=O)CCN=C Amb24713898 [2,0,0,0,0,0|2,0,0]=4 1206 B7R0.3 CNC(=O)CNC=O Amb25789179 [2,0,0,0,0,0|2,0,0]=4 1207 B7R0.3 CNC(=O)NCCO Amb24376074 [2,0,0,0,0,0|2,0,0]=4 1208 B7R0.3 CNCCC(=O)OC Amb22168213 [2,0,0,0,0,0|1,0,1]=4 1209 B7R0.3 COC(=C)CCC=O Amb18641791 [2,0,0,0,0,0|1,0,0]=3 1210 B7R0.3 COC(=C)CCCCl Amb25703575 [2,0,0,0,0,0|2,0,0]=4 1211 B7R0.3 COC(=N)CCCCl Amb16231406 [2,0,0,0,0,0|2,0,0]=4 1212 B7R0.3 COC(=O)C#CCO Amb16233601 [2,0,0,0,0,0|0,0,2]=4 1213 B7R0.3 COC(=O)CCC#C Amb18115985 [2,0,0,0,0,0|0,0,2]=4 1214 B7R0.3 COC(=O)CCC=C Amb2369959 [2,0,0,0,0,0|0,0,1]=3 1215 B7R0.3 COC(=O)CCC=O Amb18124259 [2,0,0,0,0,0|0,0,0]=2 1216 B7R0.3 COC(=O)CCCS Amb19373761 [2,0,0,0,0,0|0,1,0]=3 1217 B7R0.3 COC(=O)CCNN Amb24524272 [2,0,0,0,0,0|2,0,0]=4 1218 B7R0.3 COC(=O)CCNO Amb24644523 [2,0,0,0,0,0|1,0,0]=3 1219 B7R0.3 COC(=O)CCON Amb18641968 [2,0,0,0,0,0|2,0,0]=4 1220 B7R0.3 COC(=O)CC[Zn]Br Amb22898090 [2,0,0,0,0,0|2,0,0]=4 1221 B7R0.3 COC(=O)CNC=O Amb22000868 [2,0,0,0,0,0|1,0,0]=3 1222 B7R0.3 COC(=O)CNCO Amb25369412 [2,0,0,0,0,0|1,0,0]=3 1223 B7R0.3 COC(=O)COCBr Amb25288082 [2,0,0,0,0,0|2,0,0]=4 1224 B7R0.3 COC(=O)CSCCl Amb25689724 [2,0,0,0,0,0|2,0,0]=4 1225 B7R0.3 COC(=O)C\C=C\I Amb24531368 [2,0,0,0,0,0|1,0,1]=4 1226 B7R0.3 COC(=O)NCC=C Amb17794125 [2,0,0,0,0,0|1,0,1]=4 1227 B7R0.3 COC(=O)NCCBr Amb10608897 [2,0,0,0,0,0|2,0,0]=4 1228 B7R0.3 COC(=O)NCCCl Amb24526396 [2,0,0,0,0,0|2,0,0]=4 1229 B7R0.3 COC(=O)NCCN Amb18970459 [2,0,0,0,0,0|2,0,0]=4 1230 B7R0.3 COC(=O)OCCCl Amb25261257 [2,0,0,0,0,0|2,0,0]=4 1231 B7R0.3 COC(=O)\C=C/C=O Amb24483047 [2,0,0,0,0,0|0,0,2]=4 1232 B7R0.3 COC(=O)\C=C\C=O Amb18641759 [2,0,0,0,0,0|0,0,2]=4 1233 B7R0.3 COC(=O)\C=C\CO Amb25081886 [2,0,0,0,0,0|0,0,2]=4 1234 B7R0.3 COC(=S)SCCO Amb24416434 [2,0,0,0,0,0|1,1,0]=4 1235 B7R0.3 COC(O)CCCO Amb24619181 [2,0,0,0,0,0|0,0,2]=4 1236 B7R0.3 COP(=O)OCCO Amb24534031 [2,0,0,0,0,0|2,0,0]=4 1237 B7R0.3 CO[C@@H](C)CCCO Amb25306514 [2,0,0,0,0,0|1,0,1]=4 1238 B7R0.3 CO\C(\C)=C\CC=O Amb25365197 [2,0,0,0,0,0|1,0,1]=4 1239 B7R0.3 CSC(=O)NCCO Amb24460774 [2,0,0,0,0,0|1,1,0]=4 1240 B7R0.3 C\C=C(/C)\CCC=O Amb18641710 [2,0,0,0,0,0|2,0,0]=4 1241 B7R0.3 C\C=C(\C)/CCC=O Amb24425599 [2,0,0,0,0,0|2,0,0]=4 1242 B7R0.3 C\C=C(\C)/CCCO Amb25080181 [2,0,0,0,0,0|2,0,0]=4 1243 B7R0.3 C\C=C(\Cl)/CCCO Amb25344045 [2,0,0,0,0,0|2,0,0]=4 1244 B7R0.3 ClCCCC(=O)CC Amb17593423 [2,0,0,0,0,0|2,0,0]=4 1245 B7R0.3 NCC(=O)CCCO Amb24471240 [2,0,0,0,0,0|2,0,0]=4 1246 B7R0.3 O=CCCC(=O)C=O Amb25024665 [2,0,0,0,0,0|2,0,0]=4 1247 B7R0.4 BrCCCCC(=O)C Amb16234126 [2,0,0,0,0,0|1,0,1]=4 1248 B7R0.4 C=C(Br)CCCC=O Amb24390485 [2,0,0,0,0,0|1,0,1]=4 1249 B7R0.4 C=CCCCC(=O)C Amb17593171 [2,0,0,0,0,0|1,0,0]=3 1250 B7R0.4 C=CCCCC(N)=O Amb24579642 [2,0,0,0,0,0|1,0,1]=4 1251 B7R0.4 C=CCSCC(=O)O Amb1110888 [2,0,0,0,0,0|1,0,1]=4 1252 B7R0.4 CC(=C)CCCC=C Amb25787099 [2,0,0,0,0,0|2,0,0]=4 1253 B7R0.4 CC(=C)CCCC=O Amb18641705 [2,0,0,0,0,0|1,0,0]=3 1254 B7R0.4 CC(=O)CCCC#C Amb18115312 [2,0,0,0,0,0|1,0,1]=4 1255 B7R0.4 CC(=O)CCCC=O Amb18641775 [2,0,0,0,0,0|0,0,0]=2 1256 B7R0.4 CC(=O)CCN=C=O Amb24481500 [2,0,0,0,0,0|1,0,1]=4 1257 B7R0.4 CC(=O)CCNC=O Amb25075578 [2,0,0,0,0,0|1,0,0]=3 1258 B7R0.4 CC(=O)CCOC=O Amb24408302 [2,0,0,0,0,0|1,0,0]=3 1259 B7R0.4 CC(=O)CC\C=C/Br Amb25758398 [2,0,0,0,0,0|1,0,1]=4 1260 B7R0.4 CC(=O)CC\C=C\Br Amb25336747 [2,0,0,0,0,0|1,0,1]=4 1261 B7R0.4 CC(=O)CNCCO Amb18108527 [2,0,0,0,0,0|1,0,1]=4 1262 B7R0.4 CC(=O)COCC=O Amb18641868 [2,0,0,0,0,0|1,0,0]=3 1263 B7R0.4 CC(=O)CSCC=C Amb25767863 [2,0,0,0,0,0|2,0,0]=4 1264 B7R0.4 CC(=O)NCNC=O Amb24568316 [2,0,0,0,0,0|2,0,0]=4 1265 B7R0.4 CC(=O)OCCC=O Amb18641862 [2,0,0,0,0,0|1,0,0]=3 1266 B7R0.4 CC(=O)OCCCO Amb25854267 [2,0,0,0,0,0|1,0,1]=4 1267 B7R0.4 CC(=O)SCCC=C Amb24117956 [2,0,0,0,0,0|2,0,0]=4 1268 B7R0.4 CC(=O)SCCC=O Amb25101351 [2,0,0,0,0,0|1,0,0]=3 1269 B7R0.4 CC(=O)SCNC=O Amb25378456 [2,0,0,0,0,0|2,0,0]=4 1270 B7R0.4 CC(=O)SC\C=C\O Amb24371969 [2,0,0,0,0,0|1,0,1]=4 1271 B7R0.4 CC(C)CCCC=O Amb17940235 [2,0,0,0,0,0|1,0,1]=4 1272 B7R0.4 CC(O)CCCC=O Amb18641887 [2,0,0,0,0,0|0,0,2]=4 1273 B7R0.4 CC=C=CCC(O)=O Amb25118481 [2,0,0,0,0,0|0,0,2]=4 1274 B7R0.4 CCCCCC([O-])=O Amb22337624 [2,0,0,0,0,0|0,0,2]=4 1275 B7R0.4 CCCCCC([O-])=O Amb22525161 [2,0,0,0,0,0|0,0,2]=4 1276 B7R0.4 CCCCCC([O-])=O Amb22730527 [2,0,0,0,0,0|0,0,2]=4 1277 B7R0.4 CCCCCC([O-])=O Amb22731343 [2,0,0,0,0,0|0,0,2]=4 1278 B7R0.4 CCCCC[13C](O)=O Amb22353417 [2,0,0,0,0,0|0,0,1]=3 1279 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [2,0,0,0,0,0|0,0,1]=3 1280 B7R0.4 CCCNCC(=O)O Amb10609640 [2,0,0,0,0,0|1,0,1]=4 1281 B7R0.4 CCCNCC(=O)O Amb1110628 [2,0,0,0,0,0|1,0,1]=4 1282 B7R0.4 CCCSCC(=O)O Amb1137113 [2,0,0,0,0,0|1,0,1]=4 1283 B7R0.4 CN(C)CCCC=O Amb22753951 [2,0,0,0,0,0|2,0,0]=4 1284 B7R0.4 CN(C)CCCC=O Amb24117840 [2,0,0,0,0,0|2,0,0]=4 1285 B7R0.4 CNCCCC(=O)O Amb1153115 [2,0,0,0,0,0|1,0,0]=3 1286 B7R0.4 CNCCCC(N)=O Amb18303611 [2,0,0,0,0,0|2,0,0]=4 1287 B7R0.4 CNCCCS(O)=O Amb24656214 [2,0,0,0,0,0|2,0,0]=4 1288 B7R0.4 COCCCC(=O)Cl Amb24481572 [2,0,0,0,0,0|1,0,0]=3 1289 B7R0.4 COCCCC(N)=N Amb19269156 [2,0,0,0,0,0|2,0,0]=4 1290 B7R0.4 COCCCC(N)=O Amb24670109 [2,0,0,0,0,0|1,0,0]=3 1291 B7R0.4 COCCNC(=O)N Amb1104938 [2,0,0,0,0,0|2,0,0]=4 1292 B7R0.4 COCCOC(N)=O Amb25054225 [2,0,0,0,0,0|2,0,0]=4 1293 B7R0.4 COCSCC(C)=O Amb24717297 [2,0,0,0,0,0|2,0,0]=4 1294 B7R0.4 COC\C=C\C(O)=O Amb18296423 [2,0,0,0,0,0|0,0,2]=4 1295 B7R0.4 CONCCC(C)=O Amb25342369 [2,0,0,0,0,0|2,0,0]=4 1296 B7R0.4 CONCCC(N)=O Amb24481431 [2,0,0,0,0,0|2,0,0]=4 1297 B7R0.4 CONCCC(O)=O Amb24441275 [2,0,0,0,0,0|1,0,0]=3 1298 B7R0.4 CO\C=C\CC(O)=O Amb25174889 [2,0,0,0,0,0|0,0,1]=3 1299 B7R0.4 CS(=O)CCNC=O Amb24350245 [2,0,0,0,0,0|2,0,0]=4 1300 B7R0.4 CSCCCC(=O)O Amb17503622 [2,0,0,0,0,0|0,1,0]=3 1301 B7R0.4 CSCCCC(C)=O Amb25122381 [2,0,0,0,0,0|1,1,0]=4 1302 B7R0.4 CSCCCC(N)=O Amb19129736 [2,0,0,0,0,0|1,1,0]=4 1303 B7R0.4 C[C@@H](O)CCCC=O Amb22896885 [2,0,0,0,0,0|0,0,2]=4 1304 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [2,0,0,0,0,0|0,1,0]=3 1305 B7R0.4 C\C(\F)=C\CCC=O Amb25290222 [2,0,0,0,0,0|1,0,1]=4 1306 B7R0.4 C\C=C/CCC(C)=O Amb24333832 [2,0,0,0,0,0|1,0,1]=4 1307 B7R0.4 C\C=C\CCC(=O)Cl Amb25246754 [2,0,0,0,0,0|1,0,1]=4 1308 B7R0.4 C\C=C\CCC(=O)O Amb10071500 [2,0,0,0,0,0|0,0,1]=3 1309 B7R0.4 C\C=C\CCC(N)=O Amb25343167 [2,0,0,0,0,0|1,0,1]=4 1310 B7R0.4 N#CCCCC(=O)C Amb17106756 [2,0,0,0,0,0|1,0,1]=4 1311 B7R0.4 N#CCCCC(O)=O Amb18560874 [2,0,0,0,0,0|1,0,1]=4 1312 B7R0.4 NC(=O)CCNC=O Amb24630476 [2,0,0,0,0,0|2,0,0]=4 1313 B7R0.4 NC(=O)CSCC=O Amb25806671 [2,0,0,0,0,0|2,0,0]=4 1314 B7R0.4 NNCCCC(O)=O Amb24455803 [2,0,0,0,0,0|2,0,0]=4 1315 B7R0.4 NOCCCC(=O)O Amb10975956 [2,0,0,0,0,0|1,0,0]=3 1316 B7R0.4 NOCCCC(O)=O Amb22011795 [2,0,0,0,0,0|1,0,0]=3 1317 B7R0.4 O=CCCC=C(C)C Amb17593168 [2,0,0,0,0,0|1,0,1]=4 1318 B7R0.4 O=CCCCC(=O)O Amb17593198 [2,0,0,0,0,0|0,0,0]=2 1319 B7R0.4 O=CCCNC(=O)C Amb17102165 [2,0,0,0,0,0|1,0,0]=3 1320 B7R0.4 OC(=O)CCC=C=C Amb10605299 [2,0,0,0,0,0|1,0,1]=4 1321 B7R0.4 OC(=O)CCNC=O Amb18290434 [2,0,0,0,0,0|1,0,0]=3 1322 B7R0.4 OC(=O)CC\C=C\Br Amb25238247 [2,0,0,0,0,0|1,0,1]=4 1323 B7R0.4 OC(=O)CC\C=C\Cl Amb25803087 [2,0,0,0,0,0|1,0,1]=4 1324 B7R0.4 OC(=O)CSCC=O Amb24628311 [2,0,0,0,0,0|1,0,0]=3 1325 B7R0.4 OC(=O)C\C=C\C=O Amb24437944 [2,0,0,0,0,0|0,0,2]=4 1326 B7R0.4 OCCCCC(=O)C Amb10603864 [2,0,0,0,0,0|0,0,1]=3 1327 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [2,0,0,0,0,0|0,0,2]=4 1328 B7R0.4 OCCCCC(O)=O Amb22351244 [2,0,0,0,0,0|0,0,1]=3 1329 B7R0.4 OCCSCC(=O)O Amb1110090 [2,0,0,0,0,0|1,0,1]=4 1330 B7R0.4 SCCCCC(=O)O Amb17503767 [2,0,0,0,0,0|0,1,1]=4 1331 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [2,0,0,0,0,0|0,0,2]=4 1332 B9R0.5 C=C(CCO)CCCC=O Amb25134080 [1,1,0,0,0,0|2,0,0]=4 1333 B9R0.5 CCCC(=O)CCCC=C Amb24370275 [1,1,0,0,0,0|2,0,0]=4 1334 B9R0.5 CCCC(=O)NCCC=O Amb17102167 [1,1,0,0,0,0|2,0,0]=4 1335 B9R0.5 CCCCCC(=O)OCCl Amb24568887 [1,1,0,0,0,0|1,0,1]=4 1336 B9R0.5 CCNC(=O)CCCC=C Amb24352710 [1,1,0,0,0,0|2,0,0]=4 1337 B9R0.5 CCOC(=O)CCCC#C Amb18115788 [1,1,0,0,0,0|1,0,1]=4 1338 B9R0.5 CCOC(=O)CCCC#N Amb16233123 [1,1,0,0,0,0|1,0,1]=4 1339 B9R0.5 CCOC(=O)CCCC=O Amb22230665 [1,1,0,0,0,0|0,0,0]=2 1340 B9R0.5 CCOC(=O)CCCCCl Amb24445064 [1,1,0,0,0,0|1,0,1]=4 1341 B9R0.5 CCOC(=O)CCCCN Amb19957938 [1,1,0,0,0,0|1,0,1]=4 1342 B9R0.5 CCOC(=O)CCCCS Amb25246862 [1,1,0,0,0,0|0,1,1]=4 1343 B9R0.5 CCOC(=O)CCCSC Amb25058939 [1,1,0,0,0,0|2,0,0]=4 1344 B9R0.5 CCOC(=O)CCC[Zn]Br Amb22000359 [1,1,0,0,0,0|2,0,0]=4 1345 B9R0.5 CCOC(=O)CCOC=C Amb25136518 [1,1,0,0,0,0|2,0,0]=4 1346 B9R0.5 CCOC(=O)COCCO Amb24113532 [1,1,0,0,0,0|1,0,1]=4 1347 B9R0.5 CCOC(=O)CSCC=O Amb18183493 [1,1,0,0,0,0|1,0,0]=3 1348 B9R0.5 CCOC(=O)NCCC=O Amb24668711 [1,1,0,0,0,0|1,0,0]=3 1349 B9R0.5 CCOC(=O)OCNC=O Amb22370493 [1,1,0,0,0,0|2,0,0]=4 1350 B9R0.5 CCSC(=O)CCCCO Amb25806700 [1,1,0,0,0,0|0,1,1]=4 1351 B9R0.5 CCSC(=O)CCNC=O Amb25350097 [1,1,0,0,0,0|1,1,0]=4 1352 B9R0.5 CC\C=C(/C)\CCCC=O Amb18643645 [1,1,0,0,0,0|2,0,0]=4 1353 B9R0.5 CNCC(=O)CCCC=C Amb24670935 [1,1,0,0,0,0|2,0,0]=4 1354 B9R0.5 CNCCCC(=O)NOC Amb25684988 [1,1,0,0,0,0|2,0,0]=4 1355 B9R0.5 COCC(=O)CCCCF Amb24475353 [1,1,0,0,0,0|1,0,1]=4 1356 B9R0.5 COCC(=O)CCCCO Amb25709925 [1,1,0,0,0,0|0,0,1]=3 1357 B9R0.5 COCC(=O)CCCSC Amb25060575 [1,1,0,0,0,0|2,0,0]=4 1358 B9R0.5 COCC(=O)CC\C=C\Cl Amb24746164 [1,1,0,0,0,0|1,0,1]=4 1359 B9R0.5 COCC(=O)NCCC=C Amb24648273 [1,1,0,0,0,0|2,0,0]=4 1360 B9R0.5 COCC(=O)NCCCO Amb25786595 [1,1,0,0,0,0|1,0,1]=4 1361 B9R0.5 COCC(=O)OCCC=C Amb24465811 [1,1,0,0,0,0|2,0,0]=4 1362 B9R0.5 CONC(=O)CCCC#C Amb24482717 [1,1,0,0,0,0|1,0,1]=4 1363 B9R0.5 CONC(=O)CCCC#N Amb25305914 [1,1,0,0,0,0|1,0,1]=4 1364 B9R0.5 CONC(=O)CCCC=C Amb25169382 [1,1,0,0,0,0|1,0,0]=3 1365 B9R0.5 CONC(=O)CCCCCl Amb25045987 [1,1,0,0,0,0|1,0,1]=4 1366 B9R0.5 CONC(=O)CCCCO Amb25851846 [1,1,0,0,0,0|0,0,1]=3 1367 B9R0.5 CONC(=O)CNCC=C Amb25825803 [1,1,0,0,0,0|2,0,0]=4 1368 B9R0.5 CONC(=O)COCC=C Amb25106349 [1,1,0,0,0,0|2,0,0]=4 1369 B9R0.5 CONC(=O)COCCO Amb24482795 [1,1,0,0,0,0|1,0,1]=4 1370 B9R0.5 CO\N=C(/C)\CCCC=O Amb24456850 [1,1,0,0,0,0|1,0,0]=3 1371 B9R0.5 C\C(\CCCC=O)=C\CO Amb25834372 [1,1,0,0,0,0|2,0,0]=4 1372 B9R0.5 C\C=C/C(=O)CCCC=C Amb24422413 [1,1,0,0,0,0|2,0,0]=4 1373 B9R0.5 C\C=C\C(=O)CCCC=O Amb25743030 [1,1,0,0,0,0|1,0,0]=3 1374 B9R0.5 C\C=C\C(=O)CCCNO Amb25066429 [1,1,0,0,0,0|2,0,0]=4 1375 B9R0.5 C\C=C\C(=O)CCOC=O Amb24617279 [1,1,0,0,0,0|2,0,0]=4 1376 B9R0.5 C\C=C\C(=O)NCCC=O Amb25203871 [1,1,0,0,0,0|2,0,0]=4 1377 B9R0.5 C\C=C\CCC(=O)OCC Amb25242775 [1,1,0,0,0,0|1,0,1]=4 1378 B9R0.5 NCCCCC(=O)OCC Amb10807401 [1,1,0,0,0,0|1,0,1]=4 1379 B9R0.5 O=C(CCCCCl)OCCl Amb24692453 [1,1,0,0,0,0|1,0,1]=4 1380 B9R0.5 OCCCCC(=O)CCCl Amb25292236 [1,1,0,0,0,0|1,0,1]=4 1381 B9R0.5 OCCCCC(=O)NCC Amb17231999 [1,1,0,0,0,0|1,0,1]=4 1382 B9R0.5 OCCCCC(=O)OCC Amb17593658 [1,1,0,0,0,0|0,0,1]=3 1383 B9R0.5 [C-]#[N+]CCCC(=O)OCC Amb2235706 [1,1,0,0,0,0|2,0,0]=4 1384 B9R0.8 CCC(=O)C(C)CCC=C Amb24668637 [1,1,0,0,0,0|2,0,0]=4 1385 B9R0.8 CCC(=O)C(C)CCC=O Amb18643954 [1,1,0,0,0,0|1,0,0]=3 1386 B9R0.8 CCC(=O)C(N)CCC=C Amb25287718 [1,1,0,0,0,0|2,0,0]=4 1387 B9R0.8 CCCCC(Br)C(=O)OC Amb19514695 [1,1,0,0,0,0|1,0,1]=4 1388 B9R0.8 CCCCC(Cl)C(=O)OC Amb18800859 [1,1,0,0,0,0|1,0,1]=4 1389 B9R0.8 CCCCC(O)C(=O)OC Amb23596568 [1,1,0,0,0,0|1,0,1]=4 1390 B9R0.8 CCCCC(S)C(=O)OC Amb24745120 [1,1,0,0,0,0|1,0,1]=4 1391 B9R0.8 CCCC[C@@H](Br)C(=O)OC Amb25119304 [1,1,0,0,0,0|1,0,1]=4 1392 B9R0.8 CCCC[C@@H](N)C(=O)OC Amb22745342 [1,1,0,0,0,0|1,0,1]=4 1393 B9R0.8 CCCC[C@@H](O)C(=O)OC Amb24430118 [1,1,0,0,0,0|1,0,1]=4 1394 B9R0.8 CCCC[C@H](C(=O)OC)N Amb16183949 [1,1,0,0,0,0|1,0,1]=4 1395 B9R0.8 CCCC[C@H](N)C(=O)OC Amb22169631 [1,1,0,0,0,0|1,0,1]=4 1396 B9R0.8 CNC(=O)C(N)CCC=C Amb25708722 [1,1,0,0,0,0|2,0,0]=4 1397 B9R0.8 COC(=O)C(=O)CCC=C Amb25134158 [1,1,0,0,0,0|1,0,1]=4 1398 B9R0.8 COC(=O)C(=O)CCC=O Amb25699822 [1,1,0,0,0,0|0,0,1]=3 1399 B9R0.8 COC(=O)C(Br)COC=O Amb24502286 [1,1,0,0,0,0|1,0,0]=3 1400 B9R0.8 COC(=O)C(C)CCC#N Amb18643706 [1,1,0,0,0,0|1,0,1]=4 1401 B9R0.8 COC(=O)C(C)CCC=O Amb18644132 [1,1,0,0,0,0|0,0,0]=2 1402 B9R0.8 COC(=O)C(C)CCCBr Amb25249687 [1,1,0,0,0,0|1,0,1]=4 1403 B9R0.8 COC(=O)C(C)CCCO Amb24413656 [1,1,0,0,0,0|0,0,1]=3 1404 B9R0.8 COC(=O)C(C)C\C=C\O Amb24412661 [1,1,0,0,0,0|0,0,1]=3 1405 B9R0.8 COC(=O)C(C)NCC=C Amb24411113 [1,1,0,0,0,0|2,0,0]=4 1406 B9R0.8 COC(=O)C(C)SCCO Amb18183513 [1,1,0,0,0,0|1,0,1]=4 1407 B9R0.8 COC(=O)C(C)\C=C\C=O Amb18643813 [1,1,0,0,0,0|0,0,2]=4 1408 B9R0.8 COC(=O)C(CCCBr)Br Amb10071878 [1,1,0,0,0,0|1,0,1]=4 1409 B9R0.8 COC(=O)C(Cl)CCCCl Amb24711462 [1,1,0,0,0,0|1,0,1]=4 1410 B9R0.8 COC(=O)C(Cl)CCSC Amb18327893 [1,1,0,0,0,0|2,0,0]=4 1411 B9R0.8 COC(=O)C(F)CCCN Amb24558737 [1,1,0,0,0,0|1,0,1]=4 1412 B9R0.8 COC(=O)C(N)CC=C=O Amb25123214 [1,1,0,0,0,0|0,0,2]=4 1413 B9R0.8 COC(=O)C(N)CCCO Amb18644325 [1,1,0,0,0,0|0,0,1]=3 1414 B9R0.8 COC(=O)C(N)CSN=O Amb25780529 [1,1,0,0,0,0|2,0,0]=4 1415 B9R0.8 COC(=O)C(N)C\C=C\Cl Amb25119357 [1,1,0,0,0,0|1,0,1]=4 1416 B9R0.8 COC(=O)C(O)CCC=O Amb25078499 [1,1,0,0,0,0|0,0,0]=2 1417 B9R0.8 COC(=O)C(O)CCCBr Amb24759864 [1,1,0,0,0,0|1,0,1]=4 1418 B9R0.8 COC(=O)C(O)CCCCl Amb24480606 [1,1,0,0,0,0|1,0,1]=4 1419 B9R0.8 COC(=O)C(O)CCCO Amb24404795 [1,1,0,0,0,0|0,0,1]=3 1420 B9R0.8 COC(=O)C(O)CCSC Amb18800831 [1,1,0,0,0,0|2,0,0]=4 1421 B9R0.8 COC(=O)C(O)OCC=C Amb24748272 [1,1,0,0,0,0|2,0,0]=4 1422 B9R0.8 COC(=O)N(C)CCCO Amb25261910 [1,1,0,0,0,0|1,0,1]=4 1423 B9R0.8 COC(=O)[C@@H](C)CCCBr Amb24477377 [1,1,0,0,0,0|1,0,1]=4 1424 B9R0.8 COC(=O)[C@@H](N)CCC#N Amb24479018 [1,1,0,0,0,0|1,0,1]=4 1425 B9R0.8 COC(=O)[C@@H](N)CNC=O Amb24409940 [1,1,0,0,0,0|1,0,0]=3 1426 B9R0.8 COC(=O)[C@@H](N)CSN=O Amb24482178 [1,1,0,0,0,0|2,0,0]=4 1427 B9R0.8 COC(=O)[C@H](C)NCC=C Amb24432295 [1,1,0,0,0,0|2,0,0]=4 1428 B9R0.8 COC(=O)[C@H](CCCN)N Amb16183971 [1,1,0,0,0,0|1,0,1]=4 1429 B9R0.8 COC(=O)[C@H](N)CCC#C Amb25367248 [1,1,0,0,0,0|1,0,1]=4 1430 B9R0.8 COC(=O)[C@H](N)CCCN Amb25823371 [1,1,0,0,0,0|1,0,1]=4 1431 B9R0.8 COC(=O)[C@H](O)CCC=C Amb25749046 [1,1,0,0,0,0|1,0,0]=3 1432 B9R0.8 COC(=O)[C@H](O)CNC=O Amb25245085 [1,1,0,0,0,0|1,0,0]=3 1433 B9R0.8 COCCC(N)C(=O)OC Amb24053179 [1,1,0,0,0,0|2,0,0]=4 1434 B9R0.8 CSCCC(C(=O)OC)N Amb1152979 [1,1,0,0,0,0|2,0,0]=4 1435 B9R0.8 C\C(=C/CC=O)\C(=O)OC Amb18643814 [1,1,0,0,0,0|0,0,2]=4 1436 B9R0.8 NCCC[C@@H](C(=O)OC)N Amb16236222 [1,1,0,0,0,0|1,0,1]=4 1437 B9R0.20 COS(=O)(=O)CCCCO Amb24592425 [1,1,0,0,0,0|1,0,1]=4 1438 B9R0.24 CCC(=C)CCC(C)C=O Amb25740692 [1,1,0,0,0,0|2,0,0]=4 1439 B9R0.24 CCC(=C)CC[C@@H](C)C=O Amb25727919 [1,1,0,0,0,0|2,0,0]=4 1440 B9R0.24 CCC(=O)CCC(C)CO Amb25146971 [1,1,0,0,0,0|1,0,1]=4 1441 B9R0.24 CCC(=O)CC[C@@H](C)C=O Amb24478247 [1,1,0,0,0,0|1,0,0]=3 1442 B9R0.24 CCC(=O)OCC(C)C=O Amb24567100 [1,1,0,0,0,0|2,0,0]=4 1443 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [1,1,0,0,0,0|1,0,1]=4 1444 B9R0.24 CCC(O)CCC(=O)OC Amb25850223 [1,1,0,0,0,0|1,0,1]=4 1445 B9R0.24 CC[C@@H](O)CCC(=O)OC Amb24561650 [1,1,0,0,0,0|1,0,1]=4 1446 B9R0.24 CC[C@H](O)CCC(=O)OC Amb24377641 [1,1,0,0,0,0|1,0,1]=4 1447 B9R0.24 COC(=O)CCC(Br)C=O Amb24680272 [1,1,0,0,0,0|0,0,0]=2 1448 B9R0.24 COC(=O)CCC(Br)CBr Amb25343381 [1,1,0,0,0,0|1,0,1]=4 1449 B9R0.24 COC(=O)CCC(C)C=O Amb18644121 [1,1,0,0,0,0|0,0,0]=2 1450 B9R0.24 COC(=O)CCC(C)CBr Amb25032347 [1,1,0,0,0,0|1,0,1]=4 1451 B9R0.24 COC(=O)CCC(C)SC Amb24709195 [1,1,0,0,0,0|2,0,0]=4 1452 B9R0.24 COC(=O)CCC(Cl)C#N Amb24650009 [1,1,0,0,0,0|1,0,1]=4 1453 B9R0.24 COC(=O)CCC(Cl)CCl Amb25241534 [1,1,0,0,0,0|1,0,1]=4 1454 B9R0.24 COC(=O)CCC(N)C#C Amb24433501 [1,1,0,0,0,0|1,0,1]=4 1455 B9R0.24 COC(=O)CCC(N)C=C Amb18124639 [1,1,0,0,0,0|1,0,0]=3 1456 B9R0.24 COC(=O)CCC(N)CF Amb24517084 [1,1,0,0,0,0|1,0,1]=4 1457 B9R0.24 COC(=O)CCC(O)C=C Amb25127861 [1,1,0,0,0,0|1,0,0]=3 1458 B9R0.24 COC(=O)CCC(O)CBr Amb25044783 [1,1,0,0,0,0|1,0,1]=4 1459 B9R0.24 COC(=O)CCC(O)CN Amb25857935 [1,1,0,0,0,0|1,0,1]=4 1460 B9R0.24 COC(=O)CCC(O)CO Amb25204294 [1,1,0,0,0,0|0,0,1]=3 1461 B9R0.24 COC(=O)CC[C@@H](C)C=O Amb25104821 [1,1,0,0,0,0|0,0,0]=2 1462 B9R0.24 COC(=O)CC[C@@H](O)C#C Amb25343842 [1,1,0,0,0,0|1,0,1]=4 1463 B9R0.24 COC(=O)CC[C@@H](O)CN Amb24744697 [1,1,0,0,0,0|1,0,1]=4 1464 B9R0.24 COC(=O)CC[C@H](Cl)C=O Amb25100997 [1,1,0,0,0,0|0,0,0]=2 1465 B9R0.24 COC(=O)CC[C@H](N)C#C Amb25147453 [1,1,0,0,0,0|1,0,1]=4 1466 B9R0.24 COC(=O)CC[C@H](O)C=C Amb24481290 [1,1,0,0,0,0|1,0,0]=3 1467 B9R0.24 COC(=O)CNC(C)C=C Amb25693636 [1,1,0,0,0,0|2,0,0]=4 1468 B9R0.24 COC(=O)CSC(C)CO Amb25070989 [1,1,0,0,0,0|1,0,1]=4 1469 B9R0.24 C\C(\C=O)=C/CC(=O)OC Amb18643828 [1,1,0,0,0,0|0,0,2]=4 1470 B9R0.24 C\C(\C=O)=C\CC(=O)OC Amb24655988 [1,1,0,0,0,0|0,0,2]=4 1471 B9R0.24 C\C=C(\C)/CCC(C)C=O Amb24697776 [1,1,0,0,0,0|2,0,0]=4 1472 B9R0.24 O=NN(CCC(=O)OC)C Amb17618594 [1,1,0,0,0,0|2,0,0]=4 1473 B9R0.34 CCC(=O)CC(C)CC=C Amb25712973 [1,1,0,0,0,0|2,0,0]=4 1474 B9R0.34 CCC(=O)CC(O)CCO Amb24662474 [1,1,0,0,0,0|1,0,1]=4 1475 B9R0.34 CCC(=O)C[C@H](C)CC=C Amb24620054 [1,1,0,0,0,0|2,0,0]=4 1476 B9R0.34 CCC(=O)O[C@@H](C)CC=O Amb25102800 [1,1,0,0,0,0|2,0,0]=4 1477 B9R0.34 CCCC(Br)CC(=O)OC Amb25278221 [1,1,0,0,0,0|1,0,1]=4 1478 B9R0.34 CCCC(C)CC(=O)OC Amb25125122 [1,1,0,0,0,0|1,0,1]=4 1479 B9R0.34 CCCC(N)CC(=O)OC Amb22059489 [1,1,0,0,0,0|1,0,1]=4 1480 B9R0.34 CCCC(O)CC(=O)OC Amb21928831 [1,1,0,0,0,0|1,0,1]=4 1481 B9R0.34 CCC[C@H](N)CC(=O)OC Amb25147500 [1,1,0,0,0,0|1,0,1]=4 1482 B9R0.34 CNC(=O)CN(C)CC=O Amb24475648 [1,1,0,0,0,0|2,0,0]=4 1483 B9R0.34 COC(=O)CC(=O)CC=C Amb24456670 [1,1,0,0,0,0|1,0,1]=4 1484 B9R0.34 COC(=O)CC(=O)CCO Amb25833665 [1,1,0,0,0,0|0,0,2]=4 1485 B9R0.34 COC(=O)CC(C)CC=O Amb18644136 [1,1,0,0,0,0|0,0,0]=2 1486 B9R0.34 COC(=O)CC(C)CCBr Amb24477385 [1,1,0,0,0,0|1,0,1]=4 1487 B9R0.34 COC(=O)CC(C)CCN Amb24546678 [1,1,0,0,0,0|1,0,1]=4 1488 B9R0.34 COC(=O)CC(N)CC=C Amb25799423 [1,1,0,0,0,0|1,0,0]=3 1489 B9R0.34 COC(=O)CC(O)CC#C Amb25136248 [1,1,0,0,0,0|1,0,1]=4 1490 B9R0.34 COC(=O)CC(O)CC#N Amb24391893 [1,1,0,0,0,0|1,0,1]=4 1491 B9R0.34 COC(=O)CC(O)CCBr Amb25760946 [1,1,0,0,0,0|1,0,1]=4 1492 B9R0.34 COC(=O)CC(O)CSC Amb24412887 [1,1,0,0,0,0|2,0,0]=4 1493 B9R0.34 COC(=O)C[C@@H](C)CC=O Amb24365488 [1,1,0,0,0,0|0,0,0]=2 1494 B9R0.34 COC(=O)C[C@@H](N)CC=C Amb25259760 [1,1,0,0,0,0|1,0,0]=3 1495 B9R0.34 COC(=O)C[C@@H](N)CCO Amb25132686 [1,1,0,0,0,0|0,0,1]=3 1496 B9R0.34 COC(=O)C[C@@H](O)CSC Amb25266160 [1,1,0,0,0,0|2,0,0]=4 1497 B9R0.34 COC(=O)C[C@H](C)CC=O Amb25799016 [1,1,0,0,0,0|0,0,0]=2 1498 B9R0.34 COC(=O)C[C@H](C)CCO Amb24449995 [1,1,0,0,0,0|0,0,1]=3 1499 B9R0.34 COC(=O)C[C@H](N)CC#N Amb24367695 [1,1,0,0,0,0|1,0,1]=4 1500 B9R0.34 COC(=O)C[C@H](N)CC=C Amb25294467 [1,1,0,0,0,0|1,0,0]=3 1501 B9R0.34 COC(=O)C[C@H](N)CCO Amb25776064 [1,1,0,0,0,0|0,0,1]=3 1502 B9R0.34 COC(=O)C[C@H](O)CC#C Amb24457417 [1,1,0,0,0,0|1,0,1]=4 1503 B9R0.34 COC(=O)C[C@H](O)CC=C Amb24672394 [1,1,0,0,0,0|1,0,0]=3 1504 B9R0.34 COC(=O)NC(C)CC=C Amb25790033 [1,1,0,0,0,0|2,0,0]=4 1505 B9R0.34 COC(=O)NC(C)CCO Amb24479314 [1,1,0,0,0,0|1,0,1]=4 1506 B9R0.34 COC(=O)N[C@@H](C)CCO Amb24676467 [1,1,0,0,0,0|1,0,1]=4 1507 B9R0.34 COCC(N)CC(=O)OC Amb24393406 [1,1,0,0,0,0|2,0,0]=4 1508 B9R0.34 COC[C@@H](N)CC(=O)OC Amb25118860 [1,1,0,0,0,0|2,0,0]=4 1509 B9R0.34 COC[C@H](N)CC(=O)OC Amb24518573 [1,1,0,0,0,0|2,0,0]=4 1510 B9R0.34 C\C(\CC(=O)OC)=C/C=O Amb24513732 [1,1,0,0,0,0|0,0,2]=4 1511 B9R0.34 C\C=C\C(N)CC(=O)OC Amb24746604 [1,1,0,0,0,0|1,0,1]=4 1512 B9R0.34 C\C=C\[C@H](N)CC(=O)OC Amb25147608 [1,1,0,0,0,0|1,0,1]=4 1513 B9R0.46 CCC(=O)CCCCC=O Amb25243006 [1,1,0,0,0,0|1,0,0]=3 1514 B9R0.46 CCC(=O)CCCCOC Amb25797343 [1,1,0,0,0,0|1,0,1]=4 1515 B9R0.46 CCC(=O)CCSCC=C Amb25714184 [1,1,0,0,0,0|2,0,0]=4 1516 B9R0.46 CCC(=O)COCCC=C Amb25783572 [1,1,0,0,0,0|2,0,0]=4 1517 B9R0.46 CCC(=O)NCCNC=O Amb25747153 [1,1,0,0,0,0|2,0,0]=4 1518 B9R0.46 CCC(=O)OCCCC=C Amb24482885 [1,1,0,0,0,0|2,0,0]=4 1519 B9R0.46 CCC(=O)OCCCC=O Amb25270047 [1,1,0,0,0,0|1,0,0]=3 1520 B9R0.46 CCC(=O)\C=C/CCC=O Amb25695392 [1,1,0,0,0,0|1,0,1]=4 1521 B9R0.46 CCC(=O)\C=C\CCC=O Amb24697805 [1,1,0,0,0,0|1,0,1]=4 1522 B9R0.46 CCCCCNC(=O)OC Amb17918558 [1,1,0,0,0,0|1,0,1]=4 1523 B9R0.46 CCNCCCC(=O)OC Amb22886193 [1,1,0,0,0,0|1,0,1]=4 1524 B9R0.46 CC\C=C\CCC(=O)OC Amb25350136 [1,1,0,0,0,0|1,0,1]=4 1525 B9R0.46 CNC(=O)CCCCC=C Amb25368070 [1,1,0,0,0,0|2,0,0]=4 1526 B9R0.46 CNC(=O)CCCCC=O Amb25339730 [1,1,0,0,0,0|1,0,0]=3 1527 B9R0.46 CNC(=O)CCCCOC Amb24457668 [1,1,0,0,0,0|1,0,1]=4 1528 B9R0.46 CNC(=O)CCNCC=C Amb20171973 [1,1,0,0,0,0|2,0,0]=4 1529 B9R0.46 CNC(=O)CCNCCO Amb24478100 [1,1,0,0,0,0|1,0,1]=4 1530 B9R0.46 CNC(=O)CCSCC=O Amb24657588 [1,1,0,0,0,0|1,0,0]=3 1531 B9R0.46 CNC(=O)CCSCCO Amb18798234 [1,1,0,0,0,0|1,0,1]=4 1532 B9R0.46 CNC(=O)CNCCC=C Amb24476198 [1,1,0,0,0,0|2,0,0]=4 1533 B9R0.46 CNC(=O)NCCCC=C Amb24700967 [1,1,0,0,0,0|2,0,0]=4 1534 B9R0.46 CNC(=O)NCCCCO Amb24480832 [1,1,0,0,0,0|1,0,1]=4 1535 B9R0.46 CNCCCCC(=O)OC Amb25725637 [1,1,0,0,0,0|1,0,1]=4 1536 B9R0.46 CNCCSCC(=O)OC Amb18798231 [1,1,0,0,0,0|2,0,0]=4 1537 B9R0.46 COC(=O)C#CCCCO Amb22230916 [1,1,0,0,0,0|0,0,2]=4 1538 B9R0.46 COC(=O)CCC#CCO Amb25854158 [1,1,0,0,0,0|0,0,2]=4 1539 B9R0.46 COC(=O)CCCCC#C Amb18636156 [1,1,0,0,0,0|1,0,1]=4 1540 B9R0.46 COC(=O)CCCCC#N Amb18643702 [1,1,0,0,0,0|1,0,1]=4 1541 B9R0.46 COC(=O)CCCCCCl Amb25703167 [1,1,0,0,0,0|1,0,1]=4 1542 B9R0.46 COC(=O)CCCCCI Amb24429888 [1,1,0,0,0,0|1,0,1]=4 1543 B9R0.46 COC(=O)CCCCCO Amb22002577 [1,1,0,0,0,0|0,0,1]=3 1544 B9R0.46 COC(=O)CCCC[Zn]Br Amb22898092 [1,1,0,0,0,0|1,0,1]=4 1545 B9R0.46 COC(=O)CCCN=[N+]=[N-] Amb22586627 [1,1,0,0,0,0|2,0,0]=4 1546 B9R0.46 COC(=O)CCCSC#N Amb22230905 [1,1,0,0,0,0|1,0,1]=4 1547 B9R0.46 COC(=O)CCNCCF Amb24468568 [1,1,0,0,0,0|1,0,1]=4 1548 B9R0.46 COC(=O)CCNCCN Amb24478041 [1,1,0,0,0,0|1,0,1]=4 1549 B9R0.46 COC(=O)CCSCC#C Amb18183274 [1,1,0,0,0,0|1,0,1]=4 1550 B9R0.46 COC(=O)CCSCC=O Amb18183492 [1,1,0,0,0,0|0,0,0]=2 1551 B9R0.46 COC(=O)CCSCCN Amb20623046 [1,1,0,0,0,0|1,0,1]=4 1552 B9R0.46 COC(=O)CCSCCN Amb20668423 [1,1,0,0,0,0|1,0,1]=4 1553 B9R0.46 COC(=O)CC\C=C/C=O Amb24536495 [1,1,0,0,0,0|0,0,1]=3 1554 B9R0.46 COC(=O)CC\C=C\C=C Amb10605293 [1,1,0,0,0,0|1,0,1]=4 1555 B9R0.46 COC(=O)CC\C=C\C=O Amb18643849 [1,1,0,0,0,0|0,0,1]=3 1556 B9R0.46 COC(=O)CC\C=C\CBr Amb25076169 [1,1,0,0,0,0|1,0,1]=4 1557 B9R0.46 COC(=O)CNCCCF Amb24675706 [1,1,0,0,0,0|1,0,1]=4 1558 B9R0.46 COC(=O)CNCCCN Amb25128054 [1,1,0,0,0,0|1,0,1]=4 1559 B9R0.46 COC(=O)CN\C=C\C=O Amb24566966 [1,1,0,0,0,0|0,0,2]=4 1560 B9R0.46 COC(=O)COCCCBr Amb24477190 [1,1,0,0,0,0|1,0,1]=4 1561 B9R0.46 COC(=O)COCN=C=O Amb24363869 [1,1,0,0,0,0|1,0,1]=4 1562 B9R0.46 COC(=O)COC\C=C\C Amb25321206 [1,1,0,0,0,0|1,0,1]=4 1563 B9R0.46 COC(=O)CSCCC#C Amb24476761 [1,1,0,0,0,0|1,0,1]=4 1564 B9R0.46 COC(=O)CSCCC=C Amb25143714 [1,1,0,0,0,0|1,0,0]=3 1565 B9R0.46 COC(=O)CSCCC=O Amb18788129 [1,1,0,0,0,0|0,0,0]=2 1566 B9R0.46 COC(=O)CSCCCCl Amb22524768 [1,1,0,0,0,0|1,0,1]=4 1567 B9R0.46 COC(=O)CSCCCS Amb24733758 [1,1,0,0,0,0|0,1,1]=4 1568 B9R0.46 COC(=O)CSC\C=C\Cl Amb24459086 [1,1,0,0,0,0|1,0,1]=4 1569 B9R0.46 COC(=O)NCCCC#N Amb24477915 [1,1,0,0,0,0|1,0,1]=4 1570 B9R0.46 COC(=O)NCCCNN Amb24670479 [1,1,0,0,0,0|2,0,0]=4 1571 B9R0.46 COC(=O)NCCOC=C Amb24478981 [1,1,0,0,0,0|2,0,0]=4 1572 B9R0.46 COC(=O)OCCCCN Amb24570668 [1,1,0,0,0,0|1,0,1]=4 1573 B9R0.46 COC(=O)OCCCCO Amb25056213 [1,1,0,0,0,0|0,0,1]=3 1574 B9R0.46 COC(=O)\C=C/CCC=O Amb25857445 [1,1,0,0,0,0|0,0,1]=3 1575 B9R0.46 COC(=O)\C=C\CCC=O Amb18643851 [1,1,0,0,0,0|0,0,1]=3 1576 B9R0.46 COC(=O)\C=C\CCCO Amb25724784 [1,1,0,0,0,0|0,0,2]=4 1577 B9R0.46 COC(=S)SCCCCO Amb25169422 [1,1,0,0,0,0|0,1,1]=4 1578 B9R0.46 COCCCCC(=O)OC Amb25136902 [1,1,0,0,0,0|0,0,1]=3 1579 B9R0.46 COCCCNC(=O)OC Amb17737911 [1,1,0,0,0,0|1,0,1]=4 1580 B9R0.46 C\C=C(/C)\CCCCC=O Amb25101803 [1,1,0,0,0,0|2,0,0]=4 1581 B9R0.46 C\C=C(\C)/CCCCC=O Amb25366484 [1,1,0,0,0,0|2,0,0]=4 1582 B9R0.46 C\C=C\CCCC(=O)OC Amb24356360 [1,1,0,0,0,0|1,0,0]=3 1583 B9R0.46 C\C=C\CCNC(=O)OC Amb24333403 [1,1,0,0,0,0|1,0,1]=4 1584 B9R0.46 C\C=C\CSCC(=O)OC Amb25297114 [1,1,0,0,0,0|1,0,1]=4 1585 B9R0.46 NCCCCCC(=O)OC Amb1152885 [1,1,0,0,0,0|1,0,1]=4 1586 B9R0.46 NCCCCCC(=O)OC Amb16203805 [1,1,0,0,0,0|1,0,1]=4 1587 B9R0.46 NCCCCCC(=O)OC Amb1935045 [1,1,0,0,0,0|1,0,1]=4 1588 B9R0.46 O=CCCCCC(=O)OC Amb16233585 [1,1,0,0,0,0|0,0,0]=2 1589 B9R0.46 OCCCCNC(=O)CC Amb17102978 [1,1,0,0,0,0|1,0,1]=4 1590 B9R0.46 OCCCSCC(=O)NC Amb17502854 [1,1,0,0,0,0|1,0,1]=4 1591 B9R0.46 ONC(=O)CCCCC=O Amb24382910 [1,1,0,0,0,0|2,0,0]=4 1592 B9R0.46 S=C=NCCCC(=O)OC Amb2371146 [1,1,0,0,0,0|0,1,1]=4 1593 B9R0.47 CC(=C)C(=O)CCCC=C Amb25146865 [1,1,0,0,0,0|2,0,0]=4 1594 B9R0.47 CC(=C)C(=O)OCCC=O Amb25352327 [1,1,0,0,0,0|2,0,0]=4 1595 B9R0.47 CC(=O)C(=O)CCCCO Amb24524628 [1,1,0,0,0,0|1,0,1]=4 1596 B9R0.47 CC(C)C(=O)CCCC=C Amb25108070 [1,1,0,0,0,0|2,0,0]=4 1597 B9R0.47 CC(C)C(=O)CCCC=O Amb18643953 [1,1,0,0,0,0|1,0,0]=3 1598 B9R0.47 CN(C)C(=O)CCNC=O Amb25032626 [1,1,0,0,0,0|2,0,0]=4 1599 B9R0.47 O=CCCNC(=O)C(C)C Amb17102168 [1,1,0,0,0,0|2,0,0]=4 1600 B9R0.47 OC(=O)C(=O)CCCC=O Amb25789953 [1,1,0,0,0,0|2,0,0]=4 1601 B9R0.47 OCCCCC(=O)N(C)C Amb17232000 [1,1,0,0,0,0|1,0,1]=4 1602 B9R0.50 COC(CCCC=O)C=O Amb25032176 [1,1,0,0,0,0|0,0,1]=3 1603 B9R0.50 COC(CCCC=O)OC Amb24117139 [1,1,0,0,0,0|0,0,2]=4 1604 B9R0.2 BrCCCCCCC(=O)O Amb10071514 [1,1,0,0,0,0|1,0,1]=4 1605 B9R0.2 C=C\C=C\CCCC(O)=O Amb25085778 [1,1,0,0,0,0|1,0,1]=4 1606 B9R0.2 CC#CCCNCC(O)=O Amb25138292 [1,1,0,0,0,0|1,0,1]=4 1607 B9R0.2 CC#CCOCCC(O)=O Amb24393140 [1,1,0,0,0,0|1,0,1]=4 1608 B9R0.2 CC#CCSCCC(O)=O Amb18797356 [1,1,0,0,0,0|1,0,1]=4 1609 B9R0.2 CC(=O)CCC\C=C/CO Amb25146607 [1,1,0,0,0,0|2,0,0]=4 1610 B9R0.2 CC(=O)CCC\C=C\CO Amb25297110 [1,1,0,0,0,0|2,0,0]=4 1611 B9R0.2 CC=C=CCCCC(C)=O Amb24364249 [1,1,0,0,0,0|2,0,0]=4 1612 B9R0.2 CC=C=CCCCC(N)=O Amb24479054 [1,1,0,0,0,0|2,0,0]=4 1613 B9R0.2 CCCCCCCC(O)=O Amb22352272 [1,1,0,0,0,0|1,0,1]=4 1614 B9R0.2 CCCCCCCC(O)=O Amb22353407 [1,1,0,0,0,0|1,0,1]=4 1615 B9R0.2 CCCCCCC[13C](O)=O Amb20243497 [1,1,0,0,0,0|1,0,1]=4 1616 B9R0.2 CCCCCC[13CH2]C(O)=O Amb22367410 [1,1,0,0,0,0|1,0,1]=4 1617 B9R0.2 CCCCCC[13CH2][13C](O)=O Amb22367490 [1,1,0,0,0,0|1,0,1]=4 1618 B9R0.2 CCCCSCCC(=O)O Amb1032992 [1,1,0,0,0,0|1,0,1]=4 1619 B9R0.2 CCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22351826 [1,1,0,0,0,0|1,0,1]=4 1620 B9R0.2 CCCNCCCC(=O)O Amb1109953 [1,1,0,0,0,0|1,0,1]=4 1621 B9R0.2 CCC\C=C\CCC(O)=O Amb25378821 [1,1,0,0,0,0|1,0,1]=4 1622 B9R0.2 CCNCCCCC(O)=O Amb24385094 [1,1,0,0,0,0|1,0,1]=4 1623 B9R0.2 CCNCCNCC(O)=O Amb24568313 [1,1,0,0,0,0|2,0,0]=4 1624 B9R0.2 CCNCCOCC(O)=O Amb18111801 [1,1,0,0,0,0|2,0,0]=4 1625 B9R0.2 CCO\C=C/CCC(C)=O Amb25369742 [1,1,0,0,0,0|1,0,1]=4 1626 B9R0.2 CCSCCNCC(O)=O Amb24652163 [1,1,0,0,0,0|2,0,0]=4 1627 B9R0.2 CCSCCOCC(O)=O Amb24716269 [1,1,0,0,0,0|2,0,0]=4 1628 B9R0.2 CC\C=C\CCCC(C)=O Amb24697143 [1,1,0,0,0,0|2,0,0]=4 1629 B9R0.2 CC\C=C\CCCC(O)=O Amb18643886 [1,1,0,0,0,0|1,0,0]=3 1630 B9R0.2 CNCCCCCC(O)=O Amb25704769 [1,1,0,0,0,0|1,0,1]=4 1631 B9R0.2 CNCCCNCC(O)=O Amb25292252 [1,1,0,0,0,0|1,0,1]=4 1632 B9R0.2 CNCCOCCC(O)=O Amb18111840 [1,1,0,0,0,0|1,0,1]=4 1633 B9R0.2 COCCCCCC(=O)O Amb10607872 [1,1,0,0,0,0|0,0,1]=3 1634 B9R0.2 COCCCCNC(N)=O Amb24478015 [1,1,0,0,0,0|1,0,1]=4 1635 B9R0.2 COCCCCOC(C)=O Amb24325176 [1,1,0,0,0,0|1,0,1]=4 1636 B9R0.2 COCCCOCC(C)=O Amb25056055 [1,1,0,0,0,0|1,0,1]=4 1637 B9R0.2 COCCCOCC(O)=O Amb25304314 [1,1,0,0,0,0|0,0,1]=3 1638 B9R0.2 COCCCSCC(C)=O Amb25289706 [1,1,0,0,0,0|1,0,1]=4 1639 B9R0.2 COCCCSCC(N)=O Amb25096665 [1,1,0,0,0,0|1,0,1]=4 1640 B9R0.2 COCCCSCC(O)=O Amb18798347 [1,1,0,0,0,0|0,0,1]=3 1641 B9R0.2 COCCNCCC(C)=O Amb24473587 [1,1,0,0,0,0|1,0,1]=4 1642 B9R0.2 COCCNCCC(N)=O Amb19960056 [1,1,0,0,0,0|1,0,1]=4 1643 B9R0.2 COCCSCCC(N)=O Amb18788219 [1,1,0,0,0,0|1,0,1]=4 1644 B9R0.2 COCOCCCC(C)=O Amb25724503 [1,1,0,0,0,0|1,0,1]=4 1645 B9R0.2 CONCCCCC(N)=O Amb24414497 [1,1,0,0,0,0|1,0,1]=4 1646 B9R0.2 CONCCCCC(O)=O Amb25694999 [1,1,0,0,0,0|0,0,1]=3 1647 B9R0.2 CONCCCNC(C)=O Amb24482765 [1,1,0,0,0,0|2,0,0]=4 1648 B9R0.2 CO\C=C\C=C\CC(O)=O Amb25213919 [1,1,0,0,0,0|0,0,2]=4 1649 B9R0.2 CO\C=C\CCCC(O)=O Amb25083414 [1,1,0,0,0,0|0,0,0]=2 1650 B9R0.2 CO\N=C\CCCC(C)=O Amb24690565 [1,1,0,0,0,0|1,0,0]=3 1651 B9R0.2 CSCCNCCC(O)=O Amb25055507 [1,1,0,0,0,0|0,1,1]=4 1652 B9R0.2 CSCCOCCC(O)=O Amb25173504 [1,1,0,0,0,0|0,1,1]=4 1653 B9R0.2 CSCCSCCC(O)=O Amb25798868 [1,1,0,0,0,0|0,1,1]=4 1654 B9R0.2 CSSCCCCC(O)=O Amb24429106 [1,1,0,0,0,0|0,1,1]=4 1655 B9R0.2 CSSCCNCC(O)=O Amb24538756 [1,1,0,0,0,0|1,1,0]=4 1656 B9R0.2 CS\C=C\CCCC(O)=O Amb25848561 [1,1,0,0,0,0|0,1,0]=3 1657 B9R0.2 C[13CH2]CCCCCC(O)=O Amb22367488 [1,1,0,0,0,0|1,0,1]=4 1658 B9R0.2 C\C=C/CCCCC(C)=O Amb25129045 [1,1,0,0,0,0|2,0,0]=4 1659 B9R0.2 C\C=C/COCCC(O)=O Amb24377336 [1,1,0,0,0,0|1,0,0]=3 1660 B9R0.2 C\C=C\C=C\CCC(O)=O Amb18643576 [1,1,0,0,0,0|1,0,1]=4 1661 B9R0.2 C\C=C\CC=CCC(O)=O Amb25076809 [1,1,0,0,0,0|1,0,1]=4 1662 B9R0.2 C\C=C\CCCCC(C)=O Amb25252247 [1,1,0,0,0,0|2,0,0]=4 1663 B9R0.2 C\C=C\CCCCC(O)=O Amb18643887 [1,1,0,0,0,0|1,0,0]=3 1664 B9R0.2 C\C=C\CCCNC(C)=O Amb24668710 [1,1,0,0,0,0|2,0,0]=4 1665 B9R0.2 C\C=C\CC\C=C\C(O)=O Amb25111532 [1,1,0,0,0,0|1,0,1]=4 1666 B9R0.2 C\C=C\COCCC(C)=O Amb25059570 [1,1,0,0,0,0|2,0,0]=4 1667 B9R0.2 C\C=C\COCCC(N)=O Amb24505222 [1,1,0,0,0,0|2,0,0]=4 1668 B9R0.2 C\C=C\COCCC(O)=O Amb24478110 [1,1,0,0,0,0|1,0,0]=3 1669 B9R0.2 ClCCCCCCC(=O)O Amb17594087 [1,1,0,0,0,0|1,0,1]=4 1670 B9R0.2 N#C\C=C\CCCC(O)=O Amb25343311 [1,1,0,0,0,0|1,0,1]=4 1671 B9R0.2 NCCCCCCC(=O)O Amb1151254 [1,1,0,0,0,0|1,0,1]=4 1672 B9R0.2 NCCCCCCC(=O)O Amb16232099 [1,1,0,0,0,0|1,0,1]=4 1673 B9R0.2 NCCOCCCC(O)=O Amb18111467 [1,1,0,0,0,0|2,0,0]=4 1674 B9R0.2 NCCSCCCC(=O)O Amb17500468 [1,1,0,0,0,0|2,0,0]=4 1675 B9R0.2 NOCCCCCC(=O)O Amb10975958 [1,1,0,0,0,0|1,0,1]=4 1676 B9R0.2 OC(=O)CCCC#CCBr Amb24477271 [1,1,0,0,0,0|1,0,1]=4 1677 B9R0.2 OC(=O)CCCCCCF Amb25132501 [1,1,0,0,0,0|1,0,1]=4 1678 B9R0.2 OC(=O)CCCCCCS Amb24710334 [1,1,0,0,0,0|1,0,1]=4 1679 B9R0.2 OC(=O)CCCNCCF Amb25312142 [1,1,0,0,0,0|2,0,0]=4 1680 B9R0.2 OC\C=C\CCCC(O)=O Amb24568323 [1,1,0,0,0,0|1,0,0]=3 1681 B9R0.2 ON=CCCCCC(O)=O Amb24480769 [1,1,0,0,0,0|2,0,0]=4 1682 B9R0.2 [13CH3]CCCCCCC(O)=O Amb22367137 [1,1,0,0,0,0|1,0,1]=4 1683 B9R0.2 [13CH3][13CH2]CCCCCC(O)=O Amb22367489 [1,1,0,0,0,0|1,0,1]=4 1684 B9R0.4 CC#CCC(C)CC(O)=O Amb24350965 [1,1,0,0,0,0|1,0,1]=4 1685 B9R0.4 CC#CC[C@@H](C)CC(O)=O Amb24616270 [1,1,0,0,0,0|1,0,1]=4 1686 B9R0.4 CCCCC(CC(=O)O)N Amb1993866 [1,1,0,0,0,0|1,0,1]=4 1687 B9R0.4 CCCCC(O)CC(O)=O Amb22388888 [1,1,0,0,0,0|1,0,1]=4 1688 B9R0.4 CCCC[C@@H](O)CC(O)=O Amb24350627 [1,1,0,0,0,0|1,0,1]=4 1689 B9R0.4 CCOCC(C)CC(O)=O Amb18202330 [1,1,0,0,0,0|2,0,0]=4 1690 B9R0.4 CCOCC(Cl)CC(O)=O Amb24426131 [1,1,0,0,0,0|2,0,0]=4 1691 B9R0.4 CC\C=C\C(C)CC(O)=O Amb18643922 [1,1,0,0,0,0|1,0,1]=4 1692 B9R0.4 CC\C=C\C(N)CC(O)=O Amb25843767 [1,1,0,0,0,0|1,0,1]=4 1693 B9R0.4 CC\C=C\C(O)CC(O)=O Amb22831930 [1,1,0,0,0,0|1,0,1]=4 1694 B9R0.4 CNCCC(C)CC(O)=O Amb24694269 [1,1,0,0,0,0|1,0,1]=4 1695 B9R0.4 CNCC[C@@H](N)CC(O)=O Amb24117036 [1,1,0,0,0,0|1,0,1]=4 1696 B9R0.4 CNCC[C@H](N)CC(O)=O Amb25789535 [1,1,0,0,0,0|1,0,1]=4 1697 B9R0.4 COCCC(C)CC(N)=O Amb25842751 [1,1,0,0,0,0|1,0,1]=4 1698 B9R0.4 COCCC(N)CC(C)=O Amb25147726 [1,1,0,0,0,0|1,0,1]=4 1699 B9R0.4 COCCN(C)CC(O)=O Amb22587006 [1,1,0,0,0,0|1,0,1]=4 1700 B9R0.4 COCCN(C)CC(O)=O Amb22587626 [1,1,0,0,0,0|1,0,1]=4 1701 B9R0.4 COCCS(=O)CC(O)=O Amb18792760 [1,1,0,0,0,0|1,0,1]=4 1702 B9R0.4 COCO[C@H](C)CC(O)=O Amb24715879 [1,1,0,0,0,0|1,0,1]=4 1703 B9R0.4 CSCCC(N)CC(O)=O Amb22353181 [1,1,0,0,0,0|0,1,1]=4 1704 B9R0.4 CSCCC(O)CC(O)=O Amb18798349 [1,1,0,0,0,0|0,1,1]=4 1705 B9R0.4 CSCC[C@@H](CC(=O)O)N Amb16184019 [1,1,0,0,0,0|0,1,1]=4 1706 B9R0.4 CSCC[C@H](N)CC(O)=O Amb22352993 [1,1,0,0,0,0|0,1,1]=4 1707 B9R0.4 C\C=C/CC(C)CC(C)=O Amb25146817 [1,1,0,0,0,0|2,0,0]=4 1708 B9R0.48 C=C=C[C@@H](N)CCC(O)=O Amb24480739 [1,1,0,0,0,0|1,0,1]=4 1709 B9R0.48 CCCC(Br)CCC(O)=O Amb24469305 [1,1,0,0,0,0|1,0,1]=4 1710 B9R0.48 CCCC(CCC(=O)O)N Amb1014101 [1,1,0,0,0,0|1,0,1]=4 1711 B9R0.48 CCCC(Cl)CCC(O)=O Amb23590328 [1,1,0,0,0,0|1,0,1]=4 1712 B9R0.48 CCCC(O)CCC(O)=O Amb17689110 [1,1,0,0,0,0|1,0,1]=4 1713 B9R0.48 CCC[C@@H](C)CCC(O)=O Amb24548514 [1,1,0,0,0,0|1,0,1]=4 1714 B9R0.48 CCC[C@H](C)CCC(O)=O Amb24446759 [1,1,0,0,0,0|1,0,1]=4 1715 B9R0.48 CCC[C@H](N)CCC(O)=O Amb25211817 [1,1,0,0,0,0|1,0,1]=4 1716 B9R0.48 CCNC(C)CCC(O)=O Amb24394614 [1,1,0,0,0,0|2,0,0]=4 1717 B9R0.48 CCOC(C)CCC(O)=O Amb24690847 [1,1,0,0,0,0|2,0,0]=4 1718 B9R0.48 CCSC(C)CCC(O)=O Amb18800669 [1,1,0,0,0,0|2,0,0]=4 1719 B9R0.48 CNCC(O)CCC(O)=O Amb24745159 [1,1,0,0,0,0|1,0,1]=4 1720 B9R0.48 COCC(C)CCC(O)=O Amb25340432 [1,1,0,0,0,0|0,0,1]=3 1721 B9R0.48 COCC(C)NCC(O)=O Amb19408155 [1,1,0,0,0,0|1,0,1]=4 1722 B9R0.48 COCC(O)CCC(C)=O Amb24438108 [1,1,0,0,0,0|1,0,1]=4 1723 B9R0.48 CSS[C@@H](C)CCC(O)=O Amb25798967 [1,1,0,0,0,0|1,1,0]=4 1724 B9R0.48 CSS[C@H](C)CCC(O)=O Amb24652619 [1,1,0,0,0,0|1,1,0]=4 1725 B9R0.48 C\C(\CCC(O)=O)=C\SC Amb24520805 [1,1,0,0,0,0|0,1,1]=4 1726 B9R0.48 C\C=C/[C@@H](O)CCC(C)=O Amb25146706 [1,1,0,0,0,0|2,0,0]=4 1727 B9R0.48 C\C=C\C(=O)CCC(O)=O Amb24620816 [1,1,0,0,0,0|1,0,1]=4 1728 B9R0.48 C\C=C\C(O)CCC(C)=O Amb25142677 [1,1,0,0,0,0|2,0,0]=4 1729 B9R0.48 C\C=C\C(O)CCC(O)=O Amb25275755 [1,1,0,0,0,0|1,0,0]=3 1730 B9R0.48 C\C=C\[C@H](O)CCC(C)=O Amb24749626 [1,1,0,0,0,0|2,0,0]=4 1731 B9R0.48 C\C=C\[C@H](O)CCC(O)=O Amb24538051 [1,1,0,0,0,0|1,0,0]=3 1732 B9R0.55 CC(=C)\C=C\CCC(O)=O Amb24565556 [1,1,0,0,0,0|1,0,1]=4 1733 B9R0.55 CC(=O)CCCC=C(C)O Amb24627452 [1,1,0,0,0,0|2,0,0]=4 1734 B9R0.55 CC(=O)CCC\C=C(\C)/O Amb24546380 [1,1,0,0,0,0|2,0,0]=4 1735 B9R0.55 CC(=O)OCCCC(O)=O Amb24480808 [1,1,0,0,0,0|2,0,0]=4 1736 B9R0.55 CC(Br)=CCCCC(O)=O Amb25289201 [1,1,0,0,0,0|1,0,0]=3 1737 B9R0.55 CC(Br)CCCCC(O)=O Amb25309392 [1,1,0,0,0,0|1,0,1]=4 1738 B9R0.55 CC(C)=CCCCC(O)=O Amb18643939 [1,1,0,0,0,0|1,0,0]=3 1739 B9R0.55 CC(C)=CCOCC(O)=O Amb18644115 [1,1,0,0,0,0|2,0,0]=4 1740 B9R0.55 CC(C)\C=C\CCC(O)=O Amb25082805 [1,1,0,0,0,0|1,0,1]=4 1741 B9R0.55 CC(CCCCC(=O)O)C Amb10576144 [1,1,0,0,0,0|1,0,1]=4 1742 B9R0.55 CC(Cl)=CCSCC(O)=O Amb25295452 [1,1,0,0,0,0|2,0,0]=4 1743 B9R0.55 CC(Cl)CCCCC(O)=O Amb18646185 [1,1,0,0,0,0|1,0,1]=4 1744 B9R0.55 CC(N)CCCCC(O)=O Amb18644199 [1,1,0,0,0,0|1,0,1]=4 1745 B9R0.55 CC(N)CCCCC(O)=O Amb19515386 [1,1,0,0,0,0|1,0,1]=4 1746 B9R0.55 CC(NCCCC(=O)O)C Amb1111231 [1,1,0,0,0,0|2,0,0]=4 1747 B9R0.55 CC(O)CCCCC(O)=O Amb18644264 [1,1,0,0,0,0|1,0,1]=4 1748 B9R0.55 CC(O)\C=C\CCC(O)=O Amb24453133 [1,1,0,0,0,0|1,0,1]=4 1749 B9R0.55 CN(C)CCCCC(O)=O Amb19275569 [1,1,0,0,0,0|1,0,1]=4 1750 B9R0.55 CP(=O)CCCCC(O)=O Amb25765822 [1,1,0,0,0,0|1,0,1]=4 1751 B9R0.55 CS(=O)CCCCC(O)=O Amb18788305 [1,1,0,0,0,0|0,1,1]=4 1752 B9R0.55 CS(=O)NCCCC(O)=O Amb24753135 [1,1,0,0,0,0|1,1,0]=4 1753 B9R0.55 C[C@@H](O)CCCCC(O)=O Amb24427549 [1,1,0,0,0,0|1,0,1]=4 1754 B9R0.55 C[C@H](N)CCCCC(O)=O Amb25229790 [1,1,0,0,0,0|1,0,1]=4 1755 B9R0.55 C[C@H](O)CCCCC(O)=O Amb24671333 [1,1,0,0,0,0|1,0,1]=4 1756 B9R0.55 OC(=O)CCCC=C(Cl)Cl Amb24441631 [1,1,0,0,0,0|2,0,0]=4 1757 B9R0.55 OC(=O)CCCSC(C)C Amb17503621 [1,1,0,0,0,0|2,0,0]=4 1758 B9R0.7 C=C(NCC(O)=O)C(O)=O Amb24350752 [1,1,0,0,0,0|1,0,1]=4 1759 B9R0.7 CC(=C)CCC(C)C(O)=O Amb25809141 [1,1,0,0,0,0|1,0,0]=3 1760 B9R0.7 CC(=C)CC[C@@H](C)C(O)=O Amb25685103 [1,1,0,0,0,0|1,0,0]=3 1761 B9R0.7 CC(=C)CC[C@@H](N)C(O)=O Amb25775219 [1,1,0,0,0,0|1,0,0]=3 1762 B9R0.7 CC(=C)COC(C)C(O)=O Amb24549744 [1,1,0,0,0,0|2,0,0]=4 1763 B9R0.7 CC(=C)CO[C@@H](C)C(O)=O Amb24505175 [1,1,0,0,0,0|2,0,0]=4 1764 B9R0.7 CC(=C)CO[C@H](C)C(O)=O Amb25772492 [1,1,0,0,0,0|2,0,0]=4 1765 B9R0.7 CC(=N)SCC(Cl)C(O)=O Amb18648569 [1,1,0,0,0,0|2,0,0]=4 1766 B9R0.7 CC(=O)C(=O)CCC(O)=O Amb24359327 [1,1,0,0,0,0|0,0,1]=3 1767 B9R0.7 CC(=O)C(Br)CCC(O)=O Amb25733508 [1,1,0,0,0,0|0,0,0]=2 1768 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [1,1,0,0,0,0|1,0,0]=3 1769 B9R0.7 CC(=O)C(C)CNC(C)=O Amb24072033 [1,1,0,0,0,0|2,0,0]=4 1770 B9R0.7 CC(=O)C(C)SCC(C)=O Amb24482830 [1,1,0,0,0,0|2,0,0]=4 1771 B9R0.7 CC(=O)C(Cl)CCC(=O)Cl Amb24373858 [1,1,0,0,0,0|1,0,0]=3 1772 B9R0.7 CC(=O)C(F)COC(C)=O Amb25319947 [1,1,0,0,0,0|2,0,0]=4 1773 B9R0.7 CC(=O)C(N)CCC(N)=O Amb25231237 [1,1,0,0,0,0|1,0,0]=3 1774 B9R0.7 CC(=O)CCC(=C)C(C)=O Amb25303019 [1,1,0,0,0,0|1,0,1]=4 1775 B9R0.7 CC(=O)CCC(=O)C(C)=O Amb25852390 [1,1,0,0,0,0|1,0,1]=4 1776 B9R0.7 CC(=O)CCC(C)C(C)=C Amb25702190 [1,1,0,0,0,0|2,0,0]=4 1777 B9R0.7 CC(=O)CCC(C)C(C)=O Amb25146789 [1,1,0,0,0,0|1,0,0]=3 1778 B9R0.7 CC(=O)CCC(C)C(O)=O Amb18644099 [1,1,0,0,0,0|0,0,0]=2 1779 B9R0.7 CC(=O)CCC(Cl)C(C)=C Amb25242489 [1,1,0,0,0,0|2,0,0]=4 1780 B9R0.7 CC(=O)CCC(F)C(C)=O Amb25369738 [1,1,0,0,0,0|1,0,0]=3 1781 B9R0.7 CC(=O)CCC(N)C(O)=O Amb20669473 [1,1,0,0,0,0|0,0,0]=2 1782 B9R0.7 CC(=O)CCC(N)C(O)=O Amb22157242 [1,1,0,0,0,0|0,0,0]=2 1783 B9R0.7 CC(=O)CCN(C)C(C)=O Amb24352049 [1,1,0,0,0,0|2,0,0]=4 1784 B9R0.7 CC(=O)CC[C@@H](C)C(C)=C Amb24646916 [1,1,0,0,0,0|2,0,0]=4 1785 B9R0.7 CC(=O)CC[C@@H](N)C(O)=O Amb19130479 [1,1,0,0,0,0|0,0,0]=2 1786 B9R0.7 CC(=O)CC[C@H](C)C(C)=C Amb24583145 [1,1,0,0,0,0|2,0,0]=4 1787 B9R0.7 CC(=O)CC[C@H](C)C(C)=O Amb25692099 [1,1,0,0,0,0|1,0,0]=3 1788 B9R0.7 CC(=O)CC[C@H](N)C(O)=O Amb25147501 [1,1,0,0,0,0|0,0,0]=2 1789 B9R0.7 CC(=O)CNC(=O)C(O)=O Amb24480846 [1,1,0,0,0,0|1,0,1]=4 1790 B9R0.7 CC(=O)CSC(C(=O)O)C Amb17501621 [1,1,0,0,0,0|1,0,0]=3 1791 B9R0.7 CC(=O)N(C)CCC(N)=O Amb25688630 [1,1,0,0,0,0|2,0,0]=4 1792 B9R0.7 CC(=O)NCC(C)C(O)=O Amb18300085 [1,1,0,0,0,0|1,0,0]=3 1793 B9R0.7 CC(=O)NCC(F)C(O)=O Amb25356174 [1,1,0,0,0,0|1,0,0]=3 1794 B9R0.7 CC(=O)NCC(O)C(O)=O Amb25374579 [1,1,0,0,0,0|1,0,0]=3 1795 B9R0.7 CC(=O)NC[C@H](N)C(O)=O Amb25772091 [1,1,0,0,0,0|1,0,0]=3 1796 B9R0.7 CC(=O)NC[C@H](O)C(O)=O Amb24480830 [1,1,0,0,0,0|1,0,0]=3 1797 B9R0.7 CC(=O)NNC(C)C(O)=O Amb24679763 [1,1,0,0,0,0|2,0,0]=4 1798 B9R0.7 CC(=O)NN[C@@H](C)C(O)=O Amb24068257 [1,1,0,0,0,0|2,0,0]=4 1799 B9R0.7 CC(=O)OCC(=O)C(O)=O Amb24350556 [1,1,0,0,0,0|1,0,1]=4 1800 B9R0.7 CC(=O)OCC(C(=O)O)N Amb17593668 [1,1,0,0,0,0|1,0,0]=3 1801 B9R0.7 CC(=O)OCC(C)C(N)=O Amb24356443 [1,1,0,0,0,0|2,0,0]=4 1802 B9R0.7 CC(=O)OCC(Cl)C(=O)Cl Amb24692678 [1,1,0,0,0,0|2,0,0]=4 1803 B9R0.7 CC(=O)OCC(Cl)C(O)=O Amb24425506 [1,1,0,0,0,0|1,0,0]=3 1804 B9R0.7 CC(=O)OC[C@@H](C)C(O)=O Amb25187888 [1,1,0,0,0,0|1,0,0]=3 1805 B9R0.7 CC(=O)OC[C@@H](N)C(O)=O Amb22756697 [1,1,0,0,0,0|1,0,0]=3 1806 B9R0.7 CC(=O)OC[C@H](C)C(N)=O Amb25147342 [1,1,0,0,0,0|2,0,0]=4 1807 B9R0.7 CC(=O)ON[C@@H](C)C(O)=O Amb25096728 [1,1,0,0,0,0|2,0,0]=4 1808 B9R0.7 CC(=O)SCC(=C)C(O)=O Amb24482306 [1,1,0,0,0,0|1,0,1]=4 1809 B9R0.7 CC(=O)SCC(C(=O)Cl)C Amb16232721 [1,1,0,0,0,0|2,0,0]=4 1810 B9R0.7 CC(=O)SCC(C)C(N)=O Amb22586594 [1,1,0,0,0,0|2,0,0]=4 1811 B9R0.7 CC(=O)SCC(Cl)C(O)=O Amb24423824 [1,1,0,0,0,0|1,0,0]=3 1812 B9R0.7 CC(=O)SCC(N)C(O)=O Amb22490452 [1,1,0,0,0,0|1,0,0]=3 1813 B9R0.7 CC(=O)SC[C@@H](C(=O)O)N Amb16185419 [1,1,0,0,0,0|1,0,0]=3 1814 B9R0.7 CC(=O)SC[C@H](C)C(=O)Cl Amb25230202 [1,1,0,0,0,0|2,0,0]=4 1815 B9R0.7 CC(=O)[C@@H](C)CCC(O)=O Amb25333003 [1,1,0,0,0,0|0,0,0]=2 1816 B9R0.7 CC(=O)[C@@H](N)CCC(N)=O Amb25142080 [1,1,0,0,0,0|1,0,0]=3 1817 B9R0.7 CC(=O)[C@@H](N)CCC(O)=O Amb24386065 [1,1,0,0,0,0|0,0,0]=2 1818 B9R0.7 CC(=O)[C@H](C)CCC(O)=O Amb24671283 [1,1,0,0,0,0|0,0,0]=2 1819 B9R0.7 CC(=O)[C@H](C)COC(C)=O Amb24457434 [1,1,0,0,0,0|2,0,0]=4 1820 B9R0.7 CC(C)=C(C)CCC(O)=O Amb24505016 [1,1,0,0,0,0|1,0,1]=4 1821 B9R0.7 CC(C)=CCC(C)C(O)=O Amb18643879 [1,1,0,0,0,0|1,0,1]=4 1822 B9R0.7 CC(C)=CCC(F)C(O)=O Amb24480809 [1,1,0,0,0,0|1,0,1]=4 1823 B9R0.7 CC(C)=CC[C@@H](C)C(O)=O Amb24698988 [1,1,0,0,0,0|1,0,1]=4 1824 B9R0.7 CC(C)=CC[C@H](N)C(O)=O Amb25836895 [1,1,0,0,0,0|1,0,1]=4 1825 B9R0.7 CC(C)C(Br)CCC(O)=O Amb24640345 [1,1,0,0,0,0|1,0,1]=4 1826 B9R0.7 CC(C)C(C)CCC(O)=O Amb25843702 [1,1,0,0,0,0|1,0,1]=4 1827 B9R0.7 CC(C)C(Cl)CCC(O)=O Amb24413514 [1,1,0,0,0,0|1,0,1]=4 1828 B9R0.7 CC(C)C(F)CCC(O)=O Amb24480880 [1,1,0,0,0,0|1,0,1]=4 1829 B9R0.7 CC(C)C(N)CCC(O)=O Amb18124745 [1,1,0,0,0,0|1,0,1]=4 1830 B9R0.7 CC(C)C(O)CCC(O)=O Amb25252592 [1,1,0,0,0,0|1,0,1]=4 1831 B9R0.7 CC(C)C(S)CCC(O)=O Amb25723893 [1,1,0,0,0,0|1,0,1]=4 1832 B9R0.7 CC(C)CCC(Br)C(O)=O Amb18131059 [1,1,0,0,0,0|1,0,1]=4 1833 B9R0.7 CC(C)CCC(C)C(O)=O Amb19033547 [1,1,0,0,0,0|1,0,1]=4 1834 B9R0.7 CC(C)CCC(N)C(O)=O Amb19269152 [1,1,0,0,0,0|1,0,1]=4 1835 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb19133196 [1,1,0,0,0,0|1,0,1]=4 1836 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb22899130 [1,1,0,0,0,0|1,0,1]=4 1837 B9R0.7 CC(C)[C@@H](C)CCC(O)=O Amb25076667 [1,1,0,0,0,0|1,0,1]=4 1838 B9R0.7 CC(C)[C@H](N)CCC(O)=O Amb24452899 [1,1,0,0,0,0|1,0,1]=4 1839 B9R0.7 CC(CCC(C)Br)C(O)=O Amb24452260 [1,1,0,0,0,0|1,0,1]=4 1840 B9R0.7 CC(CCC(O)=O)[N+]([O-])=O Amb25221792 [1,1,0,0,0,0|1,0,1]=4 1841 B9R0.7 CC(CNC(N)=O)C(O)=O Amb18298054 [1,1,0,0,0,0|2,0,0]=4 1842 B9R0.7 CC(Cl)=CCC(N)C(O)=O Amb25326840 [1,1,0,0,0,0|1,0,1]=4 1843 B9R0.7 CC(Cl)=CC[C@H](N)C(O)=O Amb24518555 [1,1,0,0,0,0|1,0,1]=4 1844 B9R0.7 CC(Cl)C(O)CCC(O)=O Amb24677604 [1,1,0,0,0,0|1,0,1]=4 1845 B9R0.7 CC(Cl)CCC(N)C(O)=O Amb24692699 [1,1,0,0,0,0|1,0,1]=4 1846 B9R0.7 CC(Cl)CC[C@H](N)C(O)=O Amb24692939 [1,1,0,0,0,0|1,0,1]=4 1847 B9R0.7 CC(F)=CCC(N)C(O)=O Amb24354283 [1,1,0,0,0,0|1,0,1]=4 1848 B9R0.7 CC(F)C(O)CCC(O)=O Amb25831840 [1,1,0,0,0,0|1,0,1]=4 1849 B9R0.7 CC(N)C(N)CCC(O)=O Amb24377171 [1,1,0,0,0,0|1,0,1]=4 1850 B9R0.7 CC(N=CC(O)=O)C(O)=O Amb24446584 [1,1,0,0,0,0|1,0,1]=4 1851 B9R0.7 CC(O)C(O)CCC(O)=O Amb25054706 [1,1,0,0,0,0|0,0,2]=4 1852 B9R0.7 CC(O)CCC(C)C(O)=O Amb25848509 [1,1,0,0,0,0|0,0,2]=4 1853 B9R0.7 CC(O)CCC(F)C(C)=O Amb25093785 [1,1,0,0,0,0|1,0,1]=4 1854 B9R0.7 CC(OCC(N)=O)C(O)=O Amb24660109 [1,1,0,0,0,0|2,0,0]=4 1855 B9R0.7 CC(OCC(O)=O)C(O)=O Amb25292152 [1,1,0,0,0,0|1,0,0]=3 1856 B9R0.7 CC(\C=C\C(O)=O)C(O)=O Amb24409525 [1,1,0,0,0,0|0,0,2]=4 1857 B9R0.7 CN(C)CC[C@H](N)C(O)=O Amb25108550 [1,1,0,0,0,0|2,0,0]=4 1858 B9R0.7 CN(CCC(O)=O)C(N)=O Amb18984979 [1,1,0,0,0,0|2,0,0]=4 1859 B9R0.7 CP(=O)OCC(N)C(O)=O Amb24724745 [1,1,0,0,0,0|2,0,0]=4 1860 B9R0.7 CP(=O)OC[C@H](N)C(O)=O Amb25362185 [1,1,0,0,0,0|2,0,0]=4 1861 B9R0.7 CP(O)CCC(N)C(O)=O Amb25295427 [1,1,0,0,0,0|1,0,1]=4 1862 B9R0.7 CS(=N)CCC(N)C(O)=O Amb25243030 [1,1,0,0,0,0|2,0,0]=4 1863 B9R0.7 CS(=N)CC[C@H](N)C(O)=O Amb25100927 [1,1,0,0,0,0|2,0,0]=4 1864 B9R0.7 CS(=O)CC[C@@H](N)C(O)=O Amb19133021 [1,1,0,0,0,0|1,0,0]=3 1865 B9R0.7 CS(=O)NCC(O)C(O)=O Amb25177159 [1,1,0,0,0,0|2,0,0]=4 1866 B9R0.7 CS(=O)NC[C@H](N)C(O)=O Amb25798536 [1,1,0,0,0,0|2,0,0]=4 1867 B9R0.7 CS(C)CCC(N)C(O)=O Amb25695887 [1,1,0,0,0,0|2,0,0]=4 1868 B9R0.7 CS(C)CC[C@H](N)C(O)=O Amb24440849 [1,1,0,0,0,0|2,0,0]=4 1869 B9R0.7 C[C@@H](CCC(C)=O)[C@@H](C)O Amb22747043 [1,1,0,0,0,0|1,0,1]=4 1870 B9R0.7 C[C@@H](CCC(O)=O)C(O)=O Amb22799543 [1,1,0,0,0,0|0,0,0]=2 1871 B9R0.7 C[C@@H](CC[N+]([O-])=O)C(O)=O Amb24330210 [1,1,0,0,0,0|1,0,1]=4 1872 B9R0.7 C[C@@H](F)[C@H](N)CCC(O)=O Amb25042508 [1,1,0,0,0,0|1,0,1]=4 1873 B9R0.7 C[C@@H](NCC(N)=O)C(O)=O Amb25849548 [1,1,0,0,0,0|2,0,0]=4 1874 B9R0.7 C[C@@H](NCC(O)=O)C(O)=O Amb22748947 [1,1,0,0,0,0|1,0,0]=3 1875 B9R0.7 C[C@@H](SCC(O)=O)C(O)=O Amb24482305 [1,1,0,0,0,0|1,0,0]=3 1876 B9R0.7 C[C@H](CCC(O)=O)C(O)=O Amb22225175 [1,1,0,0,0,0|0,0,0]=2 1877 B9R0.7 C[C@H](N)CC[C@@H](N)C(O)=O Amb25199121 [1,1,0,0,0,0|1,0,1]=4 1878 B9R0.7 C[C@H](NCC(N)=O)C(O)=O Amb24753576 [1,1,0,0,0,0|2,0,0]=4 1879 B9R0.7 C[C@H](NCC(O)=O)C(O)=O Amb25133540 [1,1,0,0,0,0|1,0,0]=3 1880 B9R0.7 C[C@H](O)CC[C@@H](C)C(O)=O Amb25378744 [1,1,0,0,0,0|0,0,2]=4 1881 B9R0.7 C[C@H](O)[C@H](C)CCC(O)=O Amb25340448 [1,1,0,0,0,0|0,0,2]=4 1882 B9R0.7 C[C@H](OCC(O)=O)C(O)=O Amb24393806 [1,1,0,0,0,0|1,0,0]=3 1883 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800534 [1,1,0,0,0,0|2,0,0]=4 1884 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800551 [1,1,0,0,0,0|2,0,0]=4 1885 B9R0.7 C\C(=C\CC(C(=O)O)Cl)\Cl Amb17594711 [1,1,0,0,0,0|1,0,1]=4 1886 B9R0.7 C\C(\Cl)=C\CC(C)C(O)=O Amb18126350 [1,1,0,0,0,0|1,0,1]=4 1887 B9R0.7 C\C(\Cl)=C\CC(N)C(O)=O Amb24692752 [1,1,0,0,0,0|1,0,1]=4 1888 B9R0.7 C\C(\Cl)=C\C[C@H](N)C(O)=O Amb24629700 [1,1,0,0,0,0|1,0,1]=4 1889 B9R0.7 N=C(CCC(O)=O)C(O)=O Amb25064299 [1,1,0,0,0,0|0,0,1]=3 1890 B9R0.7 NC(=O)C(=O)CCC(O)=O Amb25279394 [1,1,0,0,0,0|1,0,1]=4 1891 B9R0.7 NC(=O)C(N)CCC(O)=O Amb18644256 [1,1,0,0,0,0|1,0,0]=3 1892 B9R0.7 NC(=O)CCC(F)C(O)=O Amb24745286 [1,1,0,0,0,0|1,0,0]=3 1893 B9R0.7 NC(=O)CCC(O)C(O)=O Amb25275311 [1,1,0,0,0,0|1,0,0]=3 1894 B9R0.7 NC(=O)CC[13C@H](N)[13C](O)=O Amb22338972 [1,1,0,0,0,0|1,0,0]=3 1895 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O Amb22748708 [1,1,0,0,0,0|2,0,0]=4 1896 B9R0.7 NC(=O)CC[C@H](Br)C(O)=O Amb25223377 [1,1,0,0,0,0|1,0,0]=3 1897 B9R0.7 NC(=O)CC[C@H](N)C(N)=O Amb24426852 [1,1,0,0,0,0|2,0,0]=4 1898 B9R0.7 NC(=O)CC[C@H](O)C(N)=O Amb24480731 [1,1,0,0,0,0|2,0,0]=4 1899 B9R0.7 NC(=O)NCC(C(=O)O)F Amb17610485 [1,1,0,0,0,0|2,0,0]=4 1900 B9R0.7 NC(=O)NC[C@@H](C(=O)O)C Amb10844047 [1,1,0,0,0,0|2,0,0]=4 1901 B9R0.7 NC(=O)NC[C@@H](F)C(O)=O Amb24389552 [1,1,0,0,0,0|2,0,0]=4 1902 B9R0.7 NC(=O)NC[C@H](C(=O)O)N Amb10068479 [1,1,0,0,0,0|2,0,0]=4 1903 B9R0.7 NC(=O)N[13CH2][13CH]([13C](=O)O)F Amb17610486 [1,1,0,0,0,0|2,0,0]=4 1904 B9R0.7 NC(=O)SC[C@H](C(=O)O)N Amb10072293 [1,1,0,0,0,0|2,0,0]=4 1905 B9R0.7 NC(=O)SC[C@H](N)C(O)=O Amb22735296 [1,1,0,0,0,0|2,0,0]=4 1906 B9R0.7 NC(=O)[C@@H](N)CCC(O)=O Amb22745051 [1,1,0,0,0,0|1,0,0]=3 1907 B9R0.7 NC(=O)[C@H](N)CCC(O)=O Amb24557281 [1,1,0,0,0,0|1,0,0]=3 1908 B9R0.7 NC(CCB(O)O)C(O)=O Amb22497480 [1,1,0,0,0,0|1,0,1]=4 1909 B9R0.7 NC(CCC(=O)Br)C(O)=O Amb25224344 [1,1,0,0,0,0|1,0,0]=3 1910 B9R0.7 NC(CCC(=O)Cl)C(=O)Cl Amb25101509 [1,1,0,0,0,0|2,0,0]=4 1911 B9R0.7 NC(CCC(O)=O)C(=O)[Na] Amb24375221 [1,1,0,0,0,0|1,0,0]=3 1912 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350008 [1,1,0,0,0,0|0,0,0]=2 1913 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350165 [1,1,0,0,0,0|0,0,0]=2 1914 B9R0.7 NC(CCC(O)=O)P(O)=O Amb24340498 [1,1,0,0,0,0|1,0,0]=3 1915 B9R0.7 NC(CCC(O)=O)[13C](O)=O Amb22367384 [1,1,0,0,0,0|0,0,0]=2 1916 B9R0.7 NC(CCC(O)=S)C(O)=O Amb25039924 [1,1,0,0,0,0|0,1,0]=3 1917 B9R0.7 NC(CCC([O-])=O)C([O-])=O Amb22369354 [1,1,0,0,0,0|0,0,2]=4 1918 B9R0.7 NC(CCP(O)=O)C(O)=O Amb25276313 [1,1,0,0,0,0|1,0,0]=3 1919 B9R0.7 NC(CCS(O)=O)C(O)=O Amb22349645 [1,1,0,0,0,0|1,0,0]=3 1920 B9R0.7 NC(CC[13C](O)=O)C(O)=O Amb22366853 [1,1,0,0,0,0|0,0,0]=2 1921 B9R0.7 N[13C](=O)CC[C@@H](C(=O)O)N Amb17614783 [1,1,0,0,0,0|1,0,0]=3 1922 B9R0.7 N[13C](=O)[13CH2][13CH2][13C@H](N)[13C](O)=O Amb22367371 [1,1,0,0,0,0|1,0,0]=3 1923 B9R0.7 N[C@@H](CCC(=O)Br)C(O)=O Amb25123825 [1,1,0,0,0,0|1,0,0]=3 1924 B9R0.7 N[C@@H](CCC(=O)Cl)C(=O)Cl Amb25138653 [1,1,0,0,0,0|2,0,0]=4 1925 B9R0.7 N[C@@H](CCC(=O)Cl)C(O)=O Amb25065344 [1,1,0,0,0,0|1,0,0]=3 1926 B9R0.7 N[C@@H](CCC(O)=O)C([O-])=O Amb22745619 [1,1,0,0,0,0|0,0,1]=3 1927 B9R0.7 N[C@@H](CCC(O)=O)[13C](O)=O Amb22353662 [1,1,0,0,0,0|0,0,0]=2 1928 B9R0.7 N[C@@H](CCC(O)=S)C(O)=O Amb24480492 [1,1,0,0,0,0|0,1,0]=3 1929 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22338524 [1,1,0,0,0,0|0,0,1]=3 1930 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22350063 [1,1,0,0,0,0|0,0,1]=3 1931 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22800016 [1,1,0,0,0,0|0,0,1]=3 1932 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22801488 [1,1,0,0,0,0|0,0,1]=3 1933 B9R0.7 N[C@@H](CCC([O-])=O)C([O-])=O Amb22799952 [1,1,0,0,0,0|0,0,2]=4 1934 B9R0.7 N[C@@H](CCP(O)=O)C(O)=O Amb22904307 [1,1,0,0,0,0|1,0,0]=3 1935 B9R0.7 N[C@@H](CC[N+]([O-])=O)C(O)=O Amb25227987 [1,1,0,0,0,0|1,0,1]=4 1936 B9R0.7 N[C@@H]([13CH2]CC(O)=O)C(O)=O Amb22338711 [1,1,0,0,0,0|0,0,0]=2 1937 B9R0.7 N[C@H](C(=O)O)CCC(C)C Amb16183866 [1,1,0,0,0,0|1,0,1]=4 1938 B9R0.7 N[C@H](C(=O)O)CC[S+](C)C Amb10601599 [1,1,0,0,0,0|2,0,0]=4 1939 B9R0.7 N[C@H](CCS(O)=O)C(O)=O Amb24099404 [1,1,0,0,0,0|1,0,0]=3 1940 B9R0.7 O=C(Cl)CCC(Cl)C(=O)Cl Amb25759080 [1,1,0,0,0,0|2,0,0]=4 1941 B9R0.7 OC(=O)C(=S)NCC(O)=O Amb24423880 [1,1,0,0,0,0|1,0,1]=4 1942 B9R0.7 OC(=O)C(Cl)SCC(O)=O Amb24390363 [1,1,0,0,0,0|1,0,0]=3 1943 B9R0.7 OC(=O)C(O)SCC(O)=O Amb24524554 [1,1,0,0,0,0|1,0,0]=3 1944 B9R0.7 OC(=O)CCC(=O)C(=O)O Amb1154117 [1,1,0,0,0,0|0,0,1]=3 1945 B9R0.7 OC(=O)CCC(=O)C(=O)[O-] Amb10072616 [1,1,0,0,0,0|0,0,2]=4 1946 B9R0.7 OC(=O)CCC(=O)C(O)=O Amb22349893 [1,1,0,0,0,0|0,0,1]=3 1947 B9R0.7 OC(=O)CCC(=O)C(O)=O Amb22350267 [1,1,0,0,0,0|0,0,1]=3 1948 B9R0.7 OC(=O)CCC(=O)C(O)=O Amb22746233 [1,1,0,0,0,0|0,0,1]=3 1949 B9R0.7 OC(=O)CCC(=O)[13C](O)=O Amb22055609 [1,1,0,0,0,0|0,0,1]=3 1950 B9R0.7 OC(=O)CCC(C(=O)O)Cl Amb17594149 [1,1,0,0,0,0|0,0,0]=2 1951 B9R0.7 OC(=O)CCC(C(=O)O)N Amb1778181 [1,1,0,0,0,0|0,0,0]=2 1952 B9R0.7 OC(=O)CCC(F)C(O)=O Amb25708515 [1,1,0,0,0,0|0,0,0]=2 1953 B9R0.7 OC(=O)CCC(O)C(O)=O Amb18124864 [1,1,0,0,0,0|0,0,0]=2 1954 B9R0.7 OC(=O)CC[C@@H](O)C(O)=O Amb22799690 [1,1,0,0,0,0|0,0,0]=2 1955 B9R0.7 OC(=O)CNC(=O)C(=O)C Amb17593639 [1,1,0,0,0,0|1,0,1]=4 1956 B9R0.7 OC(=O)CNC(=O)C(=O)O Amb2447304 [1,1,0,0,0,0|1,0,1]=4 1957 B9R0.7 OC(=O)CSC(C(=O)O)C Amb2431034 [1,1,0,0,0,0|1,0,0]=3 1958 B9R0.7 OC(=O)\C(\Br)=C/CC(O)=O Amb25364176 [1,1,0,0,0,0|0,0,2]=4 1959 B9R0.7 OC(=O)\C=C/C(O)C(O)=O Amb25757882 [1,1,0,0,0,0|0,0,2]=4 1960 B9R0.7 [15NH2]C(=O)CC[C@@H](C(=O)O)N Amb17614782 [1,1,0,0,0,0|1,0,0]=3 1961 B9R0.7 [15NH2]C(=O)CC[C@H]([15NH2])C(O)=O Amb22338766 [1,1,0,0,0,0|1,0,0]=3 1962 B9R0.7 [15NH2]C(CCC(O)=O)C(O)=O Amb22336520 [1,1,0,0,0,0|0,0,0]=2 1963 B9R0.7 [15NH2][13C@@H]([13CH2][13CH2][13C](O)=O)[13C](O)=O Amb22353585 [1,1,0,0,0,0|0,0,0]=2 1964 B9R0.7 [15NH2][13C](=O)[13CH2][13CH2][13C@H]([15NH2])[13C](O)=O Amb22353586 [1,1,0,0,0,0|1,0,0]=3 1965 B9R0.7 [O-]C(=O)C(=O)CCC(O)=O Amb22166891 [1,1,0,0,0,0|0,0,2]=4 1966 B9R0.7 [O-]C(=O)CCC(=O)C(O)=O Amb22231405 [1,1,0,0,0,0|0,0,2]=4 1967 B9R0.7 [O-]C(=O)CCC(O)C([O-])=O Amb22055443 [1,1,0,0,0,0|0,0,2]=4 1968 B9R0.7 [O-]C(=O)CC[C@@H](C(=O)[O-])O Amb17615400 [1,1,0,0,0,0|0,0,2]=4 1969 B9R0.7 [O-]C(=O)CC[C@H](C(=O)[O-])O Amb17615399 [1,1,0,0,0,0|0,0,2]=4 1970 B9R0.7 [O-][N+](=O)CC[C@H](C(=O)O)C Amb13883662 [1,1,0,0,0,0|1,0,1]=4 1971 B9R0.53 C=C(CC(O)=O)CC(O)=O Amb18644057 [1,1,0,0,0,0|0,0,1]=3 1972 B9R0.53 CC(=C)CC(C)CC(O)=O Amb18643943 [1,1,0,0,0,0|1,0,0]=3 1973 B9R0.53 CC(=O)CC(=O)CC(=O)Cl Amb24662270 [1,1,0,0,0,0|1,0,1]=4 1974 B9R0.53 CC(=O)CC(=O)CC(O)=O Amb18644062 [1,1,0,0,0,0|0,0,1]=3 1975 B9R0.53 CC(=O)CC(C)CC(O)=O Amb18644106 [1,1,0,0,0,0|0,0,0]=2 1976 B9R0.53 CC(=O)CS(=O)CC(N)=O Amb24716709 [1,1,0,0,0,0|2,0,0]=4 1977 B9R0.53 CC(=O)C[C@@H](CC(=O)O)C Amb10844399 [1,1,0,0,0,0|0,0,0]=2 1978 B9R0.53 CC(=O)C[C@H](O)CC(C)=C Amb25318972 [1,1,0,0,0,0|2,0,0]=4 1979 B9R0.53 CC(=O)C\C(\C)=C\C(O)=O Amb25833580 [1,1,0,0,0,0|0,0,2]=4 1980 B9R0.53 CC(=O)NC(=O)CC(O)=O Amb24671240 [1,1,0,0,0,0|1,0,1]=4 1981 B9R0.53 CC(=O)NC(C)CC(C)=O Amb24096345 [1,1,0,0,0,0|2,0,0]=4 1982 B9R0.53 CC(=O)NN(C)CC(O)=O Amb24430379 [1,1,0,0,0,0|2,0,0]=4 1983 B9R0.53 CC(=O)N[C@H](C)CC(C)=O Amb24478882 [1,1,0,0,0,0|2,0,0]=4 1984 B9R0.53 CC(=O)OC(C)CC(C)=O Amb25690313 [1,1,0,0,0,0|2,0,0]=4 1985 B9R0.53 CC(=O)OC(C)CC(O)=O Amb18644244 [1,1,0,0,0,0|1,0,0]=3 1986 B9R0.53 CC(=O)O[C@H](C)CC(O)=O Amb25062672 [1,1,0,0,0,0|1,0,0]=3 1987 B9R0.53 CC(=O)\C=C(/C)\CC(O)=O Amb25838743 [1,1,0,0,0,0|0,0,2]=4 1988 B9R0.53 CC(=O)\C=C(\C)/CC(O)=O Amb24446679 [1,1,0,0,0,0|0,0,2]=4 1989 B9R0.53 CC(C)=CC(C)CC(O)=O Amb24480766 [1,1,0,0,0,0|1,0,1]=4 1990 B9R0.53 CC(C)=CC(O)CC(O)=O Amb18644102 [1,1,0,0,0,0|1,0,1]=4 1991 B9R0.53 CC(C)=C[C@@H](O)CC(O)=O Amb24393168 [1,1,0,0,0,0|1,0,1]=4 1992 B9R0.53 CC(C)C[C@@H](C)CC(O)=O Amb24455134 [1,1,0,0,0,0|1,0,1]=4 1993 B9R0.53 CC(C)C[C@H](N)CC(O)=O Amb19944305 [1,1,0,0,0,0|1,0,1]=4 1994 B9R0.53 CC(C)C[C@H](O)CC(O)=O Amb24505145 [1,1,0,0,0,0|1,0,1]=4 1995 B9R0.53 CC(CC(CC(=O)O)N)C Amb2438867 [1,1,0,0,0,0|1,0,1]=4 1996 B9R0.53 CC(CC(CC(=O)O)O)C Amb17232005 [1,1,0,0,0,0|1,0,1]=4 1997 B9R0.53 CC(CC(O)=O)=CC(O)=O Amb24556420 [1,1,0,0,0,0|0,0,2]=4 1998 B9R0.53 CC(CC(O)=O)CC(N)=O Amb19034796 [1,1,0,0,0,0|1,0,0]=3 1999 B9R0.53 CC(CC(O)=O)C[N+]([O-])=O Amb25142280 [1,1,0,0,0,0|1,0,1]=4 2000 B9R0.53 CC(CC(O)=O)NS(C)=O Amb25347318 [1,1,0,0,0,0|2,0,0]=4 2001 B9R0.53 CC(C[C@@H](CC(=O)O)C)C Amb10844383 [1,1,0,0,0,0|1,0,1]=4 2002 B9R0.53 CC(C[C@@H](CC(=O)O)N)C Amb16184017 [1,1,0,0,0,0|1,0,1]=4 2003 B9R0.53 CN(C)CC(N)CC(O)=O Amb18644281 [1,1,0,0,0,0|2,0,0]=4 2004 B9R0.53 CN(C)C[C@@H](O)CC(O)=O Amb25084529 [1,1,0,0,0,0|2,0,0]=4 2005 B9R0.53 CN(CC(=O)C)CC(=O)C Amb10604213 [1,1,0,0,0,0|2,0,0]=4 2006 B9R0.53 CN(CC(=O)O)CC(=O)O Amb1156001 [1,1,0,0,0,0|1,0,0]=3 2007 B9R0.53 CN(C[C@@H](CC(=O)O)O)C Amb10069803 [1,1,0,0,0,0|2,0,0]=4 2008 B9R0.53 CN(O)CC(O)CC(O)=O Amb24611959 [1,1,0,0,0,0|1,0,1]=4 2009 B9R0.53 CS(=O)CC(N)CC(O)=O Amb25766509 [1,1,0,0,0,0|1,0,0]=3 2010 B9R0.53 CS(=O)C[C@@H](N)CC(O)=O Amb25321945 [1,1,0,0,0,0|1,0,0]=3 2011 B9R0.53 C[C@H](N)C[C@H](N)CC(O)=O Amb24418565 [1,1,0,0,0,0|1,0,1]=4 2012 B9R0.53 N=C(CC(O)=O)CC(O)=O Amb25703517 [1,1,0,0,0,0|0,0,1]=3 2013 B9R0.53 NC(=O)CC(O)CC(O)=O Amb25147276 [1,1,0,0,0,0|1,0,0]=3 2014 B9R0.53 NC(=O)CS(=O)CC(O)=O Amb19007093 [1,1,0,0,0,0|2,0,0]=4 2015 B9R0.53 NC(CC(=O)O)CC(=O)O Amb16184013 [1,1,0,0,0,0|0,0,0]=2 2016 B9R0.53 OC(=O)C=C(Br)CC(O)=O Amb24573499 [1,1,0,0,0,0|0,0,2]=4 2017 B9R0.53 OC(=O)CC(Cl)CC(O)=O Amb18126464 [1,1,0,0,0,0|0,0,0]=2 2018 B9R0.53 OC(=O)CN(Br)CC(O)=O Amb25277216 [1,1,0,0,0,0|1,0,0]=3 2019 B9R0.53 OC(=O)CN(Cl)CC(O)=O Amb24482142 [1,1,0,0,0,0|1,0,0]=3 2020 B9R0.53 OC(=O)C[C@@H](NC(=O)C)C Amb2372568 [1,1,0,0,0,0|1,0,0]=3 2021 B9R0.53 OC(=O)C[C@H](NC(=O)C)C Amb2372567 [1,1,0,0,0,0|1,0,0]=3 2022 B9R0.53 OC(=O)\C=C(/Br)\CC(O)=O Amb25123824 [1,1,0,0,0,0|0,0,2]=4 2023 B9R0.53 OC(CC(=O)O)CC(=O)O Amb17615401 [1,1,0,0,0,0|0,0,0]=2 2024 B9R0.53 ON(CC(O)=O)CC(O)=O Amb25062474 [1,1,0,0,0,0|1,0,0]=3 2025 B9R0.53 [NH3+]N(CC(O)=O)CC(O)=O Amb23453377 [1,1,0,0,0,0|1,0,0]=3 2026 B9R0.53 [NH3+]N(CC(O)=O)CC(O)=O Amb24121533 [1,1,0,0,0,0|1,0,0]=3 2027 B9R0.56 CC(=O)CCCC(O)(C)C Amb17593627 [1,1,0,0,0,0|1,0,1]=4 2028 B9R0.56 CC(=O)CCCS(=O)(=O)F Amb25706977 [1,1,0,0,0,0|1,0,1]=4 2029 B9R0.56 CC(=O)CCCS(C)(=O)=O Amb18180080 [1,1,0,0,0,0|1,0,1]=4 2030 B9R0.56 CC(=O)SCCS(O)(=O)=O Amb21857874 [1,1,0,0,0,0|2,0,0]=4 2031 B9R0.56 CC(C)(C)CCCC(O)=O Amb18307485 [1,1,0,0,0,0|1,0,1]=4 2032 B9R0.56 CC(C)(F)CCCC(O)=O Amb25270576 [1,1,0,0,0,0|1,0,1]=4 2033 B9R0.56 CC(C)(N)CCCC(O)=O Amb25839402 [1,1,0,0,0,0|1,0,1]=4 2034 B9R0.56 CC(C)(O)CCCC(O)=O Amb24340189 [1,1,0,0,0,0|0,0,2]=4 2035 B9R0.56 CN(C)(C)CCCC(O)=O Amb22732541 [1,1,0,0,0,0|2,0,0]=4 2036 B9R0.56 CP(C)(=O)CNCC(O)=O Amb25339632 [1,1,0,0,0,0|2,0,0]=4 2037 B9R0.56 CP(O)(=O)CCCC(O)=O Amb24524573 [1,1,0,0,0,0|1,0,0]=3 2038 B9R0.56 CP(O)(=O)CNCC(O)=O Amb25772534 [1,1,0,0,0,0|2,0,0]=4 2039 B9R0.56 CS(=O)(=O)CCCC(N)=O Amb18409109 [1,1,0,0,0,0|2,0,0]=4 2040 B9R0.56 CS(=O)(=O)OCCC(O)=O Amb25288145 [1,1,0,0,0,0|2,0,0]=4 2041 B9R0.56 OC(=O)CCCC(F)(F)C Amb17593778 [1,1,0,0,0,0|1,0,1]=4 2042 B9R0.56 OC(=O)CCCP(O)(O)=O Amb17671941 [1,1,0,0,0,0|1,0,0]=3 2043 B9R0.56 OC(=O)CCCS(=O)(=O)C Amb17503668 [1,1,0,0,0,0|1,0,0]=3 2044 B9R0.56 OC(=O)CCNS(=O)(=O)C Amb1116751 [1,1,0,0,0,0|2,0,0]=4 2045 B9R0.56 OC(=O)CCNS(O)(=O)=O Amb24479473 [1,1,0,0,0,0|2,0,0]=4 2046 B9R0.56 OC(=O)CCOP(O)(O)=O Amb24482464 [1,1,0,0,0,0|2,0,0]=4 2047 B9R0.56 OC(=O)CCOS(O)(=O)=O Amb24482181 [1,1,0,0,0,0|2,0,0]=4 2048 B9R0.56 OC(=O)CCSP(O)(O)=O Amb24482326 [1,1,0,0,0,0|2,0,0]=4 2049 B9R0.56 OC(=O)CCSS(=O)(=O)C Amb10071647 [1,1,0,0,0,0|2,0,0]=4 2050 B9R0.56 OC(=O)CNCP(O)(=O)=O Amb25282213 [1,1,0,0,0,0|2,0,0]=4 2051 B9R0.56 OC(=O)CNCP(O)(O)=O Amb21618824 [1,1,0,0,0,0|2,0,0]=4 2052 B9R0.56 OC(=O)CN[13CH2]P(O)(O)=O Amb22367405 [1,1,0,0,0,0|2,0,0]=4 2053 B9R0.56 O[13C](=O)[13CH2][15NH]CP(=O)(O)O Amb17614840 [1,1,0,0,0,0|2,0,0]=4 2054 B9R0.56 [O-]P(O)(=O)CSCC(O)=O Amb22453470 [1,1,0,0,0,0|2,0,0]=4 2055 B9R0.21 COC(=O)CCC(C)(C)O Amb25687794 [0,1,0,0,1,0|1,0,1]=4 2056 B9R0.21 COC(=O)CCP(O)(O)=O Amb22388887 [0,1,0,0,1,0|1,0,0]=3 2057 B9R0.21 COC(=O)CCS(=O)(=O)F Amb25830336 [0,1,0,0,1,0|1,0,1]=4 2058 B9R0.21 COC(=O)CCS(=O)(=O)N Amb1131761 [0,1,0,0,1,0|1,0,1]=4 2059 B9R0.21 COC(=O)CCS(=O)(=O)O Amb17400246 [0,1,0,0,1,0|1,0,0]=3 2060 B9R0.21 COC(=O)CCS(C)(=O)=O Amb18177820 [0,1,0,0,1,0|1,0,1]=4 2061 B9R0.23 CC(=C)CC(O)C(=O)OC Amb24464009 [0,1,0,0,1,0|2,0,0]=4 2062 B9R0.23 CC(=C)C[C@H](N)C(=O)OC Amb25200054 [0,1,0,0,1,0|2,0,0]=4 2063 B9R0.23 CC(=CC(O)=O)C(=O)OC Amb24362654 [0,1,0,0,1,0|0,0,2]=4 2064 B9R0.23 CC(=O)CC(=C)C(=O)OC Amb25146670 [0,1,0,0,1,0|1,0,1]=4 2065 B9R0.23 CC(=O)CC(N)C(=O)OC Amb25367296 [0,1,0,0,1,0|1,0,0]=3 2066 B9R0.23 CC(=O)CC(O)C(=O)CC Amb25767775 [0,1,0,0,1,0|2,0,0]=4 2067 B9R0.23 CC(=O)C[C@@H](O)C(=O)OC Amb24408458 [0,1,0,0,1,0|1,0,0]=3 2068 B9R0.23 CC(=O)C[C@H](O)C(=O)OC Amb25146504 [0,1,0,0,1,0|1,0,0]=3 2069 B9R0.23 CC(=O)NC(Br)C(=O)OC Amb24434913 [0,1,0,0,1,0|2,0,0]=4 2070 B9R0.23 CC(=O)NC(C)C(=O)OC Amb24650565 [0,1,0,0,1,0|2,0,0]=4 2071 B9R0.23 CC(=O)NC(O)C(=O)OC Amb25147262 [0,1,0,0,1,0|2,0,0]=4 2072 B9R0.23 CC(=O)OC(C)C(=O)OC Amb24719402 [0,1,0,0,1,0|2,0,0]=4 2073 B9R0.23 CC(=O)O[C@@H](C)C(=O)OC Amb24397827 [0,1,0,0,1,0|2,0,0]=4 2074 B9R0.23 CC(C(=O)NC)CC(=O)N Amb17334220 [0,1,0,0,1,0|2,0,0]=4 2075 B9R0.23 CC(CC(C)O)C(=O)OC Amb25781081 [0,1,0,0,1,0|1,0,1]=4 2076 B9R0.23 CC(CC(O)=O)C(=O)CN Amb25072734 [0,1,0,0,1,0|2,0,0]=4 2077 B9R0.23 CC(OC)C(C)CC(O)=O Amb18202340 [0,1,0,0,1,0|1,0,1]=4 2078 B9R0.23 CCC(=C)C(N)CC(O)=O Amb25068441 [0,1,0,0,1,0|2,0,0]=4 2079 B9R0.23 CCC(=O)[C@@H](C)CC(O)=O Amb24504994 [0,1,0,0,1,0|1,0,0]=3 2080 B9R0.23 CCC(=O)[C@H](C)CC(O)=O Amb24426900 [0,1,0,0,1,0|1,0,0]=3 2081 B9R0.23 CCS(=O)C(C)CC(O)=O Amb19012075 [0,1,0,0,1,0|2,0,0]=4 2082 B9R0.23 CN(C(=O)CC)CC(=O)O Amb1113094 [0,1,0,0,1,0|2,0,0]=4 2083 B9R0.23 CN(CC(O)=O)C(=S)OC Amb24514158 [0,1,0,0,1,0|1,1,0]=4 2084 B9R0.23 CNC(=O)C(N)CC(N)=O Amb18968977 [0,1,0,0,1,0|2,0,0]=4 2085 B9R0.23 CNC(=O)C(N)CC(O)=O Amb18862479 [0,1,0,0,1,0|1,0,0]=3 2086 B9R0.23 CNC(=O)[C@@H](N)CC(O)=O Amb25694374 [0,1,0,0,1,0|1,0,0]=3 2087 B9R0.23 COC(=O)C(=C)CC(N)=O Amb25757986 [0,1,0,0,1,0|1,0,1]=4 2088 B9R0.23 COC(=O)C(=O)CC(=O)C Amb1155424 [0,1,0,0,1,0|1,0,1]=4 2089 B9R0.23 COC(=O)C(Br)CC(N)=O Amb24728398 [0,1,0,0,1,0|1,0,0]=3 2090 B9R0.23 COC(=O)C(Br)CC(O)=O Amb18656999 [0,1,0,0,1,0|0,0,0]=2 2091 B9R0.23 COC(=O)C(C)CC(=O)Cl Amb24648102 [0,1,0,0,1,0|1,0,0]=3 2092 B9R0.23 COC(=O)C(C)CC(N)=N Amb25178681 [0,1,0,0,1,0|2,0,0]=4 2093 B9R0.23 COC(=O)C(C)CC(N)=O Amb25113876 [0,1,0,0,1,0|1,0,0]=3 2094 B9R0.23 COC(=O)C(C)CC(O)=O Amb18644248 [0,1,0,0,1,0|0,0,0]=2 2095 B9R0.23 COC(=O)C(C)CS(C)=O Amb18788308 [0,1,0,0,1,0|2,0,0]=4 2096 B9R0.23 COC(=O)C(C)NC(N)=O Amb20407420 [0,1,0,0,1,0|2,0,0]=4 2097 B9R0.23 COC(=O)C(CC(=O)N)N Amb16243083 [0,1,0,0,1,0|1,0,0]=3 2098 B9R0.23 COC(=O)C(CC(=O)N)N Amb17601698 [0,1,0,0,1,0|1,0,0]=3 2099 B9R0.23 COC(=O)C(CC(=O)O)O Amb17615865 [0,1,0,0,1,0|0,0,0]=2 2100 B9R0.23 COC(=O)C(Cl)OC(=O)Cl Amb25711657 [0,1,0,0,1,0|2,0,0]=4 2101 B9R0.23 COC(=O)C(N)CC(=C)Br Amb24630384 [0,1,0,0,1,0|2,0,0]=4 2102 B9R0.23 COC(=O)C(N)CC(=C)Cl Amb18645938 [0,1,0,0,1,0|2,0,0]=4 2103 B9R0.23 COC(=O)C(N)CC(O)=O Amb18644309 [0,1,0,0,1,0|0,0,0]=2 2104 B9R0.23 COC(=O)C(O)CN(C)O Amb24713209 [0,1,0,0,1,0|2,0,0]=4 2105 B9R0.23 COC(=O)C(O)CS(C)=O Amb25369004 [0,1,0,0,1,0|2,0,0]=4 2106 B9R0.23 COC(=O)[C@@H](C)CC(N)=O Amb24351411 [0,1,0,0,1,0|1,0,0]=3 2107 B9R0.23 COC(=O)[C@@H](C)CC(O)=O Amb22226152 [0,1,0,0,1,0|0,0,0]=2 2108 B9R0.23 COC(=O)[C@@H](C)NC(N)=O Amb24400792 [0,1,0,0,1,0|2,0,0]=4 2109 B9R0.23 COC(=O)[C@@H](CC(=O)O)O Amb17615866 [0,1,0,0,1,0|0,0,0]=2 2110 B9R0.23 COC(=O)[C@@H](N)CC(O)=O Amb22746069 [0,1,0,0,1,0|0,0,0]=2 2111 B9R0.23 COC(=O)[C@@H](N)CS(O)=O Amb24592787 [0,1,0,0,1,0|1,0,0]=3 2112 B9R0.23 COC(=O)[C@@H](O)CC(N)=O Amb25147368 [0,1,0,0,1,0|1,0,0]=3 2113 B9R0.23 COC(=O)[C@H](C)CC(N)=O Amb25824598 [0,1,0,0,1,0|1,0,0]=3 2114 B9R0.23 COC(=O)[C@H](C)CC(O)=O Amb24561954 [0,1,0,0,1,0|0,0,0]=2 2115 B9R0.23 COC(=O)[C@H](CC(=O)N)N Amb10844909 [0,1,0,0,1,0|1,0,0]=3 2116 B9R0.23 COC(=O)[C@H](CC(=O)O)O Amb17615867 [0,1,0,0,1,0|0,0,0]=2 2117 B9R0.23 COC(=O)[C@H](N)CC(N)=O Amb19883963 [0,1,0,0,1,0|1,0,0]=3 2118 B9R0.23 COC(=O)[C@H](N)CC(O)=O Amb19944281 [0,1,0,0,1,0|0,0,0]=2 2119 B9R0.23 COC(=O)[C@H](NC(=O)C)C Amb17621817 [0,1,0,0,1,0|2,0,0]=4 2120 B9R0.23 COC(=O)\C(=C\C(=O)O)\Br Amb15695379 [0,1,0,0,1,0|0,0,2]=4 2121 B9R0.23 COC(=O)\C(\Cl)=C/C(O)=O Amb24482175 [0,1,0,0,1,0|0,0,2]=4 2122 B9R0.23 COC(O)C(O)CC(O)=O Amb24650997 [0,1,0,0,1,0|0,0,2]=4 2123 B9R0.23 C\C(=C/C)\C(N)CC(O)=O Amb24377592 [0,1,0,0,1,0|2,0,0]=4 2124 B9R0.23 C\C(=C/C)\C(O)CC(O)=O Amb18644100 [0,1,0,0,1,0|2,0,0]=4 2125 B9R0.23 NC(CC(O)=O)C(=O)O[Na] Amb22352689 [0,1,0,0,1,0|1,0,0]=3 2126 B9R0.23 NC(CC([O-])=O)C(=O)O[Cu+] Amb22540451 [0,1,0,0,1,0|1,0,1]=4 2127 B9R0.23 NCC(=O)C(N)CC(O)=O Amb24745663 [0,1,0,0,1,0|2,0,0]=4 2128 B9R0.23 N[C@@H](CC(O)=O)C(=O)NO Amb25762946 [0,1,0,0,1,0|2,0,0]=4 2129 B9R0.23 OC(=O)CC(C(=O)CBr)Br Amb15772353 [0,1,0,0,1,0|2,0,0]=4 2130 B9R0.23 OC(=O)CC(Cl)C(=O)CCl Amb24426203 [0,1,0,0,1,0|2,0,0]=4 2131 B9R0.23 OC(=O)CC(O)C(=O)CO Amb25124913 [0,1,0,0,1,0|2,0,0]=4 2132 B9R0.23 OC(=O)C[C@H](O)C(=O)CO Amb25259211 [0,1,0,0,1,0|2,0,0]=4 2133 B9R0.42 CC(=O)C(=C)CC(=O)OC Amb24378956 [0,1,0,0,1,0|1,0,1]=4 2134 B9R0.42 CC(=O)C(=O)CC(=O)OC Amb25146895 [0,1,0,0,1,0|1,0,1]=4 2135 B9R0.42 CC(=O)C(C)CC(=O)CC Amb25146752 [0,1,0,0,1,0|2,0,0]=4 2136 B9R0.42 CC(=O)C(C)OC(=O)OC Amb24647748 [0,1,0,0,1,0|2,0,0]=4 2137 B9R0.42 CC(=O)C(Cl)CC(=O)OC Amb25061154 [0,1,0,0,1,0|1,0,0]=3 2138 B9R0.42 CC(=O)C(N)CC(=O)OC Amb24529258 [0,1,0,0,1,0|1,0,0]=3 2139 B9R0.42 CC(=O)C(O)CC(=O)CC Amb24467028 [0,1,0,0,1,0|2,0,0]=4 2140 B9R0.42 CC(=O)C(O)CC(=O)OC Amb25146688 [0,1,0,0,1,0|1,0,0]=3 2141 B9R0.42 CC(=O)[C@H](C)NC(=O)OC Amb24377158 [0,1,0,0,1,0|2,0,0]=4 2142 B9R0.42 CC(C(=O)N)CC(=O)NC Amb17334219 [0,1,0,0,1,0|2,0,0]=4 2143 B9R0.42 CC(C(=O)O)NC(=O)CC Amb1116933 [0,1,0,0,1,0|2,0,0]=4 2144 B9R0.42 CC(C(=O)O)NC(=O)NC Amb1130316 [0,1,0,0,1,0|2,0,0]=4 2145 B9R0.42 CC(CC(=O)CCl)C(O)=O Amb24585160 [0,1,0,0,1,0|2,0,0]=4 2146 B9R0.42 CC(CC(=O)CN)C(O)=O Amb25758299 [0,1,0,0,1,0|2,0,0]=4 2147 B9R0.42 CC(CC(=O)OC)C(C)O Amb25260435 [0,1,0,0,1,0|1,0,1]=4 2148 B9R0.42 CC(CC(F)C(O)=O)OC Amb25298262 [0,1,0,0,1,0|1,0,1]=4 2149 B9R0.42 CC(CC(N)C(O)=O)OC Amb25147752 [0,1,0,0,1,0|1,0,1]=4 2150 B9R0.42 CC(CC(S)C(O)=O)OC Amb24641528 [0,1,0,0,1,0|1,0,1]=4 2151 B9R0.42 CC(C[C@@H](N)C(O)=O)OC Amb24412403 [0,1,0,0,1,0|1,0,1]=4 2152 B9R0.42 CC(O)C(N)CC(=O)OC Amb24466348 [0,1,0,0,1,0|1,0,1]=4 2153 B9R0.42 CC(O)[C@@H](N)CC(=O)OC Amb25315361 [0,1,0,0,1,0|1,0,1]=4 2154 B9R0.42 CCC(=C)CC(C)C(O)=O Amb25342029 [0,1,0,0,1,0|2,0,0]=4 2155 B9R0.42 CCC(=C)CC(O)C(O)=O Amb25200851 [0,1,0,0,1,0|2,0,0]=4 2156 B9R0.42 CCC(=C)C[C@H](C)C(O)=O Amb24384990 [0,1,0,0,1,0|2,0,0]=4 2157 B9R0.42 CCC(=C)C[C@H](N)C(O)=O Amb25694434 [0,1,0,0,1,0|2,0,0]=4 2158 B9R0.42 CCC(=O)CC(N)C(N)=O Amb25129863 [0,1,0,0,1,0|2,0,0]=4 2159 B9R0.42 CCC(=O)CC(N)C(O)=O Amb22546324 [0,1,0,0,1,0|1,0,0]=3 2160 B9R0.42 CCC(=O)CC(N)C(O)=O Amb24479073 [0,1,0,0,1,0|1,0,0]=3 2161 B9R0.42 CCC(=O)C[C@@H](C)C(O)=O Amb24680887 [0,1,0,0,1,0|1,0,0]=3 2162 B9R0.42 CCC(=O)C[C@H](N)C(O)=O Amb24479266 [0,1,0,0,1,0|1,0,0]=3 2163 B9R0.42 CCC(=O)N[C@@H](C)C(O)=O Amb22901053 [0,1,0,0,1,0|2,0,0]=4 2164 B9R0.42 CCC(=O)OC(C)C(O)=O Amb18644241 [0,1,0,0,1,0|2,0,0]=4 2165 B9R0.42 CCS(=O)CC(C)C(O)=O Amb19012076 [0,1,0,0,1,0|2,0,0]=4 2166 B9R0.42 CNC(=O)CC(=C)C(O)=O Amb22269311 [0,1,0,0,1,0|1,0,1]=4 2167 B9R0.42 CNC(=O)CC(N)C(N)=O Amb25284709 [0,1,0,0,1,0|2,0,0]=4 2168 B9R0.42 CNC(=O)C[C@@H](N)C(O)=O Amb20240891 [0,1,0,0,1,0|1,0,0]=3 2169 B9R0.42 CNC(=O)C[C@H](N)C(O)=O Amb20242140 [0,1,0,0,1,0|1,0,0]=3 2170 B9R0.42 CNC(=O)N[C@@H](C)C(O)=O Amb24478025 [0,1,0,0,1,0|2,0,0]=4 2171 B9R0.42 CNC(=O)N[C@H](C)C(O)=O Amb24558529 [0,1,0,0,1,0|2,0,0]=4 2172 B9R0.42 COC(=O)CC(=C)C(N)=O Amb24655917 [0,1,0,0,1,0|1,0,1]=4 2173 B9R0.42 COC(=O)CC(=O)C(O)=O Amb22728219 [0,1,0,0,1,0|0,0,1]=3 2174 B9R0.42 COC(=O)CC(Br)C(O)=O Amb18656998 [0,1,0,0,1,0|0,0,0]=2 2175 B9R0.42 COC(=O)CC(C(=O)C)Br Amb17403794 [0,1,0,0,1,0|1,0,0]=3 2176 B9R0.42 COC(=O)CC(C)C(N)=O Amb24604307 [0,1,0,0,1,0|1,0,0]=3 2177 B9R0.42 COC(=O)CC(C)C(O)=O Amb18644239 [0,1,0,0,1,0|0,0,0]=2 2178 B9R0.42 COC(=O)CC(C)S(C)=O Amb18788309 [0,1,0,0,1,0|2,0,0]=4 2179 B9R0.42 COC(=O)CC(N)C(O)=O Amb22489498 [0,1,0,0,1,0|0,0,0]=2 2180 B9R0.42 COC(=O)CC(O)C(O)=O Amb25786182 [0,1,0,0,1,0|0,0,0]=2 2181 B9R0.42 COC(=O)C[C@@H](C(=O)O)N Amb13884879 [0,1,0,0,1,0|0,0,0]=2 2182 B9R0.42 COC(=O)C[C@@H](C)C(=O)Cl Amb24556752 [0,1,0,0,1,0|1,0,0]=3 2183 B9R0.42 COC(=O)C[C@@H](N)C(O)=O Amb22745861 [0,1,0,0,1,0|0,0,0]=2 2184 B9R0.42 COC(=O)C[C@@H](O)C(O)=O Amb23603858 [0,1,0,0,1,0|0,0,0]=2 2185 B9R0.42 COC(=O)C[C@H](Br)C(N)=O Amb25326024 [0,1,0,0,1,0|1,0,0]=3 2186 B9R0.42 COC(=O)C[C@H](O)C(O)=O Amb25367304 [0,1,0,0,1,0|0,0,0]=2 2187 B9R0.42 COC(=O)C[C@H]([NH3+])C(=O)O Amb10574406 [0,1,0,0,1,0|0,0,0]=2 2188 B9R0.42 COC(=O)NC(C)C(=O)Cl Amb25365583 [0,1,0,0,1,0|2,0,0]=4 2189 B9R0.42 COC(=O)NC(C)C(N)=O Amb24459048 [0,1,0,0,1,0|2,0,0]=4 2190 B9R0.42 COC(=O)N[C@@H](C)C(O)=O Amb24477985 [0,1,0,0,1,0|1,0,0]=3 2191 B9R0.42 COC(=O)N[C@H](C)C(=O)Cl Amb24505067 [0,1,0,0,1,0|2,0,0]=4 2192 B9R0.42 COC(=O)N[C@H](C)C(O)=O Amb24381066 [0,1,0,0,1,0|1,0,0]=3 2193 B9R0.42 COC(=S)NC(C)C(O)=O Amb24740723 [0,1,0,0,1,0|1,1,0]=4 2194 B9R0.42 COC(=S)N[C@@H](C)C(O)=O Amb25088529 [0,1,0,0,1,0|1,1,0]=4 2195 B9R0.42 CO[C@@H](C)C[C@H](C)C(O)=O Amb24691586 [0,1,0,0,1,0|1,0,1]=4 2196 B9R0.42 C[C@@H](CC(=O)OC)[C@H](C)O Amb25206323 [0,1,0,0,1,0|1,0,1]=4 2197 B9R0.42 C\C(=C/C(=O)OC)\C(O)=O Amb18644070 [0,1,0,0,1,0|0,0,2]=4 2198 B9R0.42 C\C(=C\C(=O)OC)\C(O)=O Amb24670134 [0,1,0,0,1,0|0,0,2]=4 2199 B9R0.42 C\C(\CC(N)C(O)=O)=C/C Amb24587021 [0,1,0,0,1,0|2,0,0]=4 2200 B9R0.42 C\C(\C[C@H](N)C(O)=O)=C\C Amb24746992 [0,1,0,0,1,0|2,0,0]=4 2201 B9R0.42 NC(CC(=O)CBr)C(O)=O Amb24477386 [0,1,0,0,1,0|2,0,0]=4 2202 B9R0.42 NC(CC(=O)CCl)C(O)=O Amb24061070 [0,1,0,0,1,0|2,0,0]=4 2203 B9R0.42 NC(CC(=O)CO)C(O)=O Amb18644310 [0,1,0,0,1,0|2,0,0]=4 2204 B9R0.42 NC(CC(=O)NCl)C(O)=O Amb24454054 [0,1,0,0,1,0|2,0,0]=4 2205 B9R0.42 NC(CC(=O)NO)C(O)=O Amb22349932 [0,1,0,0,1,0|2,0,0]=4 2206 B9R0.42 NCC(=O)CC(F)C(O)=O Amb25367166 [0,1,0,0,1,0|2,0,0]=4 2207 B9R0.42 NCC(=O)CC(N)C(O)=O Amb24462002 [0,1,0,0,1,0|2,0,0]=4 2208 B9R0.42 NCC(=O)C[C@H](N)C(O)=O Amb25757838 [0,1,0,0,1,0|2,0,0]=4 2209 B9R0.42 NNC(=O)C[C@H](N)C(O)=O Amb24680907 [0,1,0,0,1,0|2,0,0]=4 2210 B9R0.42 N[C@@H](CC(=O)CBr)C(O)=O Amb24477399 [0,1,0,0,1,0|2,0,0]=4 2211 B9R0.42 N[C@H](CC(=O)NO)C(O)=O Amb24451287 [0,1,0,0,1,0|2,0,0]=4 2212 B9R0.42 OC(=O)C(O)CC(=O)CBr Amb24477419 [0,1,0,0,1,0|2,0,0]=4 2213 B9R0.43 CC(=O)CC\C(\C=O)=C\C Amb18643605 [0,1,0,0,1,0|2,0,0]=4 2214 B9R0.43 CCC(CCC(O)=O)=CC Amb24480728 [0,1,0,0,1,0|2,0,0]=4 2215 B9R0.43 CCC(CCC(O)=O)C=O Amb25378745 [0,1,0,0,1,0|1,0,1]=4 2216 B9R0.43 CCN(CCC(O)=O)C=O Amb19010092 [0,1,0,0,1,0|2,0,0]=4 2217 B9R0.43 CCN(CCC(O)=O)N=O Amb24659873 [0,1,0,0,1,0|2,0,0]=4 2218 B9R0.43 COC(CCC(O)=O)OC Amb24657204 [0,1,0,0,1,0|0,0,2]=4 2219 B9R0.43 CO[C@H](CN)CCC(O)=O Amb24544386 [0,1,0,0,1,0|1,0,1]=4 2220 B9R0.64 COP(C)(=O)CCC(C)=O Amb25707535 [0,1,0,0,1,0|2,0,0]=4 2221 B9R0.64 COP(C)(=O)CCC(N)=O Amb24633997 [0,1,0,0,1,0|2,0,0]=4 2222 B9R0.64 COP(C)(=O)CCC(O)=O Amb25288153 [0,1,0,0,1,0|1,0,0]=3 2223 B9R0.64 COP(O)(=O)CCC(C)=O Amb24435493 [0,1,0,0,1,0|2,0,0]=4 2224 B11R0.29 CC(C(=O)NCCCC(=O)O)C Amb1113944 [0,1,0,0,0,1|1,0,0]=3 2225 B11R0.93 COC(=O)CC(=O)NCC(=O)C Amb2234019 [0,1,0,0,0,1|1,0,1]=4 2226 B11R0.93 COC(=O)CC(O)COC(C)=O Amb17778578 [0,1,0,0,0,1|1,0,0]=3 2227 B11R0.106 BrCC(=O)NCCCC(=O)OC Amb17330223 [0,1,0,0,0,1|1,0,0]=3 2228 B11R0.106 COC(=N)CCCCC(=N)OC Amb19951572 [0,1,0,0,0,1|2,0,0]=4 2229 B11R0.106 COC(=N)CCCCC(=N)OC Amb20247180 [0,1,0,0,0,1|2,0,0]=4 2230 B11R0.106 COC(=O)C#CCNC(=O)OC Amb25267881 [0,1,0,0,0,1|0,0,2]=4 2231 B11R0.106 COC(=O)CCCCC(=O)OC Amb22336490 [0,1,0,0,0,1|0,0,0]=2 2232 B11R0.106 COC(=O)CCCCC(=O)OC Amb22338483 [0,1,0,0,0,1|0,0,0]=2 2233 B11R0.106 COC(=O)CCCCC(O)CN Amb23438806 [0,1,0,0,0,1|1,0,1]=4 2234 B11R0.106 COC(=O)CNNCC(=O)OC Amb19651359 [0,1,0,0,0,1|1,0,0]=3 2235 B11R0.106 COC(=O)CNNCC(=O)OC Amb21961490 [0,1,0,0,0,1|1,0,0]=3 2236 B11R0.106 COC(=O)C\C=C\CC(=O)OC Amb17613323 [0,1,0,0,0,1|0,0,1]=3 2237 B11R0.107 COC(=O)CCC(=O)CC(=O)C Amb17334875 [0,1,0,0,0,1|1,0,0]=3 2238 B11R0.109 COC(=O)CCC[C@@H](C(=O)O)N Amb13884888 [0,1,0,0,0,1|0,0,0]=2 2239 B11R0.109 COC(=O)CCC[C@@H](N)C(O)=O Amb23437884 [0,1,0,0,0,1|0,0,0]=2 2240 B11R0.114 COC(=O)CCCCP(O)(O)=O Amb22831923 [0,1,0,0,0,1|1,0,0]=3 2241 B11R0.114 COC(=O)NCCCC(C)(C)O Amb24095878 [0,1,0,0,0,1|1,0,1]=4 2242 B11R0.127 CCS(=O)(=O)NCCCC(=O)O Amb1111445 [0,1,0,0,0,1|2,0,0]=4 2243 B11R0.176 CCCC(=O)OCCCC(=O)C Amb1033033 [0,1,0,0,0,1|2,0,0]=4 2244 B11R0.176 CCOC(=O)CCCOC(=O)C Amb17613918 [0,1,0,0,0,1|1,0,0]=3 2245 B11R0.176 COCC(=O)NCCCC(=O)O Amb1119832 [0,1,0,0,0,1|0,0,0]=2 2246 B11R0.1 CC(=O)OC(C)CC(=O)OCC Amb22731089 [0,2,0,0,0,0|2,0,0]=4 2247 B11R0.1 CCOC(=O)CC(=O)CC(=O)C Amb16192546 [0,2,0,0,0,0|1,0,1]=4 2248 B11R0.1 CCOC(=O)C[C@H](C)CC(O)=O Amb22353078 [0,2,0,0,0,0|0,0,0]=2 2249 B11R0.1 CCOC(=O)NC(C)CC(N)=O Amb24103487 [0,2,0,0,0,0|2,0,0]=4 2250 B11R0.6 CC(=O)CC(=O)CCCC(O)=O Amb22347933 [0,2,0,0,0,0|1,0,0]=3 2251 B11R0.6 CC(CC(=O)NCCC(=O)O)C Amb1115700 [0,2,0,0,0,0|2,0,0]=4 2252 B11R0.6 CC(NC(=O)NCCC(=O)O)C Amb1138267 [0,2,0,0,0,0|2,0,0]=4 2253 B11R0.59 CCOC(=O)[C@@H](N)CCC(N)=O Amb22898842 [0,2,0,0,0,0|1,0,0]=3 2254 B11R0.104 NCCS(=O)(=O)CCCC(=O)O Amb17500610 [0,2,0,0,0,0|2,0,0]=4 2255 B11R0.104 OC(=O)CCCS(=O)(=O)CCCl Amb24062755 [0,2,0,0,0,0|2,0,0]=4 2256 B11R0.141 CC#CC(=O)NCC(N)C(O)=O Amb25736458 [0,2,0,0,0,0|2,0,0]=4 2257 B11R0.141 CC(=O)N(C)CCC(=O)OCC Amb18807770 [0,2,0,0,0,0|2,0,0]=4 2258 B11R0.141 CCNC(=O)CC[C@@H](N)C(O)=O Amb19134042 [0,2,0,0,0,0|1,0,0]=3 2259 B11R0.141 CCOC(=O)CC[C@@H](N)C(O)=O Amb22745269 [0,2,0,0,0,0|0,0,0]=2 2260 B11R0.141 NC(CCC(=O)C=N=N)C(O)=O Amb22352148 [0,2,0,0,0,0|2,0,0]=4 2261 B11R0.141 N[C@@H](CCC(=O)C=N=N)C(O)=O Amb22801420 [0,2,0,0,0,0|2,0,0]=4 2262 B11R0.141 [N-]=[N+]=CC(=O)CC[C@@H](C(=O)O)N Amb16183956 [0,2,0,0,0,0|2,0,0]=4 2263 B11R0.141 [N-]=[N+]=CC(=O)CC[C@H](C(=O)O)N Amb17621829 [0,2,0,0,0,0|2,0,0]=4 2264 B11R0.147 C=CCNC(=O)CCCC(=O)O Amb1863934 [0,2,0,0,0,0|1,0,0]=3 2265 B11R0.147 C=CCNC(=O)COCC(=O)O Amb1888827 [0,2,0,0,0,0|2,0,0]=4 2266 B11R0.147 CCCNC(=O)CCCC(=O)O Amb1841483 [0,2,0,0,0,0|1,0,0]=3 2267 B11R0.174 CCC(=O)NCCC(=O)OCC Amb18807768 [0,2,0,0,0,0|2,0,0]=4 2268 B11R0.174 CCCC(=O)NCCC(=O)OC Amb18807759 [0,2,0,0,0,0|2,0,0]=4 2269 B11R0.174 C\C=C\C(=O)NCCC(=O)OC Amb18806843 [0,2,0,0,0,0|2,0,0]=4 2270 B11R0.180 CCOC(=O)CNCP(O)(O)=O Amb22388791 [0,2,0,0,0,0|2,0,0]=4 2271 B11R0.63 CC(=O)S[C@H](C)[C@H](N)C(=O)OC Amb24117265 [0,2,0,0,0,0|2,0,0]=4 2272 B11R0.63 CCC(=O)N(C)C(C)CC(O)=O Amb18862886 [0,2,0,0,0,0|2,0,0]=4 2273 B11R0.92 CNC(=O)NC(C)C(C)C(O)=O Amb25039878 [0,2,0,0,0,0|2,0,0]=4 2274 B11R0.110 CN(CC(=O)OC)CC(=O)OC Amb18808625 [0,2,0,0,0,0|1,0,0]=3 2275 B11R0.110 COC(=O)CC(CC(=O)OC)O Amb10604229 [0,2,0,0,0,0|0,0,0]=2 2276 B11R0.110 COC(=O)CC(N)CC(=O)OC Amb22001699 [0,2,0,0,0,0|0,0,0]=2 2277 B11R0.110 COC(=O)CC(N)CC(=O)OC Amb22436847 [0,2,0,0,0,0|0,0,0]=2 2278 B11R0.110 COC(=O)CC(N)CC(=O)OC Amb22749880 [0,2,0,0,0,0|0,0,0]=2 2279 B11R0.110 C\C(\CC(=O)OC)=C/C(=O)OC Amb22277097 [0,2,0,0,0,0|0,0,2]=4 2280 B11R0.110 C\C(\CC(=O)OC)=C\C(=O)OC Amb22347963 [0,2,0,0,0,0|0,0,2]=4 2281 B11R0.255 COC(=O)CC(C)(C)CC(O)=O Amb18647813 [0,2,0,0,0,0|0,0,0]=2 2282 B11R0.255 COC(=O)CC(C)(C)C[N+]([O-])=O Amb24098385 [0,2,0,0,0,0|1,0,1]=4 2283 B11R0.255 COC(=O)CC(C)(O)CC(O)=O Amb18127556 [0,2,0,0,0,0|0,0,0]=2 2284 B11R0.117 CC(CC(C)C(=O)OC)C(O)=O Amb18647808 [0,2,0,0,0,0|0,0,0]=2 2285 B11R0.120 COC(=O)C(Br)CCC(=O)OC Amb22500129 [0,2,0,0,0,0|0,0,0]=2 2286 B11R0.120 COC(=O)CC[C@H](C(=O)OC)N Amb16183941 [0,2,0,0,0,0|0,0,0]=2 2287 B11R0.120 COC(=O)CNC(=O)C(=O)OC Amb2447278 [0,2,0,0,0,0|1,0,1]=4 2288 B11R0.120 COC(=O)[C@@H](C)CCC(=O)OC Amb22799425 [0,2,0,0,0,0|0,0,0]=2 2289 B11R0.120 COC(=O)[C@H](N)CCC(=O)OC Amb22230568 [0,2,0,0,0,0|0,0,0]=2 2290 B11R0.120 OC(CCC(=O)O[Na])C(=O)O[Na] Amb22371817 [0,2,0,0,0,0|1,0,0]=3 2291 B11R0.173 CC(C(=O)N(CCC(=O)O)C)C Amb17400385 [0,2,0,0,0,0|2,0,0]=4 2292 B11R0.173 CN(C)C(=O)C(N)CCC(N)=O Amb22261475 [0,2,0,0,0,0|2,0,0]=4 2293 B11R0.200 COC(=O)CCCC(OC)OC Amb22338364 [0,2,0,0,0,0|0,0,2]=4 2294 B11R0.320 C[Si](C)(CCCC(=O)OC)OC Amb19893681 [0,2,0,0,0,0|1,1,0]=4 2295 B11R0.202 OC(=O)CCCS(=O)(=O)C(C)C Amb17503667 [0,2,0,0,0,0|2,0,0]=4 2296 B11R0.90 CCC(C(=O)O)SCC(=O)NC Amb17501361 [0,2,0,0,0,0|2,0,0]=4 2297 B11R0.201 CNC(=O)CSC(C(=O)O)(C)C Amb17501509 [0,2,0,0,0,0|2,0,0]=4 2298 B11R0.201 CNC(=O)NCC(C)(C)C(O)=O Amb25286633 [0,2,0,0,0,0|2,0,0]=4 2299 B11R0.201 CNC(=O)NCC(C)(O)C(O)=O Amb25824985 [0,2,0,0,0,0|2,0,0]=4 2300 B11R0.201 COC(=O)CCC(C)(C)C(O)=O Amb18127171 [0,2,0,0,0,0|0,0,0]=2 2301 B11R0.84 O=C(C(C)(C)C)CNCC(=O)O Amb1110578 [0,2,0,0,0,0|2,0,0]=4 2302 B11R0.84 O=C(C(C)(C)C)NCCC(=O)O Amb1119313 [0,2,0,0,0,0|2,0,0]=4 2303 B9R1.1 CC=1CC[C@H](CC1)C=O Amb25811412 [1,0,0,1,0,0|2,0,0]=4 2304 B9R1.1 O=CC1CC=C(Cl)CC1 Amb18124712 [1,0,0,1,0,0|2,0,0]=4 2305 B9R1.1 O=CC1CNC(=O)CS1 Amb25662711 [1,0,0,1,0,0|2,0,0]=4 2306 B9R1.1 O=CN1CCC(=O)CC1 Amb22059518 [1,0,0,1,0,0|2,0,0]=4 2307 B9R1.1 OCC1CCC(=O)CC1 Amb10071596 [1,0,0,1,0,0|1,0,1]=4 2308 B9R1.1 OCC1CNC(=O)CC1 Amb19958990 [1,0,0,1,0,0|1,0,1]=4 2309 B9R1.1 OCC1CNC(=O)OC1 Amb25247634 [1,0,0,1,0,0|1,0,1]=4 2310 B9R1.2 CNC1=CC(=O)CCC1 Amb2386653 [1,0,0,1,0,0|2,0,0]=4 2311 B9R1.2 COC1CC(=O)CCC1 Amb20671002 [1,0,0,1,0,0|1,0,1]=4 2312 B9R1.2 COC=1CCCC(=O)C1 Amb19930192 [1,0,0,1,0,0|1,0,0]=3 2313 B9R1.2 COC=1CNCC(=O)C1 Amb18642502 [1,0,0,1,0,0|2,0,0]=4 2314 B9R1.2 COC=1CSCC(=O)C1 Amb23568684 [1,0,0,1,0,0|2,0,0]=4 2315 B9R1.2 CSC=1CCCC(=O)C1 Amb25735167 [1,0,0,1,0,0|1,1,0]=4 2316 B9R1.3 CC1=C(C)CCCC1=O Amb17593288 [1,0,0,1,0,0|2,0,0]=4 2317 B9R1.3 CC1=C(O)CCCC1=O Amb25147218 [1,0,0,1,0,0|1,0,0]=3 2318 B9R1.3 CC1C(=O)CCCS1=O Amb25802270 [1,0,0,1,0,0|2,0,0]=4 2319 B9R1.3 CC1C(=O)COCC1=O Amb24621297 [1,0,0,1,0,0|2,0,0]=4 2320 B9R1.3 CC1C(=O)NCCC1=O Amb25220145 [1,0,0,1,0,0|2,0,0]=4 2321 B9R1.3 CN1C(=O)CCCC1=O Amb22757472 [1,0,0,1,0,0|1,0,0]=3 2322 B9R1.3 CN1C(=O)CNCC1=O Amb17334097 [1,0,0,1,0,0|2,0,0]=4 2323 B9R1.3 CN1C(=O)CSCC1=O Amb24612532 [1,0,0,1,0,0|2,0,0]=4 2324 B9R1.3 CN1C(=O)SCCC1=O Amb25212420 [1,0,0,1,0,0|2,0,0]=4 2325 B9R1.3 CN1C(O)CCCC1=O Amb25337618 [1,0,0,1,0,0|1,0,1]=4 2326 B9R1.3 C[C@@H]1C(=O)CCCS1=O Amb25319756 [1,0,0,1,0,0|2,0,0]=4 2327 B9R1.3 C[C@H]1[C@@H](O)CCCC1=O Amb24737440 [1,0,0,1,0,0|1,0,1]=4 2328 B9R1.3 NC1C(=O)CCCC1=O Amb24682149 [1,0,0,1,0,0|2,0,0]=4 2329 B9R1.3 NN1C(=O)CCCC1=O Amb25130901 [1,0,0,1,0,0|2,0,0]=4 2330 B9R1.3 O=C1CCCC(=O)C1Br Amb2459664 [1,0,0,1,0,0|2,0,0]=4 2331 B9R1.3 O=C1CCCC(=O)C1Cl Amb25726716 [1,0,0,1,0,0|2,0,0]=4 2332 B9R1.3 O=C1CCCC(=O)C1F Amb25143046 [1,0,0,1,0,0|2,0,0]=4 2333 B9R1.3 OC=1CCCC(=O)C1S Amb25792989 [1,0,0,1,0,0|2,0,0]=4 2334 B9R1.5 CC1OCCCCC1=O Amb25825779 [1,0,0,1,0,0|1,0,1]=4 2335 B9R1.7 C=CCC1CNC(=O)C1 Amb25694415 [1,0,0,1,0,0|2,0,0]=4 2336 B9R1.7 C=CCC1COC(=O)N1 Amb24532876 [1,0,0,1,0,0|2,0,0]=4 2337 B9R1.7 C=CC[C@@H]1CC(=O)CC1 Amb25358940 [1,0,0,1,0,0|2,0,0]=4 2338 B9R1.7 C=CC[C@@H]1COC(=O)N1 Amb25329003 [1,0,0,1,0,0|2,0,0]=4 2339 B9R1.7 C=CC[C@H]1CC(=O)CC1 Amb24613923 [1,0,0,1,0,0|2,0,0]=4 2340 B9R1.7 O=CCC1CC(=O)CC1 Amb18642410 [1,0,0,1,0,0|1,0,0]=3 2341 B9R1.7 O=CCC1COC(=O)C1 Amb24633507 [1,0,0,1,0,0|0,0,0]=2 2342 B9R1.7 O=CCC1COC(=O)N1 Amb18642692 [1,0,0,1,0,0|1,0,0]=3 2343 B9R1.7 O=CC[C@@H]1COC(=O)N1 Amb24524150 [1,0,0,1,0,0|1,0,0]=3 2344 B9R1.7 O=CNC1CNC(=O)C1 Amb25742374 [1,0,0,1,0,0|2,0,0]=4 2345 B9R1.7 OCCC1CC(=O)CC1 Amb24467811 [1,0,0,1,0,0|1,0,1]=4 2346 B9R1.7 OCCC1CNC(=O)C1 Amb23598230 [1,0,0,1,0,0|1,0,1]=4 2347 B9R1.7 OCCC1COC(=O)C1 Amb24577239 [1,0,0,1,0,0|0,0,1]=3 2348 B9R1.7 OCCC1COC(=O)N1 Amb24477775 [1,0,0,1,0,0|1,0,1]=4 2349 B9R1.7 OCC[C@@H]1CC(=O)CC1 Amb24750224 [1,0,0,1,0,0|1,0,1]=4 2350 B9R1.7 OCC[C@@H]1COC(=O)N1 Amb25354215 [1,0,0,1,0,0|1,0,1]=4 2351 B9R1.7 OCC[C@H]1COC(=O)C1 Amb25740657 [1,0,0,1,0,0|0,0,1]=3 2352 B9R1.7 OCC[C@H]1COC(=O)N1 Amb24649331 [1,0,0,1,0,0|1,0,1]=4 2353 B9R1.11 CCC(=O)C1CCC=C1 Amb25094264 [1,0,0,1,0,0|2,0,0]=4 2354 B9R1.11 CCC(=O)C1CCCO1 Amb23590157 [1,0,0,1,0,0|1,0,1]=4 2355 B9R1.11 COC(=O)C1CC=CN1 Amb24406652 [1,0,0,1,0,0|1,0,1]=4 2356 B9R1.11 COC(=O)C1CC=NO1 Amb25145656 [1,0,0,1,0,0|1,0,1]=4 2357 B9R1.11 COC(=O)C1CCC=C1 Amb23456135 [1,0,0,1,0,0|1,0,0]=3 2358 B9R1.11 COC(=O)C1CCC=N1 Amb25106874 [1,0,0,1,0,0|1,0,0]=3 2359 B9R1.11 COC(=O)C1CCCS1 Amb23590656 [1,0,0,1,0,0|0,1,1]=4 2360 B9R1.11 COC(=O)C1CCC[NH2+]1 Amb22045239 [1,0,0,1,0,0|1,0,1]=4 2361 B9R1.11 COC(=O)C1CCN=N1 Amb24062008 [1,0,0,1,0,0|2,0,0]=4 2362 B9R1.11 COC(=O)C1CCNO1 Amb24607719 [1,0,0,1,0,0|1,0,0]=3 2363 B9R1.11 COC(=O)C1CNC=N1 Amb20668156 [1,0,0,1,0,0|2,0,0]=4 2364 B9R1.11 COC(=O)C1CNC=N1 Amb23454652 [1,0,0,1,0,0|2,0,0]=4 2365 B9R1.11 COC(=O)C1COCC1 Amb10610344 [1,0,0,1,0,0|2,0,0]=4 2366 B9R1.11 COC(=O)C1CSC=N1 Amb24099788 [1,0,0,1,0,0|2,0,0]=4 2367 B9R1.11 COC(=O)C1CSCC1 Amb24598032 [1,0,0,1,0,0|2,0,0]=4 2368 B9R1.11 COC(=O)C1NCC=C1 Amb17621965 [1,0,0,1,0,0|2,0,0]=4 2369 B9R1.11 COC(=O)N1CCC=C1 Amb17843576 [1,0,0,1,0,0|2,0,0]=4 2370 B9R1.11 COC(=O)[C@@H]1C=CCN1 Amb22800018 [1,0,0,1,0,0|2,0,0]=4 2371 B9R1.11 COC(=O)[C@@H]1CCCO1 Amb25113406 [1,0,0,1,0,0|0,0,1]=3 2372 B9R1.11 COC(=O)[C@@H]1CNCC1 Amb22405890 [1,0,0,1,0,0|2,0,0]=4 2373 B9R1.11 COC(=O)[C@@H]1CNCC1 Amb22744897 [1,0,0,1,0,0|2,0,0]=4 2374 B9R1.11 COC(=O)[C@@H]1COCC1 Amb23439173 [1,0,0,1,0,0|2,0,0]=4 2375 B9R1.11 COC(=O)[C@H]1CCCN1 Amb10844896 [1,0,0,1,0,0|1,0,1]=4 2376 B9R1.11 COC(=O)[C@H]1CCCS1 Amb24061418 [1,0,0,1,0,0|0,1,1]=4 2377 B9R1.11 COC(=O)[C@H]1CNCC1 Amb20241764 [1,0,0,1,0,0|2,0,0]=4 2378 B9R1.11 COC(=O)[C@H]1CNCC1 Amb22225397 [1,0,0,1,0,0|2,0,0]=4 2379 B9R1.11 COC(=O)[C@H]1CNCC1 Amb22405891 [1,0,0,1,0,0|2,0,0]=4 2380 B9R1.11 COC(=O)[C@H]1NCC=C1 Amb16183938 [1,0,0,1,0,0|2,0,0]=4 2381 B9R1.39 O=CCCN1CCC1=O Amb25216243 [1,0,0,1,0,0|2,0,0]=4 2382 B9R1.49 C=C1CCCC(=O)CC1 Amb24633527 [1,0,0,1,0,0|2,0,0]=4 2383 B9R1.49 O=C1CCC(=O)NCC1 Amb22490261 [1,0,0,1,0,0|2,0,0]=4 2384 B9R1.49 O=C1CCC(=O)OCC1 Amb25723209 [1,0,0,1,0,0|2,0,0]=4 2385 B9R1.49 O=C1CCCC(=O)CC1 Amb25797316 [1,0,0,1,0,0|1,0,0]=3 2386 B9R1.49 O=C1CNC(=O)CCC1 Amb25144028 [1,0,0,1,0,0|1,0,0]=3 2387 B9R1.49 O=C1CNC(=O)CCN1 Amb24715756 [1,0,0,1,0,0|2,0,0]=4 2388 B9R1.49 O=C1CNC(=O)NCC1 Amb25772112 [1,0,0,1,0,0|2,0,0]=4 2389 B9R1.49 OC1CNC(=O)CCC1 Amb22491274 [1,0,0,1,0,0|1,0,1]=4 2390 B9R1.49 O[C@@H]1CCCC(=O)CC1 Amb24689806 [1,0,0,1,0,0|1,0,1]=4 2391 B9R1.50 O=C1CCCC=CCC1 Amb22364753 [1,0,0,1,0,0|2,0,0]=4 2392 B9R1.50 O=C1CCOCCCC1 Amb25032168 [1,0,0,1,0,0|1,0,1]=4 2393 B9R1.79 COC(=O)CC1CNC1 Amb21960730 [1,0,0,1,0,0|2,0,0]=4 2394 B9R1.79 COC(=O)CC1CNC1 Amb21962978 [1,0,0,1,0,0|2,0,0]=4 2395 B9R1.79 COC(=O)CC1CNC1 Amb22057369 [1,0,0,1,0,0|2,0,0]=4 2396 B9R1.79 COC(=O)CC1COC1 Amb21960725 [1,0,0,1,0,0|2,0,0]=4 2397 B9R1.80 COC(=O)CCC1CC1 Amb24615342 [1,0,0,1,0,0|1,0,1]=4 2398 B9R1.80 COC(=O)CCC1CO1 Amb25377501 [1,0,0,1,0,0|0,0,1]=3 2399 B9R1.81 CC1CCC1C(=O)OC Amb25110041 [1,0,0,1,0,0|1,0,1]=4 2400 B9R1.81 CCC(=O)N1CCC1=O Amb25190242 [1,0,0,1,0,0|2,0,0]=4 2401 B9R1.81 COC(=O)C1CCC1N Amb25363640 [1,0,0,1,0,0|1,0,1]=4 2402 B9R1.81 COC(=O)C1CCC1O Amb24448430 [1,0,0,1,0,0|0,0,1]=3 2403 B9R1.81 COC(=O)C1CNC1=O Amb24665696 [1,0,0,1,0,0|1,0,0]=3 2404 B9R1.81 COC(=O)N1CCC1=O Amb24078326 [1,0,0,1,0,0|1,0,0]=3 2405 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb22232595 [1,0,0,1,0,0|1,0,1]=4 2406 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb23439308 [1,0,0,1,0,0|1,0,1]=4 2407 B9R1.81 COC(=O)[C@@H]1CC[C@H]1Cl Amb24635677 [1,0,0,1,0,0|1,0,1]=4 2408 B9R1.81 COC(=O)[C@H]1CC[C@@H]1N Amb25261158 [1,0,0,1,0,0|1,0,1]=4 2409 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb22232608 [1,0,0,1,0,0|1,0,1]=4 2410 B9R1.81 COC(=O)[C@H]1NCC1=O Amb24471980 [1,0,0,1,0,0|1,0,0]=3 2411 B9R1.81 COC(=O)[C@H]1NC[C@H]1O Amb24573017 [1,0,0,1,0,0|1,0,1]=4 2412 B9R1.81 C[C@H]1CC[C@H]1C(=O)OC Amb24559896 [1,0,0,1,0,0|1,0,1]=4 2413 B9R1.88 CCC1CC1C(=O)OC Amb24601476 [1,0,0,1,0,0|1,0,1]=4 2414 B9R1.88 CNC(=O)C1CC1C=C Amb22356831 [1,0,0,1,0,0|2,0,0]=4 2415 B9R1.88 COC(=O)C1CC1C=C Amb24387009 [1,0,0,1,0,0|1,0,0]=3 2416 B9R1.88 COC(=O)C1CC1C=O Amb24480363 [1,0,0,1,0,0|0,0,0]=2 2417 B9R1.88 COC(=O)C1CC1CBr Amb25122701 [1,0,0,1,0,0|1,0,1]=4 2418 B9R1.88 COC(=O)C1CC1CN Amb22011650 [1,0,0,1,0,0|1,0,1]=4 2419 B9R1.88 COC(=O)C1CC1CN Amb22546318 [1,0,0,1,0,0|1,0,1]=4 2420 B9R1.88 COC(=O)C1CC1CO Amb25185377 [1,0,0,1,0,0|0,0,1]=3 2421 B9R1.88 COC(=O)[C@@H]1CC1CO Amb25831869 [1,0,0,1,0,0|0,0,1]=3 2422 B9R1.88 COC(=O)[C@@H]1C[C@@H]1C=O Amb24617207 [1,0,0,1,0,0|0,0,0]=2 2423 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CN Amb22900923 [1,0,0,1,0,0|1,0,1]=4 2424 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CO Amb24575289 [1,0,0,1,0,0|0,0,1]=3 2425 B9R1.88 COC(=O)[C@@H]1C[C@H]1C#N Amb24579735 [1,0,0,1,0,0|1,0,1]=4 2426 B9R1.88 COC(=O)[C@@H]1C[C@H]1CN Amb24517267 [1,0,0,1,0,0|1,0,1]=4 2427 B9R1.88 COC(=O)[C@@H]1O[C@H]1CO Amb24107515 [1,0,0,1,0,0|1,0,1]=4 2428 B9R1.88 COC(=O)[C@H]1C[C@@H]1C=O Amb24722901 [1,0,0,1,0,0|0,0,0]=2 2429 B9R1.132 CC1C(CCC1=C)C=O Amb18642232 [1,0,0,1,0,0|2,0,0]=4 2430 B9R1.132 CC1[C@@H](CCC1=O)C=C Amb25735168 [1,0,0,1,0,0|2,0,0]=4 2431 B9R1.132 CN1C(CCC1=O)C=C Amb25146894 [1,0,0,1,0,0|2,0,0]=4 2432 B9R1.132 CN1C(CCC1=O)C=O Amb24725330 [1,0,0,1,0,0|1,0,0]=3 2433 B9R1.132 CN1[C@@H](CO)CCC1=O Amb25032258 [1,0,0,1,0,0|1,0,1]=4 2434 B9R1.132 CN1[C@H](CO)CCC1=O Amb25147115 [1,0,0,1,0,0|1,0,1]=4 2435 B9R1.132 C[C@@H]1[C@H](CCC1=O)C=C Amb25205219 [1,0,0,1,0,0|2,0,0]=4 2436 B9R1.132 C[C@H]1[C@@H](CCC1=O)C=O Amb25247204 [1,0,0,1,0,0|1,0,0]=3 2437 B9R1.132 C[C@H]1[C@@H](CCC1=O)CO Amb24582507 [1,0,0,1,0,0|1,0,1]=4 2438 B9R1.132 C[C@H]1[C@H](CCC1=C)C=O Amb25270608 [1,0,0,1,0,0|2,0,0]=4 2439 B9R1.132 C[C@H]1[C@H](CCC1=O)C=C Amb24598896 [1,0,0,1,0,0|2,0,0]=4 2440 B9R1.6 CC(=O)C1CN=CCC1 Amb25073951 [1,0,0,1,0,0|2,0,0]=4 2441 B9R1.6 ClC(=O)C1CCC=CC1 Amb10844648 [1,0,0,1,0,0|2,0,0]=4 2442 B9R1.6 NC(=O)C1CCC=CC1 Amb16231370 [1,0,0,1,0,0|2,0,0]=4 2443 B9R1.6 NC(=O)[C@@H]1CC=CCC1 Amb24182044 [1,0,0,1,0,0|2,0,0]=4 2444 B9R1.6 O=C(Cl)C1CC=COC1 Amb25189711 [1,0,0,1,0,0|1,0,1]=4 2445 B9R1.6 O=C(Cl)C1COCCC1 Amb18280558 [1,0,0,1,0,0|1,0,1]=4 2446 B9R1.6 OC(=O)C1CC=CCO1 Amb18642584 [1,0,0,1,0,0|2,0,0]=4 2447 B9R1.6 OC(=O)C1CC=NCC1 Amb24340500 [1,0,0,1,0,0|2,0,0]=4 2448 B9R1.6 OC(=O)C1CCC=CN1 Amb24640071 [1,0,0,1,0,0|2,0,0]=4 2449 B9R1.6 OC(=O)C1CCC=CO1 Amb10071565 [1,0,0,1,0,0|2,0,0]=4 2450 B9R1.6 OC(=O)C1CCCNC1 Amb1151304 [1,0,0,1,0,0|1,0,1]=4 2451 B9R1.6 OC(=O)C1CCCOC1 Amb1102367 [1,0,0,1,0,0|0,0,1]=3 2452 B9R1.6 OC(=O)C1CNC=NC1 Amb25146022 [1,0,0,1,0,0|2,0,0]=4 2453 B9R1.6 OC(=O)C1COCCN1 Amb10607157 [1,0,0,1,0,0|1,0,1]=4 2454 B9R1.6 OC(=O)C1CSCCC1 Amb18202321 [1,0,0,1,0,0|0,1,1]=4 2455 B9R1.6 OC(=O)[C@@H]1CC=CCC1 Amb19131346 [1,0,0,1,0,0|1,0,0]=3 2456 B9R1.6 OC(=O)[C@@H]1CCC=CC1 Amb17611453 [1,0,0,1,0,0|1,0,0]=3 2457 B9R1.6 OC(=O)[C@@H]1CCC=CN1 Amb19888332 [1,0,0,1,0,0|2,0,0]=4 2458 B9R1.6 OC(=O)[C@@H]1CCCNC1 Amb16232354 [1,0,0,1,0,0|1,0,1]=4 2459 B9R1.6 OC(=O)[C@@H]1COCCC1 Amb24118033 [1,0,0,1,0,0|0,0,1]=3 2460 B9R1.6 OC(=O)[C@@H]1COCCN1 Amb10576585 [1,0,0,1,0,0|1,0,1]=4 2461 B9R1.6 OC(=O)[C@@H]1COCCO1 Amb23438856 [1,0,0,1,0,0|1,0,1]=4 2462 B9R1.6 OC(=O)[C@H]1CC=CCN1 Amb25757299 [1,0,0,1,0,0|2,0,0]=4 2463 B9R1.6 OC(=O)[C@H]1CC=CCO1 Amb24455780 [1,0,0,1,0,0|2,0,0]=4 2464 B9R1.6 OC(=O)[C@H]1COCCN1 Amb16232575 [1,0,0,1,0,0|1,0,1]=4 2465 B9R1.9 CCCCC1CC(=O)O1 Amb25202242 [1,0,0,1,0,0|1,0,1]=4 2466 B9R1.9 CO\C=C\C1CC(=O)N1 Amb24375069 [1,0,0,1,0,0|1,0,1]=4 2467 B9R1.9 CO\C=C\[C@@H]1CC(=O)N1 Amb24394055 [1,0,0,1,0,0|1,0,1]=4 2468 B9R1.13 CC(=O)CC1CC=CC1 Amb25337514 [1,0,0,1,0,0|2,0,0]=4 2469 B9R1.13 CC(=O)CC1COCC1 Amb20622791 [1,0,0,1,0,0|1,0,1]=4 2470 B9R1.13 NC(=O)CC1COCC1 Amb25228942 [1,0,0,1,0,0|1,0,1]=4 2471 B9R1.13 O=C(Cl)CC1COCC1 Amb22642272 [1,0,0,1,0,0|1,0,1]=4 2472 B9R1.13 OC(=O)CC1CC=CC1 Amb25673915 [1,0,0,1,0,0|1,0,0]=3 2473 B9R1.13 OC(=O)CC1CCCC1 Amb16192937 [1,0,0,1,0,0|1,0,1]=4 2474 B9R1.13 OC(=O)CC1CSCC1 Amb18202318 [1,0,0,1,0,0|0,1,1]=4 2475 B9R1.13 OC(=O)CN1CC=CC1 Amb24360179 [1,0,0,1,0,0|2,0,0]=4 2476 B9R1.13 OC(=O)C[C@@H]1COCC1 Amb23401495 [1,0,0,1,0,0|0,0,1]=3 2477 B9R1.13 OC(=O)C[C@H]1CCC=C1 Amb25378723 [1,0,0,1,0,0|1,0,1]=4 2478 B9R1.13 OC(=O)C[C@H]1CNCC1 Amb10067024 [1,0,0,1,0,0|1,0,1]=4 2479 B9R1.41 CC1=CCSC1C(O)=O Amb25801334 [1,0,0,1,0,0|2,0,0]=4 2480 B9R1.41 CC1C=CCC1C(O)=O Amb25304598 [1,0,0,1,0,0|1,0,1]=4 2481 B9R1.41 CC1NCCC1C(O)=O Amb18118138 [1,0,0,1,0,0|2,0,0]=4 2482 B9R1.41 CC1OCCC1C(O)=O Amb22059743 [1,0,0,1,0,0|2,0,0]=4 2483 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb17935722 [1,0,0,1,0,0|1,0,1]=4 2484 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb18559228 [1,0,0,1,0,0|1,0,1]=4 2485 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb22748316 [1,0,0,1,0,0|1,0,1]=4 2486 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [1,0,0,1,0,0|1,0,1]=4 2487 B9R1.41 CN1CCC[C@H]1C(O)=O Amb22587172 [1,0,0,1,0,0|1,0,1]=4 2488 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [1,0,0,1,0,0|1,0,1]=4 2489 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [1,0,0,1,0,0|1,0,1]=4 2490 B9R1.41 C[C@@H]1NCC[C@H]1C(O)=O Amb18832568 [1,0,0,1,0,0|2,0,0]=4 2491 B9R1.41 C[C@@H]1OCC[C@@H]1C(O)=O Amb22886528 [1,0,0,1,0,0|2,0,0]=4 2492 B9R1.41 C[C@H]1C=CC[C@@H]1C(O)=O Amb25180008 [1,0,0,1,0,0|1,0,1]=4 2493 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [1,0,0,1,0,0|1,0,1]=4 2494 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [1,0,0,1,0,0|1,0,1]=4 2495 B9R1.41 C[C@H]1NCC[C@@H]1C(O)=O Amb24539923 [1,0,0,1,0,0|2,0,0]=4 2496 B9R1.41 C[C@H]1OCC[C@H]1C(O)=O Amb25253338 [1,0,0,1,0,0|2,0,0]=4 2497 B9R1.41 C[S+]1CCCC1C(O)=O Amb24634112 [1,0,0,1,0,0|0,1,1]=4 2498 B9R1.48 CC=1CC(=O)CCCC1 Amb24686530 [1,0,0,1,0,0|2,0,0]=4 2499 B9R1.59 CCCC1CC1C(O)=O Amb19001459 [1,0,0,1,0,0|1,0,1]=4 2500 B9R1.59 CCC[C@@H]1C[C@H]1C(O)=O Amb25368727 [1,0,0,1,0,0|1,0,1]=4 2501 B9R1.59 CNC[C@@H]1C[C@H]1C(O)=O Amb24744378 [1,0,0,1,0,0|1,0,1]=4 2502 B9R1.59 OC(=O)[C@@H]1C[C@H]1\C=C\Cl Amb25260396 [1,0,0,1,0,0|2,0,0]=4 2503 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [1,0,0,1,0,0|1,0,1]=4 2504 B9R1.84 OC(=O)CNC1COC1 Amb22737320 [1,0,0,1,0,0|1,0,1]=4 2505 B9R1.84 OC(=O)COC1COC1 Amb24539538 [1,0,0,1,0,0|1,0,1]=4 2506 B9R1.85 OC(=O)CCCC1CC1 Amb18832629 [1,0,0,1,0,0|1,0,1]=4 2507 B9R1.85 OC(=O)CCC[C@H]1CO1 Amb24427275 [1,0,0,1,0,0|0,0,1]=3 2508 B9R1.96 CCC1CCC1C(O)=O Amb25727014 [1,0,0,1,0,0|1,0,1]=4 2509 B9R1.96 CCN1CCC1C(O)=O Amb22011877 [1,0,0,1,0,0|2,0,0]=4 2510 B9R1.96 CCN1CC[C@@H]1C(O)=O Amb24634744 [1,0,0,1,0,0|2,0,0]=4 2511 B9R1.96 CCN1CC[C@H]1C(O)=O Amb25347394 [1,0,0,1,0,0|2,0,0]=4 2512 B9R1.96 CNC1CCC1C(O)=O Amb25340658 [1,0,0,1,0,0|1,0,1]=4 2513 B9R1.96 CSC1CCC1C(O)=O Amb25118114 [1,0,0,1,0,0|0,1,1]=4 2514 B9R1.96 C\C=C/1\CNC1C(O)=O Amb25338611 [1,0,0,1,0,0|2,0,0]=4 2515 B9R1.96 C\C=C\1/CN[C@@H]1C(O)=O Amb25075476 [1,0,0,1,0,0|2,0,0]=4 2516 B9R1.35 C=C1CNC(C1)C(O)=O Amb24594868 [1,0,0,1,0,0|2,0,0]=4 2517 B9R1.35 CC(=C)[C@@H]1CC(=O)CC1 Amb25712704 [1,0,0,1,0,0|2,0,0]=4 2518 B9R1.35 CC(=C)[C@@H]1CCC(=O)N1 Amb25142143 [1,0,0,1,0,0|2,0,0]=4 2519 B9R1.35 CC(=O)C1CC(=O)CC1 Amb24423910 [1,0,0,1,0,0|1,0,0]=3 2520 B9R1.35 CC(=O)C1CC(=O)CS1 Amb24061575 [1,0,0,1,0,0|2,0,0]=4 2521 B9R1.35 CC(=O)C1CCC(=O)N1 Amb24432249 [1,0,0,1,0,0|1,0,0]=3 2522 B9R1.35 CC(=O)C1CCC(O)C1 Amb24364135 [1,0,0,1,0,0|1,0,1]=4 2523 B9R1.35 CC(=O)C1CSC(=O)N1 Amb25706778 [1,0,0,1,0,0|2,0,0]=4 2524 B9R1.35 CC(=O)N1CC(=O)CC1 Amb18832698 [1,0,0,1,0,0|2,0,0]=4 2525 B9R1.35 CC(=O)[C@@H]1CC(=O)OC1 Amb18832647 [1,0,0,1,0,0|2,0,0]=4 2526 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [1,0,0,1,0,0|0,0,0]=2 2527 B9R1.35 CC(=O)[C@@H]1CSC(=O)N1 Amb25809473 [1,0,0,1,0,0|2,0,0]=4 2528 B9R1.35 CC(=O)[C@H]1CC(=O)CC1 Amb24407171 [1,0,0,1,0,0|1,0,0]=3 2529 B9R1.35 CC(=O)[C@H]1CC(=O)OC1 Amb24390313 [1,0,0,1,0,0|2,0,0]=4 2530 B9R1.35 CC(=O)[C@H]1CCC(=O)O1 Amb24524212 [1,0,0,1,0,0|0,0,0]=2 2531 B9R1.35 CC(Br)C1CCC(=O)O1 Amb25074658 [1,0,0,1,0,0|1,0,1]=4 2532 B9R1.35 CC(Cl)C1CCC(=O)O1 Amb25060676 [1,0,0,1,0,0|1,0,1]=4 2533 B9R1.35 CC(N)C1CCC(=O)O1 Amb24477799 [1,0,0,1,0,0|1,0,1]=4 2534 B9R1.35 CC1=CC(SC1)C(=O)O Amb10809142 [1,0,0,1,0,0|2,0,0]=4 2535 B9R1.35 CC1=NC(CO1)C(O)=O Amb20621597 [1,0,0,1,0,0|2,0,0]=4 2536 B9R1.35 CC1=NC(CS1)C(O)=O Amb18124720 [1,0,0,1,0,0|2,0,0]=4 2537 B9R1.35 CC1CC(CC1)C(O)=O Amb18642624 [1,0,0,1,0,0|1,0,1]=4 2538 B9R1.35 CC1CCC(N1)C(O)=O Amb18832572 [1,0,0,1,0,0|1,0,1]=4 2539 B9R1.35 CC1CCC(O1)C(=O)O Amb17593370 [1,0,0,1,0,0|0,0,2]=4 2540 B9R1.35 CC1CCC(O1)C(C)=O Amb24580538 [1,0,0,1,0,0|1,0,1]=4 2541 B9R1.35 CC1CCC(S1)C(O)=O Amb25719281 [1,0,0,1,0,0|0,1,1]=4 2542 B9R1.35 CC1CCC([NH2+]1)C(O)=O Amb22372047 [1,0,0,1,0,0|1,0,1]=4 2543 B9R1.35 CC1CC[C@@H](N1)C(O)=O Amb22748252 [1,0,0,1,0,0|1,0,1]=4 2544 B9R1.35 CC=1CC(CC1)C(O)=O Amb18642425 [1,0,0,1,0,0|1,0,1]=4 2545 B9R1.35 CC=1CCC(N1)C(O)=O Amb23438203 [1,0,0,1,0,0|1,0,0]=3 2546 B9R1.35 CC=1CCC([NH+]1)C(O)=O Amb22372048 [1,0,0,1,0,0|1,0,0]=3 2547 B9R1.35 CC=1C[C@H](CC1)C(O)=O Amb24350803 [1,0,0,1,0,0|1,0,1]=4 2548 B9R1.35 CC=1NC(CN1)C(O)=O Amb24599993 [1,0,0,1,0,0|2,0,0]=4 2549 B9R1.35 CN1CCC(N1)C(O)=O Amb25854311 [1,0,0,1,0,0|2,0,0]=4 2550 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22746030 [1,0,0,1,0,0|2,0,0]=4 2551 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22756448 [1,0,0,1,0,0|2,0,0]=4 2552 B9R1.35 CS(=O)C1CC(=O)CC1 Amb25147151 [1,0,0,1,0,0|2,0,0]=4 2553 B9R1.35 C[C@@H]1CC[C@@H](C1)C(=O)O Amb10843961 [1,0,0,1,0,0|1,0,1]=4 2554 B9R1.35 C[C@@H]1CC[C@@H](N1)C(O)=O Amb24399449 [1,0,0,1,0,0|1,0,1]=4 2555 B9R1.35 C[C@@H]1CC[C@@H](O1)C(O)=O Amb22886534 [1,0,0,1,0,0|0,0,2]=4 2556 B9R1.35 C[C@H](N)[C@@H]1CCC(=O)O1 Amb24514821 [1,0,0,1,0,0|1,0,1]=4 2557 B9R1.35 C[C@H](O)[C@@H]1CCC(=O)O1 Amb25240058 [1,0,0,1,0,0|0,0,2]=4 2558 B9R1.35 C[C@H](O)[C@H]1CCC(=O)O1 Amb25236263 [1,0,0,1,0,0|0,0,2]=4 2559 B9R1.35 C[C@H]1CC[C@@H](N1)C(O)=O Amb25260830 [1,0,0,1,0,0|1,0,1]=4 2560 B9R1.35 C[C@H]1CC[C@H](C1)C(=O)O Amb10843955 [1,0,0,1,0,0|1,0,1]=4 2561 B9R1.35 C[C@H]1CC[C@H](N1)C(O)=O Amb24598417 [1,0,0,1,0,0|1,0,1]=4 2562 B9R1.35 C[C@H]1CC[C@H](O1)C(O)=O Amb24651587 [1,0,0,1,0,0|0,0,2]=4 2563 B9R1.35 N=C1CCC(N1)C(O)=O Amb18642592 [1,0,0,1,0,0|2,0,0]=4 2564 B9R1.35 NC(=O)C1CCC(=O)O1 Amb24466803 [1,0,0,1,0,0|1,0,0]=3 2565 B9R1.35 NC(=O)N1CC(=O)CC1 Amb25683940 [1,0,0,1,0,0|2,0,0]=4 2566 B9R1.35 NC(=O)[C@@H]1CCC(=O)O1 Amb25146823 [1,0,0,1,0,0|1,0,0]=3 2567 B9R1.35 NC(=S)[C@@H]1CCC(=O)O1 Amb25146031 [1,0,0,1,0,0|1,1,0]=4 2568 B9R1.35 NC1CCC(C1)C(=O)O Amb10066880 [1,0,0,1,0,0|1,0,1]=4 2569 B9R1.35 NC=1CC[C@H](N1)C(O)=O Amb25346757 [1,0,0,1,0,0|2,0,0]=4 2570 B9R1.35 N[C@@H]1CC(CC1)C(O)=O Amb25700807 [1,0,0,1,0,0|1,0,1]=4 2571 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O Amb10066881 [1,0,0,1,0,0|1,0,1]=4 2572 B9R1.35 N[C@@H]1C[C@@H](CC1)C(O)=O Amb22746692 [1,0,0,1,0,0|1,0,1]=4 2573 B9R1.35 N[C@@H]1C[C@H](CC1)C(O)=O Amb22756038 [1,0,0,1,0,0|1,0,1]=4 2574 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O Amb10066883 [1,0,0,1,0,0|1,0,1]=4 2575 B9R1.35 O=C1CC(CN1)C(=O)Cl Amb24742783 [1,0,0,1,0,0|2,0,0]=4 2576 B9R1.35 O=C1CC(CO1)C(=O)Cl Amb25146217 [1,0,0,1,0,0|2,0,0]=4 2577 B9R1.35 O=C1CC(CS1)C(=O)Cl Amb25689754 [1,0,0,1,0,0|2,0,0]=4 2578 B9R1.35 O=C1CCC(=C1)C(=O)O Amb13883804 [1,0,0,1,0,0|0,0,2]=4 2579 B9R1.35 O=C1CCC(C1)C(=O)Cl Amb25282784 [1,0,0,1,0,0|1,0,0]=3 2580 B9R1.35 O=C1CCC(N1)C(=O)Cl Amb17142869 [1,0,0,1,0,0|2,0,0]=4 2581 B9R1.35 O=C1CCC(N1)C(=O)N Amb17142856 [1,0,0,1,0,0|2,0,0]=4 2582 B9R1.35 O=C1CCC(O1)C(=O)Cl Amb24648754 [1,0,0,1,0,0|1,0,0]=3 2583 B9R1.35 O=C1CC[C@@H](N1)C(=O)Cl Amb24746659 [1,0,0,1,0,0|2,0,0]=4 2584 B9R1.35 O=C1CC[C@@H](O1)C(=O)Cl Amb22747149 [1,0,0,1,0,0|1,0,0]=3 2585 B9R1.35 O=C1CC[C@H](N1)C(=O)O Amb1995036 [1,0,0,1,0,0|1,0,0]=3 2586 B9R1.35 O=C1CC[C@H](O1)C(=O)Cl Amb22388653 [1,0,0,1,0,0|1,0,0]=3 2587 B9R1.35 O=C1CSC(O1)C(=O)Cl Amb25724287 [1,0,0,1,0,0|2,0,0]=4 2588 B9R1.35 O=C1NCC(C1)C(=O)N Amb1803351 [1,0,0,1,0,0|2,0,0]=4 2589 B9R1.35 O=C1NCC(C1)C(=O)O Amb1129202 [1,0,0,1,0,0|1,0,0]=3 2590 B9R1.35 O=C1OCC(N1)C(=O)O Amb15701690 [1,0,0,1,0,0|2,0,0]=4 2591 B9R1.35 O=C1SCC(C1)C(=O)O Amb10073724 [1,0,0,1,0,0|1,0,0]=3 2592 B9R1.35 O=C1SC[C@H](N1)C(=O)O Amb1157856 [1,0,0,1,0,0|2,0,0]=4 2593 B9R1.35 OC(=O)C1CC(=O)CS1 Amb24061425 [1,0,0,1,0,0|1,0,0]=3 2594 B9R1.35 OC(=O)C1CC(=O)NN1 Amb18642739 [1,0,0,1,0,0|2,0,0]=4 2595 B9R1.35 OC(=O)C1CC(=O)OC1 Amb22642307 [1,0,0,1,0,0|1,0,0]=3 2596 B9R1.35 OC(=O)C1CC(Cl)=CC1 Amb23594523 [1,0,0,1,0,0|1,0,1]=4 2597 B9R1.35 OC(=O)C1CC=C(Br)O1 Amb25251659 [1,0,0,1,0,0|1,0,1]=4 2598 B9R1.35 OC(=O)C1CCC(=O)N1 Amb22282321 [1,0,0,1,0,0|1,0,0]=3 2599 B9R1.35 OC(=O)C1CCC(=O)O1 Amb20623076 [1,0,0,1,0,0|0,0,0]=2 2600 B9R1.35 OC(=O)C1CCC(=O)S1 Amb23439315 [1,0,0,1,0,0|0,1,0]=3 2601 B9R1.35 OC(=O)C1CCC(=S)N1 Amb24477679 [1,0,0,1,0,0|1,1,0]=4 2602 B9R1.35 OC(=O)C1CCC(F)C1 Amb22886545 [1,0,0,1,0,0|1,0,1]=4 2603 B9R1.35 OC(=O)C1CCC(I)C1 Amb23456141 [1,0,0,1,0,0|1,0,1]=4 2604 B9R1.35 OC(=O)C1CNC(=O)O1 Amb24112958 [1,0,0,1,0,0|1,0,0]=3 2605 B9R1.35 OC(=O)C1CNC(=O)S1 Amb24084914 [1,0,0,1,0,0|1,1,0]=4 2606 B9R1.35 OC(=O)C1COC(=O)N1 Amb24288785 [1,0,0,1,0,0|2,0,0]=4 2607 B9R1.35 OC(=O)C1COC(=O)O1 Amb25767974 [1,0,0,1,0,0|1,0,0]=3 2608 B9R1.35 OC(=O)C1CSC(=O)S1 Amb23504458 [1,0,0,1,0,0|1,1,0]=4 2609 B9R1.35 OC(=O)C1OC(=O)CS1 Amb25063335 [1,0,0,1,0,0|1,0,0]=3 2610 B9R1.35 OC(=O)[C@@H]1CC(=O)CC1 Amb22746923 [1,0,0,1,0,0|0,0,0]=2 2611 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb19516117 [1,0,0,1,0,0|1,0,0]=3 2612 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb22747440 [1,0,0,1,0,0|1,0,0]=3 2613 B9R1.35 OC(=O)[C@@H]1CC(=O)NC1 Amb23439643 [1,0,0,1,0,0|1,0,0]=3 2614 B9R1.35 OC(=O)[C@@H]1CCC(=O)N1 Amb24099403 [1,0,0,1,0,0|1,0,0]=3 2615 B9R1.35 OC(=O)[C@@H]1CNC(=O)O1 Amb25146207 [1,0,0,1,0,0|1,0,0]=3 2616 B9R1.35 OC(=O)[C@@H]1COC(=O)N1 Amb19517080 [1,0,0,1,0,0|2,0,0]=4 2617 B9R1.35 OC(=O)[C@H]1CC(=O)CN1 Amb25360885 [1,0,0,1,0,0|1,0,0]=3 2618 B9R1.35 OC(=O)[C@H]1CNC(=O)N1 Amb24079612 [1,0,0,1,0,0|2,0,0]=4 2619 B9R1.35 OC(=O)[C@H]1COC(=O)N1 Amb24340149 [1,0,0,1,0,0|2,0,0]=4 2620 B9R1.35 OC1CCC(C1)C(O)=O Amb21963572 [1,0,0,1,0,0|0,0,2]=4 2621 B9R1.35 O[C@@H]1CC[C@@H](C1)C(O)=O Amb22746073 [1,0,0,1,0,0|0,0,2]=4 2622 B9R1.35 O[C@@H]1CC[C@H](C1)C(O)=O Amb22746558 [1,0,0,1,0,0|0,0,2]=4 2623 B9R1.35 O[C@@H]1CC[C@H](N1)C(O)=O Amb24515622 [1,0,0,1,0,0|1,0,1]=4 2624 B9R1.53 CC(=C)CC1CC(=O)N1 Amb25122775 [1,0,0,1,0,0|2,0,0]=4 2625 B9R1.53 CC(=C)C[C@@H]1CC(=O)N1 Amb25368714 [1,0,0,1,0,0|2,0,0]=4 2626 B9R1.53 CC(=O)OC1CC(=O)C1 Amb21961279 [1,0,0,1,0,0|2,0,0]=4 2627 B9R1.53 CC(=O)S[C@@H]1CC(=O)N1 Amb24606560 [1,0,0,1,0,0|2,0,0]=4 2628 B9R1.53 C[C@@H]1C[C@H](CC(O)=O)C1 Amb24372826 [1,0,0,1,0,0|1,0,1]=4 2629 B9R1.53 NC1CC(CC(O)=O)C1 Amb23440231 [1,0,0,1,0,0|1,0,1]=4 2630 B9R1.53 N[C@@H]1C[C@@H](CC(O)=O)C1 Amb23440233 [1,0,0,1,0,0|1,0,1]=4 2631 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb23440232 [1,0,0,1,0,0|1,0,1]=4 2632 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb24056536 [1,0,0,1,0,0|1,0,1]=4 2633 B9R1.53 OC(=O)CC1CC(=O)N1 Amb24351879 [1,0,0,1,0,0|1,0,0]=3 2634 B9R1.53 OC(=O)CC1CC(Cl)C1 Amb25145965 [1,0,0,1,0,0|1,0,1]=4 2635 B9R1.53 OC1CC(C1)CC(O)=O Amb24481941 [1,0,0,1,0,0|0,0,2]=4 2636 B9R1.53 O[C@@H]1C[C@H](C1)CC(O)=O Amb25204858 [1,0,0,1,0,0|0,0,2]=4 2637 B9R1.66 CC1(O)C[13CH2]CC(=O)C1 Amb22367566 [1,0,0,1,0,0|1,0,1]=4 2638 B9R1.66 O=C1CCCS(=O)(=O)C1 Amb13953230 [1,0,0,1,0,0|1,0,1]=4 2639 B9R1.66 OC1(Cl)CC(=O)CCC1 Amb24576033 [1,0,0,1,0,0|1,0,1]=4 2640 B9R1.161 CC(=C)[C@@H]1C[C@@H]1C(O)=O Amb24514832 [1,0,0,1,0,0|1,0,0]=3 2641 B9R1.161 CC(=O)C1CC1C(=C)Cl Amb24340211 [1,0,0,1,0,0|2,0,0]=4 2642 B9R1.161 CC(=O)C1CC1[N+]([O-])=O Amb24332026 [1,0,0,1,0,0|1,0,1]=4 2643 B9R1.161 CC(=O)C1C[C@H]1C(C)=O Amb25319021 [1,0,0,1,0,0|1,0,0]=3 2644 B9R1.161 CC(=O)C1OC1C(O)=O Amb25233192 [1,0,0,1,0,0|1,0,0]=3 2645 B9R1.161 CC(C)C1CC1C(O)=O Amb18285139 [1,0,0,1,0,0|1,0,1]=4 2646 B9R1.161 NC(=O)C1CC1C(=O)O Amb17606123 [1,0,0,1,0,0|1,0,0]=3 2647 B9R1.161 NC(=O)C1OC1C(O)=O Amb25695985 [1,0,0,1,0,0|2,0,0]=4 2648 B9R1.161 NC(=O)[C@@H]1C[C@@H]1C(O)=O Amb24623178 [1,0,0,1,0,0|1,0,0]=3 2649 B9R1.161 NC(=O)[C@@H]1C[C@H]1C(N)=O Amb25273795 [1,0,0,1,0,0|2,0,0]=4 2650 B9R1.161 NC(=O)[C@H]1C[C@@H]1C(N)=O Amb24760759 [1,0,0,1,0,0|2,0,0]=4 2651 B9R1.161 NC(=O)[C@H]1C[C@H]1C(N)=O Amb24671257 [1,0,0,1,0,0|2,0,0]=4 2652 B9R1.161 NC(=O)[C@H]1O[C@H]1C(O)=O Amb25174864 [1,0,0,1,0,0|2,0,0]=4 2653 B9R1.161 OC(=O)C1CC1C(=O)O Amb1350467 [1,0,0,1,0,0|0,0,0]=2 2654 B9R1.161 OC(=O)[C@@H]1C[C@@H]1C(=O)Cl Amb25175103 [1,0,0,1,0,0|1,0,0]=3 2655 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(=O)Cl Amb24402096 [1,0,0,1,0,0|1,0,0]=3 2656 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(O)=O Amb22901897 [1,0,0,1,0,0|0,0,0]=2 2657 B9R1.161 OC(=O)[C@@H]1O[C@H]1C(O)=O Amb22799776 [1,0,0,1,0,0|1,0,0]=3 2658 B9R1.161 OC(=O)[C@H]1O[C@@H]1C(O)=O Amb22262951 [1,0,0,1,0,0|1,0,0]=3 2659 B9R1.161 [O-][N+](=O)[C@@H]1C[C@H]1C(O)=O Amb25109456 [1,0,0,1,0,0|1,0,1]=4 2660 B9R1.161 [O-][N+](=O)[C@H]1C[C@H]1C(O)=O Amb25755764 [1,0,0,1,0,0|1,0,1]=4 2661 B9R1.166 CC(=O)C1CCS1(=O)=O Amb25189242 [1,0,0,1,0,0|1,0,1]=4 2662 B9R1.166 CC1(C)CCC1C(O)=O Amb25032090 [1,0,0,1,0,0|1,0,1]=4 2663 B9R1.170 CC1(C)CC1CC(O)=O Amb25145962 [1,0,0,1,0,0|1,0,1]=4 2664 B9R1.55 CC1C(NC1=O)C(O)=O Amb25339232 [0,0,0,1,1,0|2,0,0]=4 2665 B9R1.55 CN1C(CC1=O)C(O)=O Amb22011579 [0,0,0,1,1,0|1,0,0]=3 2666 B9R1.69 CC1OC(=O)CNC1=O Amb25145608 [0,0,0,1,1,0|2,0,0]=4 2667 B9R1.69 CN1CC(=O)CCC1=O Amb23555663 [0,0,0,1,1,0|2,0,0]=4 2668 B9R1.69 C[C@H]1OC(=O)CCC1=O Amb25749526 [0,0,0,1,1,0|1,0,0]=3 2669 B9R1.69 O=C1CCC(=O)OC1=O Amb24620117 [0,0,0,1,1,0|2,0,0]=4 2670 B9R1.82 CC1CC(O1)C(=O)OC Amb22737249 [0,0,0,1,1,0|1,0,1]=4 2671 B9R1.82 CNC(=O)C1CC(=O)C1 Amb23512862 [0,0,0,1,1,0|2,0,0]=4 2672 B9R1.82 COC(=O)C1CC(=C)C1 Amb21962131 [0,0,0,1,1,0|2,0,0]=4 2673 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,0,0,1,1,0|1,0,0]=3 2674 B9R1.82 COC(=O)C1CC(=O)N1 Amb24711580 [0,0,0,1,1,0|1,0,0]=3 2675 B9R1.82 COC(=O)C1CC(O)C1 Amb19516177 [0,0,0,1,1,0|1,0,1]=4 2676 B9R1.82 COC(=O)N1CC(=O)C1 Amb24078331 [0,0,0,1,1,0|2,0,0]=4 2677 B9R1.82 COC(=O)[C@@H]1CC(=O)N1 Amb22747568 [0,0,0,1,1,0|1,0,0]=3 2678 B9R1.82 COC(=O)[C@@H]1CC(=S)N1 Amb24478569 [0,0,0,1,1,0|1,1,0]=4 2679 B9R1.82 COC(=O)[C@@H]1C[C@@H](O)C1 Amb22746996 [0,0,0,1,1,0|1,0,1]=4 2680 B9R1.82 COC(=O)[C@@H]1C[C@H](O)C1 Amb22754751 [0,0,0,1,1,0|1,0,1]=4 2681 B9R1.82 C[C@@H]1C[C@H](O1)C(=O)OC Amb24056487 [0,0,0,1,1,0|1,0,1]=4 2682 B9R1.95 CO[C@@H]1C[C@@H](C1)C(O)=O Amb23440276 [0,0,0,1,1,0|1,0,1]=4 2683 B9R1.95 CO[C@@H]1C[C@H](C1)C(O)=O Amb23440277 [0,0,0,1,1,0|1,0,1]=4 2684 B11R1.20 C=C1CCN(CC(O)=O)CC1 Amb25762669 [0,0,0,1,0,1|2,0,0]=4 2685 B11R1.20 CC(=O)CC1CCC(=O)CC1 Amb24631170 [0,0,0,1,0,1|2,0,0]=4 2686 B11R1.20 CC(=O)CN1CCC(=O)CC1 Amb18799576 [0,0,0,1,0,1|2,0,0]=4 2687 B11R1.20 CC(=O)NC1CCC(=O)NC1 Amb24477612 [0,0,0,1,0,1|2,0,0]=4 2688 B11R1.20 CC(=O)O[C@H]1CCC(=O)NC1 Amb24509789 [0,0,0,1,0,1|2,0,0]=4 2689 B11R1.20 CC=1CCN(CC(O)=O)CC1 Amb18636695 [0,0,0,1,0,1|2,0,0]=4 2690 B11R1.20 ClC(=O)CN1CCC(=O)CC1 Amb17142950 [0,0,0,1,0,1|2,0,0]=4 2691 B11R1.20 NC(=O)NC1CCC(=O)NC1 Amb25077351 [0,0,0,1,0,1|2,0,0]=4 2692 B11R1.20 O=C1CCC(CC1)NC(=O)C Amb1162738 [0,0,0,1,0,1|2,0,0]=4 2693 B11R1.20 OC(=O)CC1CCC(=O)C=C1 Amb25046213 [0,0,0,1,0,1|1,0,1]=4 2694 B11R1.20 OC(=O)CC1CCC(=O)CC1 Amb10607825 [0,0,0,1,0,1|1,0,0]=3 2695 B11R1.20 OC(=O)CC1CCC(=O)NC1 Amb18200019 [0,0,0,1,0,1|1,0,0]=3 2696 B11R1.20 OC(=O)CC1CNC(=O)CN1 Amb24655930 [0,0,0,1,0,1|1,0,0]=3 2697 B11R1.20 OC(=O)CC1CNC(=O)CO1 Amb25208483 [0,0,0,1,0,1|1,0,0]=3 2698 B11R1.20 OC(=O)CC=1CCC(=O)CC1 Amb25139696 [0,0,0,1,0,1|1,0,1]=4 2699 B11R1.20 OC(=O)CN1CCC(=O)CC1 Amb21955570 [0,0,0,1,0,1|1,0,0]=3 2700 B11R1.20 OC(=O)CN1CCS(=O)CC1 Amb24328394 [0,0,0,1,0,1|2,0,0]=4 2701 B11R1.20 OC(=O)C[C@@H]1CNC(=O)CN1 Amb25367224 [0,0,0,1,0,1|1,0,0]=3 2702 B11R1.20 OC(=O)C[C@H]1CCC(=O)C=C1 Amb24391524 [0,0,0,1,0,1|1,0,1]=4 2703 B11R1.23 CC1=CCC[C@H](O1)C(=O)CC Amb24486449 [0,0,0,1,0,1|2,0,0]=4 2704 B11R1.23 CC1CNCC(O1)C(=O)OC Amb24761259 [0,0,0,1,0,1|1,0,1]=4 2705 B11R1.23 CC=1CNCC(C1)C(=O)OC Amb18644736 [0,0,0,1,0,1|2,0,0]=4 2706 B11R1.23 CC=1NCCC(N1)C(=O)OC Amb24099643 [0,0,0,1,0,1|2,0,0]=4 2707 B11R1.23 CC=1N[C@H](CCN1)C(=O)OC Amb25701590 [0,0,0,1,0,1|2,0,0]=4 2708 B11R1.23 CCC(=O)C1CC(=O)NCC1 Amb24666028 [0,0,0,1,0,1|2,0,0]=4 2709 B11R1.23 CNC(=O)C1CC(=O)CCC1 Amb25351444 [0,0,0,1,0,1|2,0,0]=4 2710 B11R1.23 COC(=C)C1CC(=O)CCC1 Amb25707472 [0,0,0,1,0,1|2,0,0]=4 2711 B11R1.23 COC(=C)[C@H]1CC(=O)CCC1 Amb25143369 [0,0,0,1,0,1|2,0,0]=4 2712 B11R1.23 COC(=O)C1CC(=O)C=CC1 Amb24633337 [0,0,0,1,0,1|1,0,1]=4 2713 B11R1.23 COC(=O)C1CC(=O)CC=C1 Amb25700306 [0,0,0,1,0,1|1,0,1]=4 2714 B11R1.23 COC(=O)C1CC(=O)CCN1 Amb13889092 [0,0,0,1,0,1|1,0,0]=3 2715 B11R1.23 COC(=O)C1CC(=O)CCN1 Amb22899628 [0,0,0,1,0,1|1,0,0]=3 2716 B11R1.23 COC(=O)C1CC(=O)CCO1 Amb25309255 [0,0,0,1,0,1|1,0,0]=3 2717 B11R1.23 COC(=O)C1CC(=O)CNC1 Amb25178940 [0,0,0,1,0,1|1,0,0]=3 2718 B11R1.23 COC(=O)C1CC(=O)CSC1 Amb25797399 [0,0,0,1,0,1|1,0,0]=3 2719 B11R1.23 COC(=O)C1CC(=O)NCC1 Amb21922898 [0,0,0,1,0,1|1,0,0]=3 2720 B11R1.23 COC(=O)C1CC(O)CCN1 Amb21856404 [0,0,0,1,0,1|1,0,1]=4 2721 B11R1.23 COC(=O)C1CC(O)CCN1 Amb21963536 [0,0,0,1,0,1|1,0,1]=4 2722 B11R1.23 COC(=O)C1CC=CC(=O)N1 Amb25803656 [0,0,0,1,0,1|1,0,1]=4 2723 B11R1.23 COC(=O)C1CCCC(=O)N1 Amb13886339 [0,0,0,1,0,1|1,0,0]=3 2724 B11R1.23 COC(=O)C1CCCC(O)C1 Amb19516181 [0,0,0,1,0,1|1,0,1]=4 2725 B11R1.23 COC(=O)C1CCOC(=O)N1 Amb25044321 [0,0,0,1,0,1|1,0,0]=3 2726 B11R1.23 COC(=O)C1CCSC(=O)N1 Amb25315086 [0,0,0,1,0,1|1,0,0]=3 2727 B11R1.23 COC(=O)C1CNCC(=O)N1 Amb18126111 [0,0,0,1,0,1|1,0,0]=3 2728 B11R1.23 COC(=O)C1CNCC(C1)O Amb13885763 [0,0,0,1,0,1|1,0,1]=4 2729 B11R1.23 COC(=O)C1CNCC(O)C1 Amb17739877 [0,0,0,1,0,1|1,0,1]=4 2730 B11R1.23 COC(=O)C1CNNC(=O)C1 Amb2437236 [0,0,0,1,0,1|2,0,0]=4 2731 B11R1.23 COC(=O)C1COCC(=O)C1 Amb25086714 [0,0,0,1,0,1|1,0,0]=3 2732 B11R1.23 COC(=O)C1COCC(=O)N1 Amb24118077 [0,0,0,1,0,1|1,0,0]=3 2733 B11R1.23 COC(=O)C1CSCC(=O)N1 Amb24637882 [0,0,0,1,0,1|1,0,0]=3 2734 B11R1.23 COC(=O)C=1CC(=O)CCC1 Amb25318818 [0,0,0,1,0,1|1,0,1]=4 2735 B11R1.23 COC(=O)C=1CCCC(=O)C1 Amb22284374 [0,0,0,1,0,1|1,0,0]=3 2736 B11R1.23 COC(=O)C=1CCCC(O)C1 Amb25071604 [0,0,0,1,0,1|1,0,1]=4 2737 B11R1.23 COC(=O)N1CC(=O)CCC1 Amb22490336 [0,0,0,1,0,1|1,0,0]=3 2738 B11R1.23 COC(=O)N1CC(=O)NCC1 Amb18183252 [0,0,0,1,0,1|2,0,0]=4 2739 B11R1.23 COC(=O)N1CCCC(Cl)=C1 Amb24060044 [0,0,0,1,0,1|2,0,0]=4 2740 B11R1.23 COC(=O)N1C[C@H](O)CCC1 Amb24528215 [0,0,0,1,0,1|1,0,1]=4 2741 B11R1.23 COC(=O)[C@@H]1CC(=O)CCC1 Amb25084961 [0,0,0,1,0,1|1,0,0]=3 2742 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 Amb13889085 [0,0,0,1,0,1|1,0,0]=3 2743 B11R1.23 COC(=O)[C@@H]1CC(=O)CCO1 Amb25794184 [0,0,0,1,0,1|1,0,0]=3 2744 B11R1.23 COC(=O)[C@@H]1CC=CC(=O)N1 Amb25734856 [0,0,0,1,0,1|1,0,1]=4 2745 B11R1.23 COC(=O)[C@@H]1CCCC(=O)N1 Amb25375349 [0,0,0,1,0,1|1,0,0]=3 2746 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](O)C1 Amb22899456 [0,0,0,1,0,1|1,0,1]=4 2747 B11R1.23 COC(=O)[C@@H]1CCNC(=O)N1 Amb24699797 [0,0,0,1,0,1|1,0,0]=3 2748 B11R1.23 COC(=O)[C@@H]1CCOC(=O)N1 Amb25785572 [0,0,0,1,0,1|1,0,0]=3 2749 B11R1.23 COC(=O)[C@@H]1CNCC(=O)N1 Amb25759494 [0,0,0,1,0,1|1,0,0]=3 2750 B11R1.23 COC(=O)[C@@H]1C[C@@H](O)CCN1 Amb22748265 [0,0,0,1,0,1|1,0,1]=4 2751 B11R1.23 COC(=O)[C@@H]1C[C@H](O)CCN1 Amb10606654 [0,0,0,1,0,1|1,0,1]=4 2752 B11R1.23 COC(=O)[C@H]1CC(=C)CCN1 Amb24605746 [0,0,0,1,0,1|2,0,0]=4 2753 B11R1.23 COC(=O)[C@H]1CC(=O)CCC1 Amb24486283 [0,0,0,1,0,1|1,0,0]=3 2754 B11R1.23 COC(=O)[C@H]1CCC[C@@H](O)C1 Amb25198846 [0,0,0,1,0,1|1,0,1]=4 2755 B11R1.23 COC(=O)[C@H]1CCC[C@H](O)C1 Amb25225913 [0,0,0,1,0,1|1,0,1]=4 2756 B11R1.23 COC(=O)[C@H]1CCSC(=O)N1 Amb24484852 [0,0,0,1,0,1|1,0,0]=3 2757 B11R1.23 COC(=O)[C@H]1COC[C@H](O)C1 Amb24076400 [0,0,0,1,0,1|1,0,1]=4 2758 B11R1.23 COC(=O)[C@H]1C[C@@H](O)CCN1 Amb10606701 [0,0,0,1,0,1|1,0,1]=4 2759 B11R1.23 COC(=O)[C@H]1C[C@H](O)CCN1 Amb13886334 [0,0,0,1,0,1|1,0,1]=4 2760 B11R1.23 C[C@@H]1CNCC(O1)C(=O)OC Amb25684325 [0,0,0,1,0,1|1,0,1]=4 2761 B11R1.23 C[C@@H]1CNC[C@@H](O1)C(=O)OC Amb24555590 [0,0,0,1,0,1|1,0,1]=4 2762 B11R1.39 CC1=NC(CS1)CC(=O)OC Amb24713094 [0,0,0,1,0,1|2,0,0]=4 2763 B11R1.39 CCC(=O)C[C@@H]1CC(=O)CC1 Amb25151572 [0,0,0,1,0,1|2,0,0]=4 2764 B11R1.39 COC(=O)CC1=CC(=O)CO1 Amb25760173 [0,0,0,1,0,1|1,0,1]=4 2765 B11R1.39 COC(=O)CC1C=CC(=O)O1 Amb24066588 [0,0,0,1,0,1|0,0,1]=3 2766 B11R1.39 COC(=O)CC1CC(=O)CC1 Amb21962984 [0,0,0,1,0,1|1,0,0]=3 2767 B11R1.39 COC(=O)CC1CC(=O)CN1 Amb24596599 [0,0,0,1,0,1|1,0,0]=3 2768 B11R1.39 COC(=O)CC1CNC(=O)C1 Amb23453157 [0,0,0,1,0,1|1,0,0]=3 2769 B11R1.39 COC(=O)CC1CNC(=O)N1 Amb25709662 [0,0,0,1,0,1|1,0,0]=3 2770 B11R1.39 COC(=O)CC1CNC(=O)O1 Amb24709358 [0,0,0,1,0,1|0,0,0]=2 2771 B11R1.39 COC(=O)CC=1CCC(=O)C1 Amb24724026 [0,0,0,1,0,1|1,0,0]=3 2772 B11R1.39 COC(=O)CN1CC(=O)CC1 Amb25696377 [0,0,0,1,0,1|1,0,0]=3 2773 B11R1.39 COC(=O)CN1CC(O)CC1 Amb18177629 [0,0,0,1,0,1|1,0,1]=4 2774 B11R1.39 COC(=O)CN1CCC(N)=N1 Amb25277675 [0,0,0,1,0,1|2,0,0]=4 2775 B11R1.39 COC(=O)C[C@@H]1CCC(=O)N1 Amb25277134 [0,0,0,1,0,1|1,0,0]=3 2776 B11R1.39 COC(=O)C[C@@H]1CC[C@H](O)C1 Amb25054455 [0,0,0,1,0,1|1,0,1]=4 2777 B11R1.39 COC(=O)C[C@@H]1CNC(=O)O1 Amb24486121 [0,0,0,1,0,1|0,0,0]=2 2778 B11R1.39 COC(=O)C[C@H]1CC(=O)C=C1 Amb24416710 [0,0,0,1,0,1|1,0,1]=4 2779 B11R1.39 COC(=O)C[C@H]1CC[C@@H](O)C1 Amb24598237 [0,0,0,1,0,1|1,0,1]=4 2780 B11R1.39 COC(=O)C[C@H]1COC(=O)N1 Amb24596361 [0,0,0,1,0,1|1,0,0]=3 2781 B11R1.39 COC(=O)NC1CC(=O)CC1 Amb23454127 [0,0,0,1,0,1|1,0,0]=3 2782 B11R1.39 COC(=O)NC1CCC(=O)O1 Amb24741804 [0,0,0,1,0,1|0,0,0]=2 2783 B11R1.39 COC(=O)NC1CS(=O)CC1 Amb25307219 [0,0,0,1,0,1|2,0,0]=4 2784 B11R1.39 COC(=O)N[C@H]1CC[C@@H](O)C1 Amb24619117 [0,0,0,1,0,1|1,0,1]=4 2785 B11R1.39 COC(=S)CC1CC(=O)CC1 Amb24645405 [0,0,0,1,0,1|1,1,0]=4 2786 B11R1.39 CON(C)CC1CNC(=O)O1 Amb25740233 [0,0,0,1,0,1|2,0,0]=4 2787 B11R1.39 COS(=O)CC1CC(=O)CC1 Amb24690609 [0,0,0,1,0,1|2,0,0]=4 2788 B11R1.43 COC1CN(CC(O)=O)CC1 Amb21860464 [0,0,0,1,0,1|1,0,1]=4 2789 B11R1.43 COC1CNC(C1)CC(O)=O Amb25149435 [0,0,0,1,0,1|1,0,1]=4 2790 B11R1.43 CO[C@@H]1CN(CC(O)=O)CC1 Amb24369951 [0,0,0,1,0,1|1,0,1]=4 2791 B11R1.43 CO[C@@H]1CN(CC(O)=O)CC1 Amb24485093 [0,0,0,1,0,1|1,0,1]=4 2792 B11R1.43 CO[C@@H]1C[C@@H](CC(O)=O)CC1 Amb25260453 [0,0,0,1,0,1|1,0,1]=4 2793 B11R1.75 CC(=O)CCC1CC(=O)NC1 Amb25857985 [0,0,0,1,0,1|2,0,0]=4 2794 B11R1.75 CC(=O)CSC1CC(=O)CC1 Amb25832598 [0,0,0,1,0,1|2,0,0]=4 2795 B11R1.75 CC(=O)NCC1CC(=O)CC1 Amb25082878 [0,0,0,1,0,1|2,0,0]=4 2796 B11R1.75 CC(=O)NCC1CC(=O)NC1 Amb24561965 [0,0,0,1,0,1|2,0,0]=4 2797 B11R1.75 CC(=O)NCC1COC(=O)N1 Amb25051942 [0,0,0,1,0,1|2,0,0]=4 2798 B11R1.75 CC(=O)OCC1CC(=O)CC1 Amb25821465 [0,0,0,1,0,1|2,0,0]=4 2799 B11R1.75 CC(=O)OC[C@@H]1CC(=O)CC1 Amb25683743 [0,0,0,1,0,1|2,0,0]=4 2800 B11R1.75 CC(=O)OC[C@H]1COC(=O)N1 Amb24533166 [0,0,0,1,0,1|2,0,0]=4 2801 B11R1.75 NC(=O)CCC1CCC(=O)N1 Amb25138799 [0,0,0,1,0,1|2,0,0]=4 2802 B11R1.75 NC(=O)CCN1CC(=O)CC1 Amb24580305 [0,0,0,1,0,1|2,0,0]=4 2803 B11R1.75 NC(=O)CNC1CC(=O)NC1 Amb24448334 [0,0,0,1,0,1|2,0,0]=4 2804 B11R1.75 NC(=O)CSC1CC(=O)CC1 Amb25151931 [0,0,0,1,0,1|2,0,0]=4 2805 B11R1.75 O=C1CCC(C1)CCC(=O)Cl Amb24408466 [0,0,0,1,0,1|2,0,0]=4 2806 B11R1.75 OC(=O)CCC1CC(=O)CC1 Amb18125974 [0,0,0,1,0,1|1,0,0]=3 2807 B11R1.75 OC(=O)CCC1CC(=O)OC1 Amb18644988 [0,0,0,1,0,1|0,0,0]=2 2808 B11R1.75 OC(=O)CCC1CCC(=O)O1 Amb18126095 [0,0,0,1,0,1|1,0,0]=3 2809 B11R1.75 OC(=O)CCC1CCC(=O)S1 Amb24487846 [0,0,0,1,0,1|1,0,0]=3 2810 B11R1.75 OC(=O)CCC1COC(=O)N1 Amb24358987 [0,0,0,1,0,1|0,0,0]=2 2811 B11R1.75 OC(=O)CCC=1CC(=O)NN1 Amb18200284 [0,0,0,1,0,1|2,0,0]=4 2812 B11R1.75 OC(=O)CC[C@H]1CCC(=O)O1 Amb24487947 [0,0,0,1,0,1|1,0,0]=3 2813 B11R1.75 OC(=O)CSC1CC(=O)OC1 Amb25111201 [0,0,0,1,0,1|0,0,0]=2 2814 B11R1.75 OC(=O)CSC1CCC(=O)N1 Amb2428430 [0,0,0,1,0,1|2,0,0]=4 2815 B11R1.75 OC(=O)\C=C/C1COC(=O)O1 Amb25858098 [0,0,0,1,0,1|0,0,2]=4 2816 B11R1.75 OC(=O)\C=C\C1COC(=O)O1 Amb24519254 [0,0,0,1,0,1|0,0,2]=4 2817 B11R1.145 O=C1CCCCC(=O)OCC1 Amb25128459 [0,0,0,1,0,1|1,0,0]=3 2818 B11R1.147 CC1C(CCC(O)=O)CC1=O Amb25074595 [0,0,0,1,0,1|1,0,0]=3 2819 B11R1.159 C=C1C(CCCC1=O)C(O)=O Amb18125677 [0,0,0,1,0,1|1,0,1]=4 2820 B11R1.159 CC(=O)C1CCCC(=O)C1C Amb25353692 [0,0,0,1,0,1|2,0,0]=4 2821 B11R1.159 CC1=C(CCCC1=O)C(O)=O Amb18125678 [0,0,0,1,0,1|1,0,0]=3 2822 B11R1.159 CC1C(CCCC1=O)C(N)=O Amb25231274 [0,0,0,1,0,1|2,0,0]=4 2823 B11R1.159 CC1C(CCCC1=O)C(O)=O Amb18644795 [0,0,0,1,0,1|1,0,0]=3 2824 B11R1.159 CN1C(CCCC1=O)C(O)=O Amb18830654 [0,0,0,1,0,1|1,0,0]=3 2825 B11R1.159 C[C@@H]1[C@H](CCCC1=O)C(N)=O Amb25195388 [0,0,0,1,0,1|2,0,0]=4 2826 B11R1.159 OC(=O)C1CCNC(=O)C1O Amb25145722 [0,0,0,1,0,1|2,0,0]=4 2827 B11R1.224 COC(=O)CCN1CC(O)C1 Amb24750434 [0,0,0,1,0,1|1,0,1]=4 2828 B11R1.224 COC(=O)CSC1CC(=O)N1 Amb25385796 [0,0,0,1,0,1|1,0,0]=3 2829 B11R1.266 CCC=1NCCC(N1)C(O)=O Amb24099649 [0,0,0,1,0,1|2,0,0]=4 2830 B11R1.266 COC1CCNC(C1)C(=O)O Amb13886061 [0,0,0,1,0,1|1,0,1]=4 2831 B11R1.266 COC1CCNC(C1)C(=O)O Amb13886211 [0,0,0,1,0,1|1,0,1]=4 2832 B11R1.266 CO[C@H]1C[C@@H](CCC1)C(O)=O Amb24739740 [0,0,0,1,0,1|1,0,1]=4 2833 B11R1.313 C=C1C(CCC1=O)CC(O)=O Amb25700924 [0,0,0,1,0,1|1,0,1]=4 2834 B11R1.313 CC(=O)CC1CCC(=O)C1C Amb25683464 [0,0,0,1,0,1|2,0,0]=4 2835 B11R1.313 CC(=O)CC1CCC(=O)N1C Amb25767121 [0,0,0,1,0,1|2,0,0]=4 2836 B11R1.313 CC1=C(CNC1=O)CC(O)=O Amb18125826 [0,0,0,1,0,1|1,0,1]=4 2837 B11R1.313 CC1C(CCC1=O)CC(N)=O Amb25204816 [0,0,0,1,0,1|2,0,0]=4 2838 B11R1.313 CC1C(CCC1=O)CC(O)=O Amb18125960 [0,0,0,1,0,1|1,0,0]=3 2839 B11R1.313 CN1C(=O)CCN1CC(O)=O Amb25268687 [0,0,0,1,0,1|1,0,0]=3 2840 B11R1.313 CN1[C@@H](CCC1=O)CC(O)=O Amb25362177 [0,0,0,1,0,1|1,0,0]=3 2841 B11R1.313 OC(=O)CC1COC(=O)C1=O Amb24627056 [0,0,0,1,0,1|2,0,0]=4 2842 B11R1.565 NC(=O)C1CCC(=O)NCC1 Amb25853668 [0,0,0,1,0,1|2,0,0]=4 2843 B11R1.565 O=C1CCCN(CC1)C(=O)C Amb13783681 [0,0,0,1,0,1|2,0,0]=4 2844 B11R1.565 OC(=O)C1CCC(=O)NCC1 Amb24488196 [0,0,0,1,0,1|1,0,0]=3 2845 B11R1.565 OC(=O)C1CCC(=O)NCN1 Amb25799038 [0,0,0,1,0,1|2,0,0]=4 2846 B11R1.565 OC(=O)C1CCC(=O)OCC1 Amb22001721 [0,0,0,1,0,1|1,0,0]=3 2847 B11R1.565 OC(=O)C1CCCC(=O)CC1 Amb23399610 [0,0,0,1,0,1|1,0,0]=3 2848 B11R1.565 OC(=O)C1CNC(=O)CCN1 Amb24697001 [0,0,0,1,0,1|1,0,0]=3 2849 B11R1.565 OC(=O)C1CNC(=O)CCO1 Amb24694511 [0,0,0,1,0,1|1,0,0]=3 2850 B11R1.849 CC(=O)OC1CC1C(=O)OC Amb24060870 [0,0,0,1,0,1|1,0,0]=3 2851 B11R1.849 CC(=O)O[C@@H]1C[C@H]1C(=O)OC Amb25383235 [0,0,0,1,0,1|1,0,0]=3 2852 B11R1.849 CC(=O)O[C@H]1C[C@H]1C(=O)OC Amb25383234 [0,0,0,1,0,1|1,0,0]=3 2853 B11R1.849 COC(=O)C/1C\C1=C\C(O)=O Amb25362160 [0,0,0,1,0,1|0,0,1]=3 2854 B11R1.849 COC(=O)C1CC1=CC(O)=O Amb25261373 [0,0,0,1,0,1|0,0,1]=3 2855 B11R1.870 C=CC(=O)C1CCC1C(O)=O Amb24651148 [0,0,0,1,0,1|1,0,1]=4 2856 B11R1.870 C=CC(=O)[C@H]1CC[C@H]1C(O)=O Amb24519265 [0,0,0,1,0,1|1,0,1]=4 2857 B11R1.870 CC(=C)C1CCC1C(=O)OC Amb25366544 [0,0,0,1,0,1|2,0,0]=4 2858 B11R1.870 CC(=C)[C@@H]1CC[C@@H]1C(=O)OC Amb24558969 [0,0,0,1,0,1|2,0,0]=4 2859 B11R1.870 CC(=O)N1CCC1C(=O)CC Amb25308896 [0,0,0,1,0,1|2,0,0]=4 2860 B11R1.870 CC(O)C1CCN1C(=O)OC Amb25301142 [0,0,0,1,0,1|1,0,1]=4 2861 B11R1.870 CCC(=O)N1CCC1C(O)=O Amb24607082 [0,0,0,1,0,1|1,0,0]=3 2862 B11R1.870 CCC(=O)[C@H]1CC[C@H]1C(O)=O Amb24607376 [0,0,0,1,0,1|1,0,0]=3 2863 B11R1.870 CNC(=O)N1CCC1C(O)=O Amb24571460 [0,0,0,1,0,1|1,0,0]=3 2864 B11R1.870 COC(=O)C1C=CC1C(O)=O Amb25028121 [0,0,0,1,0,1|0,0,1]=3 2865 B11R1.870 COC(=O)C1CCC1C(N)=O Amb25091194 [0,0,0,1,0,1|1,0,0]=3 2866 B11R1.870 COC(=O)C1CCC1C(O)=O Amb25844392 [0,0,0,1,0,1|0,0,0]=2 2867 B11R1.870 COC(=O)C1CCN1C(=O)Cl Amb25351297 [0,0,0,1,0,1|1,0,0]=3 2868 B11R1.870 COC(=O)C=1CCC1C(O)=O Amb24652503 [0,0,0,1,0,1|0,0,1]=3 2869 B11R1.870 COC(=O)N1CCC1C(O)=O Amb25690182 [0,0,0,1,0,1|0,0,0]=2 2870 B11R1.870 COC(=O)N1CC[C@@H]1C(O)=O Amb24710301 [0,0,0,1,0,1|0,0,0]=2 2871 B11R1.870 COC(=O)[C@@H]1C=C[C@@H]1C(=O)Cl Amb25089856 [0,0,0,1,0,1|1,0,1]=4 2872 B11R1.870 COC(=O)[C@@H]1CC[C@@H]1C(O)=O Amb23439085 [0,0,0,1,0,1|0,0,0]=2 2873 B11R1.870 COC(=O)[C@H]1C=C[C@H]1C(=O)Cl Amb25175039 [0,0,0,1,0,1|1,0,1]=4 2874 B11R1.870 COC(=O)[C@H]1C=C[C@H]1C(O)=O Amb25200966 [0,0,0,1,0,1|0,0,1]=3 2875 B11R1.870 COC(=O)[C@H]1CC[C@H]1C(N)=O Amb24546454 [0,0,0,1,0,1|1,0,0]=3 2876 B11R1.870 NCC(=O)N1CCC1C(O)=O Amb24522830 [0,0,0,1,0,1|2,0,0]=4 2877 B11R1.870 OC(=O)[C@H]1CCN1C(=O)CCl Amb25347686 [0,0,0,1,0,1|2,0,0]=4 2878 B11R1.892 CC(=O)[C@H]1C[C@@H]1CC(=O)OC Amb25384084 [0,0,0,1,0,1|1,0,0]=3 2879 B11R1.15 CC=1CCC(N1)C(=O)OCC Amb25144143 [0,1,0,1,0,0|2,0,0]=4 2880 B11R1.15 CC=1CC[C@H](N1)C(=O)OCC Amb25208092 [0,1,0,1,0,0|2,0,0]=4 2881 B11R1.15 CCNC(=O)[C@@H]1CCC(=O)N1 Amb24714276 [0,1,0,1,0,0|2,0,0]=4 2882 B11R1.15 CCNC(=O)[C@H]1CCC(=O)N1 Amb25148030 [0,1,0,1,0,0|2,0,0]=4 2883 B11R1.15 CCOC(=O)C1CC(=O)NC1 Amb20075873 [0,1,0,1,0,0|2,0,0]=4 2884 B11R1.15 CCOC(=O)C1CCC(=O)N1 Amb2137255 [0,1,0,1,0,0|1,0,0]=3 2885 B11R1.15 CCOC(=O)C1CCC(=S)N1 Amb25774356 [0,1,0,1,0,0|1,1,0]=4 2886 B11R1.15 CCOC(=O)C1CCC(N)=N1 Amb24484673 [0,1,0,1,0,0|2,0,0]=4 2887 B11R1.15 CCOC(=O)C1CCC(O)C1 Amb22754536 [0,1,0,1,0,0|1,0,1]=4 2888 B11R1.15 CCOC(=O)C1CCC(O)O1 Amb25032368 [0,1,0,1,0,0|0,0,2]=4 2889 B11R1.15 CCOC(=O)C1COC(=O)C1 Amb20669139 [0,1,0,1,0,0|2,0,0]=4 2890 B11R1.15 CCOC(=O)C=1CCC(=O)C1 Amb22736093 [0,1,0,1,0,0|1,0,1]=4 2891 B11R1.15 CCOC(=O)C=1CCC(=O)N1 Amb24509276 [0,1,0,1,0,0|1,0,1]=4 2892 B11R1.15 CCOC(=O)N1CCC(=O)N1 Amb24565619 [0,1,0,1,0,0|2,0,0]=4 2893 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)O1 Amb22226711 [0,1,0,1,0,0|0,0,0]=2 2894 B11R1.15 CCOC(=O)[C@@H]1CCC(N)=N1 Amb25143983 [0,1,0,1,0,0|2,0,0]=4 2895 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](O)C1 Amb25791928 [0,1,0,1,0,0|1,0,1]=4 2896 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](O)O1 Amb24613347 [0,1,0,1,0,0|0,0,2]=4 2897 B11R1.15 CCOC(=O)[C@@H]1COC(=O)N1 Amb19929335 [0,1,0,1,0,0|2,0,0]=4 2898 B11R1.15 CCOC(=O)[C@H]1CC(=O)CC1 Amb25053151 [0,1,0,1,0,0|1,0,0]=3 2899 B11R1.15 CCOC(=O)[C@H]1CC(=O)NC1 Amb25084316 [0,1,0,1,0,0|2,0,0]=4 2900 B11R1.15 CCOC(=O)[C@H]1CCC(O)O1 Amb24485924 [0,1,0,1,0,0|0,0,2]=4 2901 B11R1.15 CCOC(=O)[C@H]1COC(=O)C1 Amb25100827 [0,1,0,1,0,0|2,0,0]=4 2902 B11R1.15 CCOC(=O)[C@H]1COC(=O)N1 Amb22736699 [0,1,0,1,0,0|2,0,0]=4 2903 B11R1.15 CCSC(=O)C1CCC(=O)N1 Amb24484871 [0,1,0,1,0,0|1,1,0]=4 2904 B11R1.15 CCSC(=O)[C@@H]1CCC(=O)N1 Amb25275281 [0,1,0,1,0,0|1,1,0]=4 2905 B11R1.15 CONC(=O)C1CCC(=O)N1 Amb24334787 [0,1,0,1,0,0|1,0,0]=3 2906 B11R1.15 CONC(=O)C1CSC(=O)N1 Amb25226217 [0,1,0,1,0,0|2,0,0]=4 2907 B11R1.15 CONC(=O)[C@@H]1CC[C@@H](O)C1 Amb25031689 [0,1,0,1,0,0|1,0,1]=4 2908 B11R1.15 CONC(=O)[C@@H]1CNC(=O)N1 Amb24674975 [0,1,0,1,0,0|2,0,0]=4 2909 B11R1.15 C\C=C\C(=O)C1CC(=O)CC1 Amb24737427 [0,1,0,1,0,0|2,0,0]=4 2910 B11R1.15 O=C1CCC(N1)C(=O)OCCl Amb24371305 [0,1,0,1,0,0|1,0,0]=3 2911 B11R1.15 O=C1CC[C@@H](N1)C(=O)OCCl Amb22757012 [0,1,0,1,0,0|1,0,0]=3 2912 B11R1.15 O=C1CC[C@H](N1)C(=O)OCCl Amb24450211 [0,1,0,1,0,0|1,0,0]=3 2913 B11R1.62 CCC1C(CC(O)=O)NC1=O Amb25690284 [0,1,0,1,0,0|2,0,0]=4 2914 B11R1.64 C=CN1C(CCC1=O)C(O)=O Amb24470168 [0,1,0,1,0,0|1,0,1]=4 2915 B11R1.64 C=CN1[C@@H](CCC1=O)C(O)=O Amb24456799 [0,1,0,1,0,0|1,0,1]=4 2916 B11R1.64 CCC1C(CCC1=O)C(O)=O Amb18125955 [0,1,0,1,0,0|1,0,0]=3 2917 B11R1.64 CCC1C(CNC1=O)C(O)=O Amb25355899 [0,1,0,1,0,0|2,0,0]=4 2918 B11R1.64 CCC1C(COC1=O)C(O)=O Amb25189307 [0,1,0,1,0,0|2,0,0]=4 2919 B11R1.64 CCN1C(CCC1=O)C(O)=O Amb18288294 [0,1,0,1,0,0|1,0,0]=3 2920 B11R1.64 CCN1C(CSC1=O)C(O)=O Amb24501765 [0,1,0,1,0,0|2,0,0]=4 2921 B11R1.64 CCN1[C@@H](CCC1=O)C(O)=O Amb25108137 [0,1,0,1,0,0|1,0,0]=3 2922 B11R1.64 CCN1[C@@H](CSC1=O)C(O)=O Amb25851327 [0,1,0,1,0,0|2,0,0]=4 2923 B11R1.64 CCN1[C@H](CCC1=O)C(O)=O Amb25850193 [0,1,0,1,0,0|1,0,0]=3 2924 B11R1.64 CC[C@@H]1[C@H](COC1=O)C(O)=O Amb25216956 [0,1,0,1,0,0|2,0,0]=4 2925 B11R1.64 CC[C@@H]1[C@H](NCC1=O)C(O)=O Amb18830650 [0,1,0,1,0,0|2,0,0]=4 2926 B11R1.64 CC[C@H]1[C@@H](COC1=O)C(O)=O Amb24571752 [0,1,0,1,0,0|2,0,0]=4 2927 B11R1.64 CC[C@H]1[C@H](COC1=O)C(O)=O Amb24600687 [0,1,0,1,0,0|2,0,0]=4 2928 B11R1.64 COC1=C(CCC1=O)C(O)=O Amb25321976 [0,1,0,1,0,0|0,0,1]=3 2929 B11R1.64 C[C@H](O)[C@H]1CCC(=O)N1OC Amb25326800 [0,1,0,1,0,0|1,0,1]=4 2930 B11R1.64 OC(=O)C1CCC(=O)N1CO Amb24060249 [0,1,0,1,0,0|1,0,0]=3 2931 B11R1.64 OC(=O)C1COC(=O)C1CO Amb24453282 [0,1,0,1,0,0|2,0,0]=4 2932 B11R1.64 OC(=O)[C@@H]1CCC(=O)N1CO Amb24060250 [0,1,0,1,0,0|1,0,0]=3 2933 B11R1.64 OC(=O)[C@@H]1CCC(=O)[C@H]1CCl Amb25328825 [0,1,0,1,0,0|1,0,0]=3 2934 B11R1.64 OC(=O)[C@@H]1COC(=O)[C@H]1CO Amb25238334 [0,1,0,1,0,0|2,0,0]=4 2935 B11R1.90 CC(=O)CCC1CCCC1=O Amb24388620 [0,1,0,1,0,0|2,0,0]=4 2936 B11R1.90 CC(=O)CCC1CCNC1=O Amb18200449 [0,1,0,1,0,0|2,0,0]=4 2937 B11R1.90 CC(=O)CCC1CCOC1=O Amb24340379 [0,1,0,1,0,0|1,0,0]=3 2938 B11R1.90 CC(=O)CCC1CON=C1Cl Amb25707493 [0,1,0,1,0,0|2,0,0]=4 2939 B11R1.90 NC(=O)CCN1CCOC1=O Amb18787749 [0,1,0,1,0,0|2,0,0]=4 2940 B11R1.90 OC(=O)CCC1=CCCC1=O Amb18125691 [0,1,0,1,0,0|1,0,1]=4 2941 B11R1.90 OC(=O)CCC1CCCC1=O Amb17400002 [0,1,0,1,0,0|1,0,0]=3 2942 B11R1.90 OC(=O)CCC1CCOC1=O Amb10669454 [0,1,0,1,0,0|0,0,0]=2 2943 B11R1.90 OC(=O)CCC1N=CNC1=O Amb25028108 [0,1,0,1,0,0|1,0,1]=4 2944 B11R1.90 OC(=O)CCC1NCCC1=O Amb22536281 [0,1,0,1,0,0|1,0,0]=3 2945 B11R1.90 OC(=O)CCC1SCCC1=O Amb24365973 [0,1,0,1,0,0|1,0,0]=3 2946 B11R1.90 OC(=O)CCN1CCCC1=O Amb1138316 [0,1,0,1,0,0|2,0,0]=4 2947 B11R1.90 OC(=O)CCN1CCNC1=O Amb19002909 [0,1,0,1,0,0|2,0,0]=4 2948 B11R1.90 OC(=O)CCN1CCSC1=O Amb1106160 [0,1,0,1,0,0|1,1,0]=4 2949 B11R1.90 OC(=O)CCN1N=COC1=O Amb24743681 [0,1,0,1,0,0|1,0,1]=4 2950 B11R1.90 OC(=O)CN[C@@H]1CCOC1=O Amb25112698 [0,1,0,1,0,0|1,0,0]=3 2951 B11R1.124 CCOC1=NC(CS1)C(O)=O Amb24718608 [0,1,0,1,0,0|2,0,0]=4 2952 B11R1.124 COCC1=NC(CO1)C(O)=O Amb24488135 [0,1,0,1,0,0|2,0,0]=4 2953 B11R1.124 COCC1=NC(CS1)C(O)=O Amb25124083 [0,1,0,1,0,0|2,0,0]=4 2954 B11R1.124 COCC1CC(CC1)C(O)=O Amb25780193 [0,1,0,1,0,0|1,0,1]=4 2955 B11R1.124 COCC1CCC(N1)C(O)=O Amb24441382 [0,1,0,1,0,0|1,0,1]=4 2956 B11R1.124 COCC1CCC(O1)C(O)=O Amb18988012 [0,1,0,1,0,0|0,0,2]=4 2957 B11R1.124 COC[C@@H]1CC[C@H](N1)C(O)=O Amb24547011 [0,1,0,1,0,0|1,0,1]=4 2958 B11R1.124 COC[C@H]1CC[C@H](N1)C(O)=O Amb25369771 [0,1,0,1,0,0|1,0,1]=4 2959 B11R1.124 CO\N=C/1\CCC(C1)C(O)=O Amb23454128 [0,1,0,1,0,0|1,0,0]=3 2960 B11R1.157 C=C1CC(CC(O)=O)CCC1 Amb23589688 [0,1,0,1,0,0|2,0,0]=4 2961 B11R1.157 CC(=O)C[C@@H]1CC(=O)CCC1 Amb24486351 [0,1,0,1,0,0|2,0,0]=4 2962 B11R1.157 NC(=O)CC1CC(=O)CCN1 Amb24566618 [0,1,0,1,0,0|2,0,0]=4 2963 B11R1.157 NC(=O)CC1CC(=O)NCC1 Amb24627882 [0,1,0,1,0,0|2,0,0]=4 2964 B11R1.157 OC(=O)CC1CC(=O)NCC1 Amb18200020 [0,1,0,1,0,0|1,0,0]=3 2965 B11R1.157 OC(=O)CC1CCCC(=O)N1 Amb18200018 [0,1,0,1,0,0|2,0,0]=4 2966 B11R1.157 OC(=O)CC1CCCC(=O)O1 Amb25702813 [0,1,0,1,0,0|2,0,0]=4 2967 B11R1.157 OC(=O)CC1CNCC(=O)N1 Amb25800398 [0,1,0,1,0,0|2,0,0]=4 2968 B11R1.157 OC(=O)CC1COCC(=O)N1 Amb25253163 [0,1,0,1,0,0|1,0,0]=3 2969 B11R1.157 OC(=O)CN1CC(=O)CCC1 Amb18200026 [0,1,0,1,0,0|2,0,0]=4 2970 B11R1.157 OC(=O)CN1CCNC(=O)C1 Amb2235553 [0,1,0,1,0,0|2,0,0]=4 2971 B11R1.157 OC(=O)CN1CCOC(=O)C1 Amb1093951 [0,1,0,1,0,0|1,0,0]=3 2972 B11R1.157 OC(=O)C[C@@H]1CNCC(=O)N1 Amb25324304 [0,1,0,1,0,0|2,0,0]=4 2973 B11R1.157 OC(=O)C[C@H]1CCCC(=O)O1 Amb24383646 [0,1,0,1,0,0|2,0,0]=4 2974 B11R1.166 C=C1CC(N)C(CC1)C(O)=O Amb25264986 [0,1,0,1,0,0|2,0,0]=4 2975 B11R1.166 CC(=C)C1CCC(=O)OC1O Amb25190144 [0,1,0,1,0,0|2,0,0]=4 2976 B11R1.166 CC(=O)C1CCC(=O)CC1C Amb24484659 [0,1,0,1,0,0|2,0,0]=4 2977 B11R1.166 CC(=O)[C@@H]1CCC(=O)C[C@@H]1C Amb24571662 [0,1,0,1,0,0|2,0,0]=4 2978 B11R1.166 CC(=O)[C@@H]1CCC(=O)C[C@H]1C Amb25773216 [0,1,0,1,0,0|2,0,0]=4 2979 B11R1.166 CC1=CC(=O)CCC1C(O)=O Amb25189150 [0,1,0,1,0,0|1,0,0]=3 2980 B11R1.166 CC1CC(=O)CCC1C(O)=O Amb18125961 [0,1,0,1,0,0|1,0,0]=3 2981 B11R1.166 CC1CC(=O)NCC1C(O)=O Amb25149101 [0,1,0,1,0,0|1,0,0]=3 2982 B11R1.166 CC1CC(N)=NCC1C(O)=O Amb24062484 [0,1,0,1,0,0|2,0,0]=4 2983 B11R1.166 CC1CCC(C(C)O1)C(O)=O Amb24484632 [0,1,0,1,0,0|1,0,1]=4 2984 B11R1.166 CC1NC(=O)CCC1C(O)=O Amb25196740 [0,1,0,1,0,0|1,0,0]=3 2985 B11R1.166 CC1OC(=O)CCC1C(O)=O Amb24390903 [0,1,0,1,0,0|0,0,0]=2 2986 B11R1.166 CC=1CC(C)C(CC1)C(O)=O Amb18125766 [0,1,0,1,0,0|2,0,0]=4 2987 B11R1.166 CC=1CC[C@H]([C@@H](O)C1)C(O)=O Amb25242482 [0,1,0,1,0,0|2,0,0]=4 2988 B11R1.166 CC=1C[C@@H](C)[C@@H](CC1)C(O)=O Amb25697299 [0,1,0,1,0,0|2,0,0]=4 2989 B11R1.166 CC=1C[C@@H](C)[C@H](CC1)C(O)=O Amb25257348 [0,1,0,1,0,0|2,0,0]=4 2990 B11R1.166 CC=1C[C@H](C)[C@H](CC1)C(O)=O Amb24601788 [0,1,0,1,0,0|2,0,0]=4 2991 B11R1.166 CC=1NC(=O)CCC1C(O)=O Amb25087837 [0,1,0,1,0,0|1,0,1]=4 2992 B11R1.166 C[C@@H]1CC(=O)CC[C@H]1C(O)=O Amb24511958 [0,1,0,1,0,0|1,0,0]=3 2993 B11R1.166 C[C@@H]1CC[C@@H]([C@H](C)O1)C(O)=O Amb25173183 [0,1,0,1,0,0|1,0,1]=4 2994 B11R1.166 C[C@@H]1CC[C@H]([C@H](C)O1)C(O)=O Amb25247949 [0,1,0,1,0,0|1,0,1]=4 2995 B11R1.166 C[C@@H]1OC(=O)CC[C@H]1C(O)=O Amb24563812 [0,1,0,1,0,0|0,0,0]=2 2996 B11R1.166 C[C@H]1CC(=O)CC[C@H]1C(O)=O Amb24571688 [0,1,0,1,0,0|1,0,0]=3 2997 B11R1.172 OC(=O)CCCC1COCC1 Amb24755490 [0,1,0,1,0,0|1,0,1]=4 2998 B11R1.172 OC(=O)CCCC1OCCO1 Amb25090345 [0,1,0,1,0,0|0,0,2]=4 2999 B11R1.172 OC(=O)CCCC=1CCCC1 Amb18125777 [0,1,0,1,0,0|2,0,0]=4 3000 B11R1.172 OC(=O)CCCc1[n]cco1 Amb18559420 [0,1,0,1,0,0|1,0,1]=4 3001 B11R1.172 OC(=O)CCCc1[n]co[n]1 Amb18200268 [0,1,0,1,0,0|1,0,1]=4 3002 B11R1.172 OC(=O)CCCc1c[n]co1 Amb18200538 [0,1,0,1,0,0|1,0,1]=4 3003 B11R1.172 OC(=O)CCCc1c[n]oc1 Amb25382179 [0,1,0,1,0,0|2,0,0]=4 3004 B11R1.172 OC(=O)CCCc1cc[n]o1 Amb18200545 [0,1,0,1,0,0|1,0,1]=4 3005 B11R1.172 OC(=O)CCCc1ccco1 Amb18125675 [0,1,0,1,0,0|1,0,1]=4 3006 B11R1.172 OC(=O)CCCc1cco[n]1 Amb24062140 [0,1,0,1,0,0|1,0,1]=4 3007 B11R1.172 OC(=O)CCCc1ccoc1 Amb25385034 [0,1,0,1,0,0|1,0,1]=4 3008 B11R1.172 OC(=O)CCCc1coc[n]1 Amb18200521 [0,1,0,1,0,0|1,0,1]=4 3009 B11R1.172 OC(=O)CCCc1nnco1 Amb17138462 [0,1,0,1,0,0|1,0,1]=4 3010 B11R1.201 CCOC(=O)CC1CC(=O)C1 Amb24764656 [0,1,0,1,0,0|1,0,0]=3 3011 B11R1.201 CCOC(=O)CC1CC(=O)N1 Amb25383556 [0,1,0,1,0,0|1,0,0]=3 3012 B11R1.201 CCOC(=O)CC1CC(O)C1 Amb22737535 [0,1,0,1,0,0|1,0,1]=4 3013 B11R1.201 CCOC(=O)C[C@@H]1C[C@@H](O)C1 Amb24183445 [0,1,0,1,0,0|1,0,1]=4 3014 B11R1.201 CCOC(=O)C[C@@H]1C[C@H](O)C1 Amb24183444 [0,1,0,1,0,0|1,0,1]=4 3015 B11R1.645 CC(=O)CC1CC(=O)C=C1C Amb24533019 [0,1,0,1,0,0|2,0,0]=4 3016 B11R1.645 CC(=O)CC1CC(=O)OC1=O Amb24422481 [0,1,0,1,0,0|1,0,1]=4 3017 B11R1.645 CC(=O)C[C@@H]1CC(=O)C=C1C Amb25143940 [0,1,0,1,0,0|2,0,0]=4 3018 B11R1.645 CC1=CC(=O)OC1CC(O)=O Amb18125925 [0,1,0,1,0,0|2,0,0]=4 3019 B11R1.645 CC1CC(=O)CC1CC(O)=O Amb24753844 [0,1,0,1,0,0|1,0,0]=3 3020 B11R1.645 CC1NC(=O)CC1CC(N)=O Amb24610179 [0,1,0,1,0,0|2,0,0]=4 3021 B11R1.645 CC1NC(=O)NC1CC(O)=O Amb25830349 [0,1,0,1,0,0|2,0,0]=4 3022 B11R1.645 CC=1CC(CC(O)=O)C(C)C1 Amb18125745 [0,1,0,1,0,0|2,0,0]=4 3023 B11R1.645 C[C@@H]1CC(=O)CC1CC(O)=O Amb24693856 [0,1,0,1,0,0|1,0,0]=3 3024 B11R1.645 C[C@@H]1NC(=O)C[C@@H]1CC(N)=O Amb25189700 [0,1,0,1,0,0|2,0,0]=4 3025 B11R1.645 C[C@@H]1NC(=O)C[C@H]1CC(O)=O Amb18830651 [0,1,0,1,0,0|1,0,0]=3 3026 B11R1.645 C[C@H]1CC(=O)O[C@H]1CC(O)=O Amb25361027 [0,1,0,1,0,0|2,0,0]=4 3027 B11R1.645 OC(=O)CC1CC(=O)OC1=O Amb1091982 [0,1,0,1,0,0|0,0,1]=3 3028 B11R1.645 OC(=O)CC1NC(=O)OC1=O Amb24419989 [0,1,0,1,0,0|1,0,1]=4 3029 B11R1.645 OC(=O)CC1OC(=O)CC1O Amb25122786 [0,1,0,1,0,0|2,0,0]=4 3030 B11R1.645 OC(=O)CN1CC(=O)OC1=O Amb24638171 [0,1,0,1,0,0|1,0,1]=4 3031 B11R1.645 OC(=O)C[C@@H]1NC(=O)OC1=O Amb24652427 [0,1,0,1,0,0|1,0,1]=4 3032 B11R1.645 OC(=O)C[C@@H]1OC(=O)C[C@H]1O Amb24557821 [0,1,0,1,0,0|2,0,0]=4 3033 B11R1.720 O=C(C1CC1)NCCC(=O)O Amb1120565 [0,1,0,1,0,0|2,0,0]=4 3034 B11R1.816 CC(=O)[C@@H]1C[C@@H]1C(=O)OCC Amb24765192 [0,1,0,1,0,0|1,0,0]=3 3035 B11R1.816 CCCC(=O)C1CC1C(O)=O Amb25384586 [0,1,0,1,0,0|1,0,0]=3 3036 B11R1.816 CCCC(=O)[C@@H]1C[C@H]1C(O)=O Amb25383058 [0,1,0,1,0,0|1,0,0]=3 3037 B11R1.816 CCNC(=O)C1CC1C(=O)O Amb17606125 [0,1,0,1,0,0|1,0,0]=3 3038 B11R1.816 CCOC(=O)C1CC1B(O)O Amb24314277 [0,1,0,1,0,0|1,0,1]=4 3039 B11R1.816 CCOC(=O)C1CC1C(=O)O Amb10068403 [0,1,0,1,0,0|0,0,0]=2 3040 B11R1.816 CCOC(=O)C1CC1[N+]([O-])=O Amb25383936 [0,1,0,1,0,0|1,0,1]=4 3041 B11R1.816 CCOC(=O)C1OC1C(=O)Cl Amb24763069 [0,1,0,1,0,0|2,0,0]=4 3042 B11R1.816 CCOC(=O)C1OC1C(N)=O Amb25386163 [0,1,0,1,0,0|2,0,0]=4 3043 B11R1.816 CCOC(=O)[C@@H]1O[C@@H]1C(O)=O Amb25384257 [0,1,0,1,0,0|1,0,0]=3 3044 B11R1.816 CCOC(=O)[C@@H]1O[C@H]1C(N)=O Amb25384255 [0,1,0,1,0,0|2,0,0]=4 3045 B11R1.816 CCOC(=O)[C@@H]1O[C@H]1C(O)=O Amb25383060 [0,1,0,1,0,0|1,0,0]=3 3046 B11R1.816 CCOC(=O)[C@H]1C[C@@H]1C(O)=O Amb22736069 [0,1,0,1,0,0|0,0,0]=2 3047 B11R1.816 CCOC(=O)[C@H]1C[C@H]1C(O)=O Amb24766317 [0,1,0,1,0,0|0,0,0]=2 3048 B11R1.816 CCOC(=O)[C@H]1O[C@@H]1C(N)=O Amb25383056 [0,1,0,1,0,0|2,0,0]=4 3049 B11R1.816 CCOC(=O)[C@H]1O[C@@H]1C(O)=O Amb25383061 [0,1,0,1,0,0|1,0,0]=3 3050 B11R1.816 CCOC(=O)[C@H]1O[C@H]1C(O)=O Amb25383059 [0,1,0,1,0,0|1,0,0]=3 3051 B11R1.816 CONC(=O)C1CC1[N+]([O-])=O Amb24719162 [0,1,0,1,0,0|1,0,1]=4 3052 B11R1.816 N#CNC(=O)C1CC1C(O)=O Amb25760506 [0,1,0,1,0,0|1,0,1]=4 3053 B11R1.50 COC1C[C@H](O)[C@H](O1)C(O)=O Amb24740762 [0,1,0,1,0,0|0,0,2]=4 3054 B11R1.50 C\C=C\1/CC(C(N)C1)C(O)=O Amb25072620 [0,1,0,1,0,0|2,0,0]=4 3055 B11R1.50 C\C=C\1/C[C@H]([C@@H](N)C1)C(O)=O Amb24545945 [0,1,0,1,0,0|2,0,0]=4 3056 B11R1.80 CC(=O)CC1CC(=O)C(C)=C1 Amb24532462 [0,1,0,1,0,0|2,0,0]=4 3057 B11R1.80 CC1=CC(CC(O)=O)OC1=O Amb18125922 [0,1,0,1,0,0|2,0,0]=4 3058 B11R1.80 CC1CC(CC1=O)CC(O)=O Amb25733744 [0,1,0,1,0,0|1,0,0]=3 3059 B11R1.80 CC=1CC(CC(O)=O)CC1C Amb25361000 [0,1,0,1,0,0|2,0,0]=4 3060 B11R1.80 CN1CC(CC(O)=O)OC1=O Amb18830410 [0,1,0,1,0,0|2,0,0]=4 3061 B11R1.80 NC1CC(CC(O)=O)NC1=O Amb24559191 [0,1,0,1,0,0|2,0,0]=4 3062 B11R1.80 N[C@H]1C[C@@H](CC(O)=O)NC1=O Amb24563703 [0,1,0,1,0,0|2,0,0]=4 3063 B11R1.80 N[C@H]1C[C@H](CC(O)=O)NC1=O Amb25274953 [0,1,0,1,0,0|2,0,0]=4 3064 B11R1.225 CC1NC(=O)NC1C(=O)OC Amb24511485 [0,1,0,1,0,0|2,0,0]=4 3065 B11R1.225 CC1NC(=O)OC1C(=O)OC Amb25248496 [0,1,0,1,0,0|1,0,0]=3 3066 B11R1.225 CC=1CC(O)C(N1)C(=O)OC Amb25262911 [0,1,0,1,0,0|2,0,0]=4 3067 B11R1.225 CC=1C[C@@H](O)C(N1)C(=O)OC Amb25065495 [0,1,0,1,0,0|2,0,0]=4 3068 B11R1.225 CC=1C[C@H](O)[C@H](N1)C(=O)OC Amb24520301 [0,1,0,1,0,0|2,0,0]=4 3069 B11R1.225 COC(=O)C1CC(=C)CC1N Amb25299258 [0,1,0,1,0,0|2,0,0]=4 3070 B11R1.225 COC(=O)N1CC(=O)CC1C Amb25341417 [0,1,0,1,0,0|2,0,0]=4 3071 B11R1.225 COC(=O)[C@@H]1CC(=C)C[C@@H]1N Amb24515017 [0,1,0,1,0,0|2,0,0]=4 3072 B11R1.225 COC(=O)[C@H]1NC(=O)C[C@@H]1O Amb24512957 [0,1,0,1,0,0|1,0,0]=3 3073 B11R1.225 C[C@@H]1CC(=O)N[C@H]1C(=O)OC Amb25202043 [0,1,0,1,0,0|1,0,0]=3 3074 B11R1.225 C[C@@H]1NC(=O)C[C@@H]1C(=O)OC Amb24513173 [0,1,0,1,0,0|2,0,0]=4 3075 B11R1.673 CC1=C(C(O)CC1=O)C(O)=O Amb25061289 [0,1,0,1,0,0|1,0,1]=4 3076 B11R1.673 CC1C(C(N)CC1=C)C(O)=O Amb24562576 [0,1,0,1,0,0|2,0,0]=4 3077 B11R1.673 CC1CC(=O)C(C)C1C(O)=O Amb24509293 [0,1,0,1,0,0|1,0,0]=3 3078 B11R1.673 CC1OC(=O)N(C)C1C(O)=O Amb25111200 [0,1,0,1,0,0|2,0,0]=4 3079 B11R1.673 CN1[C@@H](C(O)CC1=N)C(O)=O Amb25028079 [0,1,0,1,0,0|2,0,0]=4 3080 B11R1.673 C[C@@H]1OC(=O)[C@H](C)[C@@H]1C(O)=O Amb25257398 [0,1,0,1,0,0|2,0,0]=4 3081 B11R1.873 CC1C(C1C(O)=O)C(=O)OC Amb24443750 [0,1,0,1,0,0|0,0,0]=2 3082 B11R1.1039 CC(=O)CC1(C)CC(=O)CC1 Amb25129012 [0,1,0,1,0,0|2,0,0]=4 3083 B11R1.1039 CC1(CCC(=O)O1)CC(O)=O Amb24635619 [0,1,0,1,0,0|2,0,0]=4 3084 B11R1.1039 C[C@@]1(CCC(=O)O1)CC(O)=O Amb25216920 [0,1,0,1,0,0|2,0,0]=4 3085 B11R1.1039 OC(=O)C[C@@]1(O)COC(=O)C1 Amb25065359 [0,1,0,1,0,0|0,0,0]=2 3086 B11R1.1496 COC(=O)CC1(C)CC(=O)N1 Amb25818000 [0,1,0,1,0,0|1,0,0]=3 3087 B11R1.21 CC(=O)C1COC(=O)C(C)C1 Amb24520673 [0,1,0,1,0,0|1,0,0]=3 3088 B11R1.21 CC1CC(CCC1=O)C(O)=O Amb25172803 [0,1,0,1,0,0|1,0,0]=3 3089 B11R1.21 CC1CC(COC1=O)C(O)=O Amb24442976 [0,1,0,1,0,0|0,0,0]=2 3090 B11R1.21 CC=1C[C@H](CCC1C)C(O)=O Amb24432806 [0,1,0,1,0,0|2,0,0]=4 3091 B11R1.21 CN1CC(CCC1=O)C(O)=O Amb22799390 [0,1,0,1,0,0|1,0,0]=3 3092 B11R1.21 CN1C[C@H](CCC1=O)C(O)=O Amb24708059 [0,1,0,1,0,0|1,0,0]=3 3093 B11R1.21 OC(=O)C1CC(Cl)=C(Cl)CC1 Amb25360979 [0,1,0,1,0,0|2,0,0]=4 3094 B11R1.21 OC(=O)C1CCC(=O)C(=O)N1 Amb24361535 [0,1,0,1,0,0|2,0,0]=4 3095 B11R1.21 OC(=O)[C@H]1COC(=O)C(=O)N1 Amb24704939 [0,1,0,1,0,0|1,0,1]=4 3096 B11R1.22 CC=1CCC(CC1)C(=O)OC Amb22493627 [0,1,0,1,0,0|2,0,0]=4 3097 B11R1.22 CC=1CCC(NN1)C(=O)OC Amb24062283 [0,1,0,1,0,0|2,0,0]=4 3098 B11R1.22 CC=1CC[C@H](CC1)C(=O)OC Amb25684213 [0,1,0,1,0,0|2,0,0]=4 3099 B11R1.22 CCC(=O)C1CCC(=O)CC1 Amb24486227 [0,1,0,1,0,0|2,0,0]=4 3100 B11R1.22 CNC(=O)C1CNC(=O)CC1 Amb25330197 [0,1,0,1,0,0|2,0,0]=4 3101 B11R1.22 COC(=O)C1CCC(=O)CO1 Amb24569287 [0,1,0,1,0,0|0,0,0]=2 3102 B11R1.22 COC(=O)C1CCC(=O)NN1 Amb25832248 [0,1,0,1,0,0|1,0,0]=3 3103 B11R1.22 COC(=O)C1CCC(Br)=CC1 Amb24749863 [0,1,0,1,0,0|2,0,0]=4 3104 B11R1.22 COC(=O)C1CCC(Br)CO1 Amb20621567 [0,1,0,1,0,0|1,0,1]=4 3105 B11R1.22 COC(=O)C1CCC(Cl)=CC1 Amb24079688 [0,1,0,1,0,0|2,0,0]=4 3106 B11R1.22 COC(=O)C1CCC(O)CN1 Amb25246969 [0,1,0,1,0,0|1,0,1]=4 3107 B11R1.22 COC(=O)C1CN=C(N)CC1 Amb24062483 [0,1,0,1,0,0|2,0,0]=4 3108 B11R1.22 COC(=O)C1CNC(=O)CC1 Amb19957331 [0,1,0,1,0,0|1,0,0]=3 3109 B11R1.22 COC(=O)C1CNC(=O)CN1 Amb24419888 [0,1,0,1,0,0|2,0,0]=4 3110 B11R1.22 COC(=O)C=1CCC(=O)CC1 Amb24380856 [0,1,0,1,0,0|1,0,1]=4 3111 B11R1.22 COC(=O)C=1CCC(=O)NN1 Amb19930081 [0,1,0,1,0,0|1,0,1]=4 3112 B11R1.22 COC(=O)[C@@H]1CC[C@@H](N)CO1 Amb24697841 [0,1,0,1,0,0|1,0,1]=4 3113 B11R1.22 COC(=O)[C@@H]1CC[C@@H](O)CC1 Amb22756640 [0,1,0,1,0,0|1,0,1]=4 3114 B11R1.22 COC(=O)[C@@H]1CC[C@H](O)CC1 Amb23439292 [0,1,0,1,0,0|1,0,1]=4 3115 B11R1.22 COC(=O)[C@@H]1CC[C@H](O)CN1 Amb24571184 [0,1,0,1,0,0|1,0,1]=4 3116 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 Amb10608895 [0,1,0,1,0,0|2,0,0]=4 3117 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 Amb22748852 [0,1,0,1,0,0|2,0,0]=4 3118 B11R1.22 COC(=O)[C@H]1CNC(=O)CN1 Amb10608896 [0,1,0,1,0,0|2,0,0]=4 3119 B11R1.22 OCC(=O)N1CCC(=O)CC1 Amb18183137 [0,1,0,1,0,0|2,0,0]=4 3120 B11R1.648 CC1CNC(=O)CCCC1=O Amb25375715 [0,1,0,1,0,0|2,0,0]=4 3121 B11R1.672 CC1CC(C(=C)C1=O)C(O)=O Amb25772805 [0,1,0,1,0,0|1,0,1]=4 3122 B11R1.672 CC1C[C@@H](C(O)=O)N(C)C1=C Amb25226829 [0,1,0,1,0,0|2,0,0]=4 3123 B11R1.672 CC=1C(=O)C(C)CC1C(O)=O Amb24710133 [0,1,0,1,0,0|1,0,1]=4 3124 B11R1.672 CN1C(CN(C)C1=O)C(O)=O Amb22642302 [0,1,0,1,0,0|2,0,0]=4 3125 B11R1.672 CN1[C@@H](CN(C)C1=O)C(O)=O Amb25322026 [0,1,0,1,0,0|2,0,0]=4 3126 B11R1.853 CC(=O)C1CC(C1)C(=O)OC Amb25069415 [0,1,0,1,0,0|1,0,0]=3 3127 B11R1.853 CC(=O)N1CC(C1)C(=O)OC Amb21865555 [0,1,0,1,0,0|2,0,0]=4 3128 B11R1.853 CCC(=O)N1CC(C1)C(O)=O Amb24557385 [0,1,0,1,0,0|2,0,0]=4 3129 B11R1.853 CNC(=O)N1CC(C1)C(O)=O Amb24362890 [0,1,0,1,0,0|2,0,0]=4 3130 B11R1.853 COC(=O)C1CC(C1)B(O)O Amb24425880 [0,1,0,1,0,0|1,0,1]=4 3131 B11R1.853 COC(=O)C1CC(C1)C(O)=O Amb22504357 [0,1,0,1,0,0|0,0,0]=2 3132 B11R1.853 COC(=O)C1CC(O1)C(O)=O Amb25853830 [0,1,0,1,0,0|0,0,0]=2 3133 B11R1.853 COC(=O)N1CC(C1)C(O)=O Amb24486045 [0,1,0,1,0,0|1,0,0]=3 3134 B11R1.853 COC(=O)[C@@H]1C[C@@H](N1)C(O)=O Amb25264053 [0,1,0,1,0,0|0,0,0]=2 3135 B11R1.866 COC(=O)C1CCC(C)(C)O1 Amb25083673 [0,1,0,1,0,0|1,0,1]=4 3136 B11R1.866 COC(=O)[C@H]1CCC(C)(C)O1 Amb24576668 [0,1,0,1,0,0|1,0,1]=4 3137 B11R1.885 CC=1CCC(C)(C1)C(=O)OC Amb22365124 [0,1,0,1,0,0|2,0,0]=4 3138 B11R1.885 COC(=O)C1(C)CC(=O)CC1 Amb23454224 [0,1,0,1,0,0|1,0,0]=3 3139 B11R1.885 COC(=O)C1(C)CC(=O)NC1 Amb25712606 [0,1,0,1,0,0|2,0,0]=4 3140 B11R1.885 COC(=O)C1(C)CC(O)CC1 Amb23454229 [0,1,0,1,0,0|1,0,1]=4 3141 B11R1.885 COC(=O)C1(C)CCC(=O)N1 Amb23596470 [0,1,0,1,0,0|1,0,0]=3 3142 B11R1.885 COC(=O)C1(C)COC(=O)N1 Amb24709388 [0,1,0,1,0,0|2,0,0]=4 3143 B11R1.885 COC(=O)C1(C)COS(=O)O1 Amb24484654 [0,1,0,1,0,0|2,0,0]=4 3144 B11R1.885 COC(=O)[C@@]1(C)COS(=O)O1 Amb19133197 [0,1,0,1,0,0|2,0,0]=4 3145 B11R1.885 COC(=O)[C@]1(C)COC(=O)O1 Amb25675732 [0,1,0,1,0,0|1,0,0]=3 3146 B11R1.885 C[C@]1(COS(=O)O1)C(=O)OC Amb17617714 [0,1,0,1,0,0|2,0,0]=4 3147 B11R1.888 COC(=O)C1(C)CC1C(O)=O Amb25104877 [0,1,0,1,0,0|0,0,0]=2 3148 B11R1.44 CCC=1CCC(N1)C(=O)OC Amb23560256 [0,1,0,1,0,0|2,0,0]=4 3149 B11R1.44 COC(=O)C1CC(CC1)C=O Amb18644789 [0,1,0,1,0,0|1,0,1]=4 3150 B11R1.44 COC(=O)C1CCC(CN)O1 Amb24474950 [0,1,0,1,0,0|1,0,1]=4 3151 B11R1.44 COC(=O)C1CCC(N1)OC Amb25087834 [0,1,0,1,0,0|1,0,1]=4 3152 B11R1.44 COC(=O)C1CCC(O1)CO Amb13951705 [0,1,0,1,0,0|0,0,2]=4 3153 B11R1.44 COC(=O)C1CN(CC1)C=O Amb24689641 [0,1,0,1,0,0|2,0,0]=4 3154 B11R1.44 COC(=O)N1CCC(=C1)C=O Amb18125828 [0,1,0,1,0,0|2,0,0]=4 3155 B11R1.44 COC(=O)[C@@H]1CCC(=N1)OC Amb24408985 [0,1,0,1,0,0|1,0,0]=3 3156 B11R1.44 COC(=O)[C@@H]1CC[C@H](C=O)O1 Amb24548890 [0,1,0,1,0,0|0,0,1]=3 3157 B11R1.44 COC(=O)[C@@H]1CC[C@H](CN)O1 Amb25231224 [0,1,0,1,0,0|1,0,1]=4 3158 B11R1.44 COC(=O)[C@@H]1CC[C@H](CO)O1 Amb25168854 [0,1,0,1,0,0|0,0,2]=4 3159 B11R1.44 COC(=O)[C@H]1C[C@@H](CC1)C=O Amb25335264 [0,1,0,1,0,0|1,0,1]=4 3160 B11R1.851 CCC(=O)C1CC1C(=O)OC Amb25384044 [0,1,0,1,0,0|1,0,0]=3 3161 B11R1.851 CC[C@@H](O)[C@@H]1C[C@H]1C(=O)OC Amb25385764 [0,1,0,1,0,0|1,0,1]=4 3162 B11R1.851 CNC(=O)C1CC1C(=O)NC Amb25072323 [0,1,0,1,0,0|2,0,0]=4 3163 B11R1.851 CNC(=O)C1CC1C(=O)OC Amb24485296 [0,1,0,1,0,0|1,0,0]=3 3164 B11R1.851 COC(=O)C1CC1C(=O)NN Amb25837667 [0,1,0,1,0,0|1,0,0]=3 3165 B11R1.851 COC(=O)C1CC1C(=O)NO Amb24747952 [0,1,0,1,0,0|0,0,0]=2 3166 B11R1.851 COC(=O)C1CC1C(=O)OC Amb10807448 [0,1,0,1,0,0|0,0,0]=2 3167 B11R1.851 COC(=O)C1NC1C(=O)OC Amb10610624 [0,1,0,1,0,0|1,0,0]=3 3168 B11R1.851 COC(=O)[C@@H]1C[C@H]1C(=O)CBr Amb24764513 [0,1,0,1,0,0|1,0,0]=3 3169 B11R1.851 COC(=O)[C@@H]1N[C@H]1C(=O)OC Amb19374707 [0,1,0,1,0,0|1,0,0]=3 3170 B11R1.851 COC(=O)[C@@H]1O[C@@H]1C(=O)OC Amb25383998 [0,1,0,1,0,0|1,0,0]=3 3171 B11R1.851 COC(=O)[C@H]1C[C@H]1C(=O)CBr Amb25385836 [0,1,0,1,0,0|1,0,0]=3 3172 B11R1.851 ONC(=O)C1CC1C(=O)NO Amb25206130 [0,1,0,1,0,0|2,0,0]=4 3173 B11R1.865 CC1C(CCC1=O)C(=O)OC Amb25288216 [0,1,0,1,0,0|1,0,0]=3 3174 B11R1.865 CC1C(CNC1=O)C(=O)OC Amb25253304 [0,1,0,1,0,0|2,0,0]=4 3175 B11R1.865 CC=1C(=O)CCC1C(=O)OC Amb24690740 [0,1,0,1,0,0|1,0,1]=4 3176 B11R1.865 CN1C(CCC1=N)C(=O)OC Amb25046214 [0,1,0,1,0,0|2,0,0]=4 3177 B11R1.865 CN1C(CCC1=O)C(=O)NO Amb25833357 [0,1,0,1,0,0|1,0,0]=3 3178 B11R1.865 CN1C(CCC1=O)C(=O)OC Amb13887226 [0,1,0,1,0,0|1,0,0]=3 3179 B11R1.865 CN1[C@@H](CCC1=O)C(=O)NO Amb24612788 [0,1,0,1,0,0|1,0,0]=3 3180 B11R1.865 CN1[C@@H](CCC1=O)C(=O)OC Amb10602465 [0,1,0,1,0,0|1,0,0]=3 3181 B11R1.865 CN1[C@H](CCC1=O)C(=O)OC Amb10602464 [0,1,0,1,0,0|1,0,0]=3 3182 B11R1.865 CNC(=O)C1CCC(=O)N1C Amb25235244 [0,1,0,1,0,0|2,0,0]=4 3183 B11R1.865 COC(=O)C1CCC(=C)C1N Amb24334786 [0,1,0,1,0,0|2,0,0]=4 3184 B11R1.865 COC(=O)C1CCC(Br)C1=O Amb24729721 [0,1,0,1,0,0|1,0,1]=4 3185 B11R1.865 COC(=O)C1CCC(O)C1O Amb23456142 [0,1,0,1,0,0|0,0,2]=4 3186 B11R1.865 COC(=O)C1CNC(=O)C1=O Amb24311954 [0,1,0,1,0,0|1,0,1]=4 3187 B11R1.865 COC(=O)C1COC(=O)N1C Amb25061987 [0,1,0,1,0,0|2,0,0]=4 3188 B11R1.865 COC(=O)C=1CNC(=O)C1O Amb22515641 [0,1,0,1,0,0|1,0,1]=4 3189 B11R1.865 COC(=O)[C@@H]1CCC(=C)[C@H]1N Amb24626123 [0,1,0,1,0,0|2,0,0]=4 3190 B11R1.865 COC(=O)[C@@H]1CCC(=O)[C@H]1N Amb24443341 [0,1,0,1,0,0|1,0,0]=3 3191 B11R1.865 COC(=O)[C@H]1CC[C@@H](O)[C@@H]1Cl Amb25328923 [0,1,0,1,0,0|1,0,1]=4 3192 B11R1.865 COC(=O)[C@H]1CC[C@H](O)[C@H]1Cl Amb25245353 [0,1,0,1,0,0|1,0,1]=4 3193 B11R1.865 C[C@@H]1[C@@H](CCC1=O)C(=O)OC Amb25373227 [0,1,0,1,0,0|1,0,0]=3 3194 B11R1.865 C[C@@H]1[C@@H](O)CC[C@H]1C(=O)OC Amb24606653 [0,1,0,1,0,0|1,0,1]=4 3195 B11R1.865 C[C@@H]1[C@H](NCC1=O)C(=O)OC Amb25249931 [0,1,0,1,0,0|2,0,0]=4 3196 B11R1.865 C[C@H]1CC[C@@H]([C@@H]1O)C(=O)OC Amb24632556 [0,1,0,1,0,0|1,0,1]=4 3197 B11R1.896 CC1CC(CC(=O)OC)C1=O Amb25318994 [0,1,0,1,0,0|1,0,1]=4 3198 B11R1.850 COC(=O)C1CC1S(=O)(=O)Cl Amb25112459 [0,1,0,1,0,0|1,0,1]=4 3199 B11R1.515 CN1[C@@H](CCS1(=O)=O)C(O)=O Amb25790970 [0,1,0,1,0,0|2,0,0]=4 3200 B11R1.621 CCS(=O)(=O)C1CC1C(O)=O Amb23570248 [0,1,0,1,0,0|2,0,0]=4 3201 B11R1.710 OC(=O)CC1CCS(=O)(=O)C1 Amb1154428 [0,1,0,1,0,0|2,0,0]=4 3202 B11R1.710 OC(=O)CC1CC[S+]([O-])(=O)C1 Amb17780664 [0,1,0,1,0,0|2,0,0]=4 3203 B11R1.727 CC1(C)CCC(CO1)C(O)=O Amb24312659 [0,1,0,1,0,0|1,0,1]=4 3204 B11R1.727 OC(=O)C1CCS(=O)(=O)CC1 Amb2416634 [0,1,0,1,0,0|2,0,0]=4 3205 B11R1.3 CC(=O)C1CC=C(CC1)C=O Amb18125422 [0,1,0,1,0,0|2,0,0]=4 3206 B11R1.3 CO[C@@H]1CC[C@H](CC1)C(O)=O Amb24183374 [0,1,0,1,0,0|1,0,1]=4 3207 B11R1.3 N#CC=1CCC(CC1)C(O)=O Amb25110073 [0,1,0,1,0,0|2,0,0]=4 3208 B11R1.3 OC(=O)C1CCC(CC1)=NO Amb24487946 [0,1,0,1,0,0|1,0,1]=4 3209 B11R1.11 C\C=C(/C=O)\C1CC(=O)CC1 Amb24529996 [0,1,0,1,0,0|2,0,0]=4 3210 B11R1.473 CC1C(CCN1C=O)C(O)=O Amb25766216 [0,1,0,1,0,0|2,0,0]=4 3211 B11R1.473 CCN1CCC(C(O)=O)C1=O Amb25705239 [0,1,0,1,0,0|2,0,0]=4 3212 B11R1.473 CO[C@@H]1CC[C@H]([C@H]1N)C(O)=O Amb24693846 [0,1,0,1,0,0|1,0,1]=4 3213 B11R1.682 CCC(OC)C1CC1C(O)=O Amb24763057 [0,1,0,1,0,0|1,0,1]=4 3214 B11R1.1043 COC1(CCC1C(O)=O)OC Amb25751048 [0,1,0,1,0,0|0,0,2]=4 3215 B11R1.220 C=C1CCC(F)(CC1)C(O)=O Amb24708158 [0,1,0,1,0,0|2,0,0]=4 3216 B11R1.220 CC(=O)C1(C)CCC(=O)CC1 Amb22497449 [0,1,0,1,0,0|2,0,0]=4 3217 B11R1.220 CC1(CCC(=C)CC1)C(O)=O Amb24487806 [0,1,0,1,0,0|2,0,0]=4 3218 B11R1.220 CC1(CCC(=O)C=C1)C(O)=O Amb24728086 [0,1,0,1,0,0|1,0,1]=4 3219 B11R1.220 CC1(CCC(=O)CC1)C(O)=O Amb22227990 [0,1,0,1,0,0|1,0,0]=3 3220 B11R1.220 CC1(CCC(F)=CC1)C(O)=O Amb24557801 [0,1,0,1,0,0|2,0,0]=4 3221 B11R1.220 CC1(CNC(=O)CN1)C(O)=O Amb24742044 [0,1,0,1,0,0|2,0,0]=4 3222 B11R1.220 CC1(COC(=O)OC1)C(N)=O Amb24705425 [0,1,0,1,0,0|2,0,0]=4 3223 B11R1.220 CC=1CCC(C)(CC1)C(O)=O Amb18125736 [0,1,0,1,0,0|2,0,0]=4 3224 B11R1.220 CC=1CC[C@](C)(CC1)C(O)=O Amb24423868 [0,1,0,1,0,0|2,0,0]=4 3225 B11R1.220 O=C1CCC(CC1)(N)C(=O)O Amb16183881 [0,1,0,1,0,0|1,0,0]=3 3226 B11R1.220 OC(=O)C1(F)CCC(=O)CC1 Amb24533003 [0,1,0,1,0,0|1,0,0]=3 3227 B11R1.220 OC(=O)C1(O)CCS(=O)CC1 Amb24711232 [0,1,0,1,0,0|2,0,0]=4 3228 B11R1.226 CC1=CC(CC1O)C(=O)OC Amb24371253 [0,1,0,1,0,0|2,0,0]=4 3229 B11R1.226 CC1=C[C@@H](C[C@@H]1O)C(=O)OC Amb25221006 [0,1,0,1,0,0|2,0,0]=4 3230 B11R1.226 CC1CC(CC1=C)C(=O)OC Amb25320810 [0,1,0,1,0,0|2,0,0]=4 3231 B11R1.226 CC1CC(CC1=O)C(=O)OC Amb24706990 [0,1,0,1,0,0|1,0,0]=3 3232 B11R1.226 CC1CC(NC1=O)C(=O)OC Amb24682118 [0,1,0,1,0,0|1,0,0]=3 3233 B11R1.226 CC1C[C@@H](CC1=O)C(=O)OC Amb24528915 [0,1,0,1,0,0|1,0,0]=3 3234 B11R1.226 CC1C[C@@H](CC1O)C(=O)OC Amb25149737 [0,1,0,1,0,0|1,0,1]=4 3235 B11R1.226 CC1O[C@H](C[C@H]1O)C(=O)OC Amb25206624 [0,1,0,1,0,0|1,0,1]=4 3236 B11R1.226 CC1SC(CC1=O)C(=O)OC Amb24486291 [0,1,0,1,0,0|2,0,0]=4 3237 B11R1.226 COC(=O)C1CC(=C)C(=O)N1 Amb25685979 [0,1,0,1,0,0|1,0,1]=4 3238 B11R1.226 COC(=O)C1CC(=O)N(C1)C Amb2236345 [0,1,0,1,0,0|2,0,0]=4 3239 B11R1.226 COC(=O)C1CC(N)C(=O)N1 Amb18126108 [0,1,0,1,0,0|1,0,0]=3 3240 B11R1.226 COC(=O)C1CC(N)C(O)C1 Amb25228978 [0,1,0,1,0,0|1,0,1]=4 3241 B11R1.226 COC(=O)C1CC(O)C(Br)C1 Amb25149412 [0,1,0,1,0,0|1,0,1]=4 3242 B11R1.226 COC(=O)C1CC(O)C(F)C1 Amb22898817 [0,1,0,1,0,0|1,0,1]=4 3243 B11R1.226 COC(=O)C1CC(O)C(O)C1 Amb25686051 [0,1,0,1,0,0|1,0,1]=4 3244 B11R1.226 COC(=O)C1CN(C)C(=O)N1 Amb24664083 [0,1,0,1,0,0|2,0,0]=4 3245 B11R1.226 COC(=O)C1C[C@@H](N)[C@H](O)C1 Amb23456143 [0,1,0,1,0,0|1,0,1]=4 3246 B11R1.226 COC(=O)C1C[C@@H](O)[C@H](Br)C1 Amb24112913 [0,1,0,1,0,0|1,0,1]=4 3247 B11R1.226 COC(=O)C1C[C@@H](O)[C@H](O)C1 Amb24632510 [0,1,0,1,0,0|1,0,1]=4 3248 B11R1.226 COC(=O)C1C[C@H](O)[C@@H](O)C1 Amb24607309 [0,1,0,1,0,0|1,0,1]=4 3249 B11R1.226 COC(=O)C1C[C@H](O)[C@H](O)C1 Amb25357463 [0,1,0,1,0,0|1,0,1]=4 3250 B11R1.226 COC(=O)[C@@H]1CC(=C)C(=O)N1 Amb25074022 [0,1,0,1,0,0|1,0,1]=4 3251 B11R1.226 COC(=O)[C@@H]1CC(O)C(=O)N1 Amb24392740 [0,1,0,1,0,0|1,0,0]=3 3252 B11R1.226 COC(=O)[C@@H]1CN(C)C(=O)N1 Amb23598490 [0,1,0,1,0,0|2,0,0]=4 3253 B11R1.226 COC(=O)[C@@H]1C[C@@H](O)C(=O)O1 Amb24719560 [0,1,0,1,0,0|0,0,0]=2 3254 B11R1.226 COC(=O)[C@@H]1C[C@@H](O)[C@H](F)C1 Amb22756938 [0,1,0,1,0,0|1,0,1]=4 3255 B11R1.226 COC(=O)[C@@H]1C[C@H](F)C(=O)N1 Amb24512998 [0,1,0,1,0,0|1,0,0]=3 3256 B11R1.226 COC(=O)[C@@H]1C[C@H](N)C(=O)N1 Amb25217050 [0,1,0,1,0,0|1,0,0]=3 3257 B11R1.226 COC(=O)[C@@H]1C[C@H](O)C(=O)N1 Amb24555635 [0,1,0,1,0,0|1,0,0]=3 3258 B11R1.226 COC(=O)[C@H]1CC(=C)C(=O)N1 Amb25779340 [0,1,0,1,0,0|1,0,1]=4 3259 B11R1.226 COC(=O)[C@H]1CC(=O)C(=C)C1 Amb24612696 [0,1,0,1,0,0|1,0,1]=4 3260 B11R1.226 COC(=O)[C@H]1CN(C)C(=O)N1 Amb25836141 [0,1,0,1,0,0|2,0,0]=4 3261 B11R1.226 COC(=O)[C@H]1C[C@@H](N)[C@H](O)C1 Amb25263789 [0,1,0,1,0,0|1,0,1]=4 3262 B11R1.226 COC(=O)[C@H]1C[C@H](O)[C@@H](F)C1 Amb24630860 [0,1,0,1,0,0|1,0,1]=4 3263 B11R1.226 C[C@H]1C[C@H](NC1=O)C(=O)OC Amb25256067 [0,1,0,1,0,0|1,0,0]=3 3264 B11R1.314 CC(=O)C(=C)C1CCC(=O)O1 Amb24380776 [0,1,0,1,0,0|2,0,0]=4 3265 B11R1.314 CC(C(O)=O)N1CC(=O)CC1 Amb25294232 [0,1,0,1,0,0|2,0,0]=4 3266 B11R1.314 CC(C)C(=O)C1CC(=O)CC1 Amb24340516 [0,1,0,1,0,0|2,0,0]=4 3267 B11R1.314 CC(C1CCC(=O)N1)C(O)=O Amb24741902 [0,1,0,1,0,0|2,0,0]=4 3268 B11R1.314 CC(C1CCC(=O)O1)C(O)=O Amb25249128 [0,1,0,1,0,0|2,0,0]=4 3269 B11R1.314 CC(C1CNC(=O)C1)C(O)=O Amb24697093 [0,1,0,1,0,0|1,0,0]=3 3270 B11R1.314 CC(C1COC(=O)C1)C(C)O Amb25189580 [0,1,0,1,0,0|1,0,1]=4 3271 B11R1.314 CN(C)C(=O)C1CCC(=O)O1 Amb25231285 [0,1,0,1,0,0|1,0,0]=3 3272 B11R1.314 CN(C)C(=O)[C@H]1CCC(=O)N1 Amb24461970 [0,1,0,1,0,0|2,0,0]=4 3273 B11R1.314 CN(O)C(=O)[C@@H]1CCC(=O)N1 Amb25831045 [0,1,0,1,0,0|2,0,0]=4 3274 B11R1.314 C[C@H]([C@@H]1CCC(=O)C1)C(O)=O Amb24580212 [0,1,0,1,0,0|1,0,0]=3 3275 B11R1.314 C[C@H]([C@H]1CCC(=O)C1)C(O)=O Amb24635654 [0,1,0,1,0,0|1,0,0]=3 3276 B11R1.314 N[C@H](C1CCC(=O)C1)C(O)=O Amb25148224 [0,1,0,1,0,0|1,0,0]=3 3277 B11R1.314 N[C@H]([C@@H]1CCC(=O)O1)C(O)=O Amb24511954 [0,1,0,1,0,0|2,0,0]=4 3278 B11R1.314 N[C@H]([C@H]1CC(=O)NO1)C(O)=O Amb24391177 [0,1,0,1,0,0|2,0,0]=4 3279 B11R1.314 OC(=O)C(O)C1CCC(=O)O1 Amb24691407 [0,1,0,1,0,0|2,0,0]=4 3280 B11R1.314 OC(=O)[C@H](O)[C@@H]1CC(=O)C=C1 Amb24539294 [0,1,0,1,0,0|1,0,1]=4 3281 B11R1.321 CC(C1CC(C1)OC)C(O)=O Amb25148301 [0,1,0,1,0,0|1,0,1]=4 3282 B11R1.321 COC1CC(C1)C(N)C(O)=O Amb24742556 [0,1,0,1,0,0|1,0,1]=4 3283 B11R1.321 COC1CC(C1)C(O)C(O)=O Amb25148294 [0,1,0,1,0,0|1,0,1]=4 3284 B11R1.868 CC(=O)[C@@]1(C)C[C@H]1C(=O)OC Amb25370613 [0,1,0,1,0,0|1,0,0]=3 3285 B11R1.868 CCC(=O)C1CC1(C)C(O)=O Amb25780602 [0,1,0,1,0,0|1,0,0]=3 3286 B11R1.868 COC(=O)[C@H]1C[C@@]1(C)C(O)=O Amb25363170 [0,1,0,1,0,0|0,0,0]=2 3287 B11R1.1229 COC1CC(N)(CC1)C(O)=O Amb25678284 [0,1,0,1,0,0|1,0,1]=4 3288 B11R1.1270 CC=1CCC(C)(C(O)=O)C1C Amb24426138 [0,1,0,1,0,0|2,0,0]=4 3289 B11R1.1270 CC=1CC[C@@](C)(C(O)=O)C1C Amb24739606 [0,1,0,1,0,0|2,0,0]=4 3290 B11R1.1270 CN1C(=O)CCC1(C)C(N)=O Amb23515109 [0,1,0,1,0,0|2,0,0]=4 3291 B11R1.1270 CN1C(=O)CCC1(C)C(O)=O Amb23515115 [0,1,0,1,0,0|1,0,0]=3 3292 B11R1.1270 CN1C(=O)CCC1(O)C(O)=O Amb24487847 [0,1,0,1,0,0|1,0,0]=3 3293 B11R1.175 CC(C)=C1CC(CC1)C(O)=O Amb25257636 [0,1,0,1,0,0|2,0,0]=4 3294 B11R1.175 CC(C)C=1CCC(N1)C(O)=O Amb23454509 [0,1,0,1,0,0|2,0,0]=4 3295 B11R1.175 CC(C)C=1CC[C@H](N1)C(O)=O Amb25152719 [0,1,0,1,0,0|2,0,0]=4 3296 B11R1.315 CC1(C)C(CCC1=O)C(O)=O Amb23536043 [0,1,0,1,0,0|1,0,0]=3 3297 B11R1.315 CC1(C)C(COC1=O)C(O)=O Amb24470090 [0,1,0,1,0,0|2,0,0]=4 3298 B11R1.315 CC1(C)C(NCC1=O)C(O)=O Amb25282876 [0,1,0,1,0,0|2,0,0]=4 3299 B11R1.315 CC1(C)[C@@H](COC1=O)C(O)=O Amb24739644 [0,1,0,1,0,0|2,0,0]=4 3300 B11R1.704 CC(C)C(=O)C1CC1C(O)=O Amb25799668 [0,1,0,1,0,0|1,0,0]=3 3301 B11R1.704 CN(C(=O)C1CC1C(=O)O)C Amb17606127 [0,1,0,1,0,0|1,0,0]=3 3302 B11R2.68 O=C1CCC2CC1NC2=O Amb24423991 [0,0,0,2,0,0|2,0,0]=4 3303 B11R2.746 OC(=O)C12CC1C(=O)C=C2 Amb24358372 [0,0,0,2,0,0|1,0,1]=4 3304 B11R2.746 OC(=O)C12CNC(=O)C1C2 Amb25225360 [0,0,0,2,0,0|1,0,0]=3 3305 B11R2.60 O=C1CCC2C(=O)CCN12 Amb24662107 [0,0,0,2,0,0|2,0,0]=4 3306 B11R2.60 O=C1CCC2C1COC2=O Amb24524644 [0,0,0,2,0,0|1,0,0]=3 3307 B11R2.60 O=C1CC[C@@H]2[C@H]1CCC2=O Amb25298523 [0,0,0,2,0,0|2,0,0]=4 3308 B11R2.60 OC1CC[C@@H]2[C@H]1COC2=O Amb25215160 [0,0,0,2,0,0|1,0,1]=4 3309 B11R2.66 O=C1CC2C(C1)CCC2=O Amb25735878 [0,0,0,2,0,0|2,0,0]=4 3310 B11R2.66 O=C1CC2C(C1)COC2=O Amb25735126 [0,0,0,2,0,0|1,0,0]=3 3311 B11R2.66 O=C1CC2COC(=O)N2C1 Amb25783364 [0,0,0,2,0,0|2,0,0]=4 3312 B11R2.66 O=C1C[C@H]2CCC(=O)[C@H]2O1 Amb25288519 [0,0,0,2,0,0|1,0,0]=3 3313 B11R2.66 O=C1C[C@H]2[C@@H](C1)CCC2=O Amb25377838 [0,0,0,2,0,0|2,0,0]=4 3314 B11R2.66 O=C1NC2C(COC2=O)N1 Amb25789534 [0,0,0,2,0,0|2,0,0]=4 3315 B11R2.66 OC1CC2COC(=O)C2C1 Amb24543898 [0,0,0,2,0,0|1,0,1]=4 3316 B11R2.66 OC1OCC2CC(=O)OC21 Amb25251382 [0,0,0,2,0,0|0,0,2]=4 3317 B11R2.66 OC1OC[C@@H]2CC(=O)O[C@@H]21 Amb24515188 [0,0,0,2,0,0|0,0,2]=4 3318 B11R2.738 CC1C2CC(CC2=O)C1=O Amb25334980 [0,0,0,2,0,0|2,0,0]=4 3319 B11R2.914 COC(=O)C1CC2OC2C1 Amb18633179 [0,0,0,2,0,0|1,0,1]=4 3320 B11R2.914 COC(=O)C1C[C@@H]2O[C@H]2C1 Amb22756936 [0,0,0,2,0,0|1,0,1]=4 3321 B11R2.914 COC(=O)[C@@H]1C[C@H]2O[C@H]2C1 Amb22756937 [0,0,0,2,0,0|1,0,1]=4 3322 B11R2.139 O=C1CC2CC(=O)CC2C1 Amb21520316 [0,0,0,2,0,0|2,0,0]=4 3323 B11R2.139 O=C1CC2CC(=O)NC2N1 Amb25680114 [0,0,0,2,0,0|2,0,0]=4 3324 B11R2.139 O=C1CC2OC(=O)CC2C1 Amb24691720 [0,0,0,2,0,0|1,0,0]=3 3325 B11R2.139 O=C1C[C@H]2CC(=O)C[C@@H]2C1 Amb25347475 [0,0,0,2,0,0|2,0,0]=4 3326 B11R2.139 OC=1CC2CC(=O)CC2C1 Amb25298537 [0,0,0,2,0,0|2,0,0]=4 3327 B11R2.139 O[C@@H]1C[C@@H]2CC(=O)O[C@@H]2C1 Amb22801805 [0,0,0,2,0,0|1,0,1]=4 3328 B11R2.139 O[C@@H]1C[C@H]2CC(=O)O[C@H]2C1 Amb24563936 [0,0,0,2,0,0|1,0,1]=4 3329 B11R2.139 [C@@H]12CC(=O)C[C@@H]1CC(=O)C2 Amb17779325 [0,0,0,2,0,0|2,0,0]=4 3330 B11R2.530 OC(=O)C1C2C1CCC2=O Amb25263963 [0,0,0,2,0,0|1,0,0]=3 3331 B11R2.530 OC(=O)[C@@H]1C2C1CCC2=O Amb24542701 [0,0,0,2,0,0|1,0,0]=3 3332 B11R2.530 OC(=O)[C@H]1[C@H]2[C@@H]1CCC2=O Amb25174904 [0,0,0,2,0,0|1,0,0]=3 3333 B11R2.611 CN1NC(=O)C2CC2C1=O Amb22753640 [0,0,0,2,0,0|2,0,0]=4 3334 B7R0.6 C=C(Br)CCC(O)=O Amb18648212 [1,0,0,0,1,0|1,0,1]=4 3335 B7R0.6 C=C(Cl)CCC(O)=O Amb18642971 [1,0,0,0,1,0|1,0,1]=4 3336 B7R0.6 C=C(F)CCC(O)=O Amb25141041 [1,0,0,0,1,0|1,0,1]=4 3337 B7R0.6 CC(=C)CCC(=O)Cl Amb24640436 [1,0,0,0,1,0|2,0,0]=4 3338 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [1,0,0,0,1,0|1,0,0]=3 3339 B7R0.6 CC(=N)SCC(O)=O Amb25704672 [1,0,0,0,1,0|2,0,0]=4 3340 B7R0.6 CC(=O)CCB(O)O Amb25095502 [1,0,0,0,1,0|1,0,1]=4 3341 B7R0.6 CC(=O)CCC(=C)Br Amb24690678 [1,0,0,0,1,0|2,0,0]=4 3342 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [1,0,0,0,1,0|1,0,0]=3 3343 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [1,0,0,0,1,0|1,0,0]=3 3344 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [1,0,0,0,1,0|0,0,1]=3 3345 B7R0.6 CC(=O)CCP(O)=O Amb24647699 [1,0,0,0,1,0|1,0,0]=3 3346 B7R0.6 CC(=O)CCS(=O)=O Amb25730256 [1,0,0,0,1,0|1,0,1]=4 3347 B7R0.6 CC(=O)CC[N+]([O-])=O Amb18198961 [1,0,0,0,1,0|1,0,1]=4 3348 B7R0.6 CC(=O)CNC(N)=O Amb24697691 [1,0,0,0,1,0|2,0,0]=4 3349 B7R0.6 CC(=O)NCC(=O)N Amb17231824 [1,0,0,0,1,0|2,0,0]=4 3350 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [1,0,0,0,1,0|1,0,0]=3 3351 B7R0.6 CC(=O)OCC(=O)Br Amb25032214 [1,0,0,0,1,0|2,0,0]=4 3352 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [1,0,0,0,1,0|1,0,0]=3 3353 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [1,0,0,0,1,0|2,0,0]=4 3354 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [1,0,0,0,1,0|2,0,0]=4 3355 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [1,0,0,0,1,0|1,0,0]=3 3356 B7R0.6 CC(=O)SCC(C)=O Amb25131248 [1,0,0,0,1,0|2,0,0]=4 3357 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [1,0,0,0,1,0|2,0,0]=4 3358 B7R0.6 CC(=O)\C=C/C(O)=O Amb24662475 [1,0,0,0,1,0|0,0,2]=4 3359 B7R0.6 CC(=S)NCC(O)=O Amb24325138 [1,0,0,0,1,0|1,1,0]=4 3360 B7R0.6 CC(Br)CCC(O)=O Amb18124528 [1,0,0,0,1,0|1,0,1]=4 3361 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [1,0,0,0,1,0|2,0,0]=4 3362 B7R0.6 CC(C)CC[13C](O)=O Amb22337922 [1,0,0,0,1,0|1,0,1]=4 3363 B7R0.6 CC(CCC(=O)O)C Amb1153016 [1,0,0,0,1,0|1,0,1]=4 3364 B7R0.6 CC(CCC(=O)O)N Amb17593212 [1,0,0,0,1,0|1,0,1]=4 3365 B7R0.6 CC(Cl)CCC(O)=O Amb18124448 [1,0,0,0,1,0|1,0,1]=4 3366 B7R0.6 CC(F)CCC(O)=O Amb24682772 [1,0,0,0,1,0|1,0,1]=4 3367 B7R0.6 CC(N)CCC(O)=O Amb19515603 [1,0,0,0,1,0|1,0,1]=4 3368 B7R0.6 CC(O)CCC(C)=O Amb25829594 [1,0,0,0,1,0|1,0,1]=4 3369 B7R0.6 CC(O)CCC(O)=O Amb18294804 [1,0,0,0,1,0|0,0,2]=4 3370 B7R0.6 CN(C)CCC(O)=O Amb19888182 [1,0,0,0,1,0|2,0,0]=4 3371 B7R0.6 CS(=O)CCC(N)=O Amb24475802 [1,0,0,0,1,0|2,0,0]=4 3372 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [1,0,0,0,1,0|1,0,0]=3 3373 B7R0.6 CS(=O)NCC(O)=O Amb25237322 [1,0,0,0,1,0|2,0,0]=4 3374 B7R0.6 C[C@@H](O)CCC(C)=O Amb22351150 [1,0,0,0,1,0|1,0,1]=4 3375 B7R0.6 C[C@@H](S)CCC(O)=O Amb24587370 [1,0,0,0,1,0|0,1,1]=4 3376 B7R0.6 C[C@H](N)CCC(O)=O Amb25047328 [1,0,0,0,1,0|1,0,1]=4 3377 B7R0.6 C[S+](C)CCC(O)=O Amb22730539 [1,0,0,0,1,0|2,0,0]=4 3378 B7R0.6 NC(=N)CCC(O)=O Amb25736788 [1,0,0,0,1,0|2,0,0]=4 3379 B7R0.6 NC(=O)CCC(=O)N Amb1353209 [1,0,0,0,1,0|2,0,0]=4 3380 B7R0.6 NC(=O)CCP(O)=O Amb25840251 [1,0,0,0,1,0|2,0,0]=4 3381 B7R0.6 NC(=O)CNC(O)=O Amb24705097 [1,0,0,0,1,0|2,0,0]=4 3382 B7R0.6 NC(=O)NCC(=O)O Amb16205895 [1,0,0,0,1,0|2,0,0]=4 3383 B7R0.6 NC(=O)OCC(O)=O Amb25777061 [1,0,0,0,1,0|2,0,0]=4 3384 B7R0.6 NC(=O)SCC(O)=O Amb24640543 [1,0,0,0,1,0|2,0,0]=4 3385 B7R0.6 NC(=S)CCC(O)=O Amb18102382 [1,0,0,0,1,0|1,1,0]=4 3386 B7R0.6 O=C(F)CCC(=O)F Amb24483270 [1,0,0,0,1,0|2,0,0]=4 3387 B7R0.6 OB(O)CCC(O)=O Amb24640288 [1,0,0,0,1,0|1,0,1]=4 3388 B7R0.6 OC(=O)C=CC(O)=O Amb22487311 [1,0,0,0,1,0|0,0,2]=4 3389 B7R0.6 OC(=O)C=CC(O)=O Amb22487315 [1,0,0,0,1,0|0,0,2]=4 3390 B7R0.6 OC(=O)CCC(=O)Cl Amb17593468 [1,0,0,0,1,0|1,0,0]=3 3391 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [1,0,0,0,1,0|0,0,0]=2 3392 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [1,0,0,0,1,0|0,0,0]=2 3393 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [1,0,0,0,1,0|0,0,0]=2 3394 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [1,0,0,0,1,0|0,0,0]=2 3395 B7R0.6 OC(=O)CNC(=O)Cl Amb25277149 [1,0,0,0,1,0|2,0,0]=4 3396 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [1,0,0,0,1,0|0,0,0]=2 3397 B7R0.6 OC(=O)SCC(O)=O Amb24699018 [1,0,0,0,1,0|1,0,0]=3 3398 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [1,0,0,0,1,0|0,0,0]=2 3399 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [1,0,0,0,1,0|0,0,0]=2 3400 B7R0.6 OC(=O)\C=C/C(O)=O Amb22274309 [1,0,0,0,1,0|0,0,2]=4 3401 B7R0.6 OC(=O)\C=C/C(O)=O Amb22350132 [1,0,0,0,1,0|0,0,2]=4 3402 B7R0.6 OC(=O)\C=C\C(=O)O Amb10072561 [1,0,0,0,1,0|0,0,2]=4 3403 B7R0.6 OC(=O)\C=C\C(O)=O Amb22336584 [1,0,0,0,1,0|0,0,2]=4 3404 B7R0.6 OC(=O)\C=C\C(O)=O Amb22352586 [1,0,0,0,1,0|0,0,2]=4 3405 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353441 [1,0,0,0,1,0|0,0,2]=4 3406 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353537 [1,0,0,0,1,0|0,0,2]=4 3407 B7R0.6 OC(=O)\C=C\C(O)=O Amb22360655 [1,0,0,0,1,0|0,0,2]=4 3408 B7R0.6 OC(=O)\[13CH]=[13CH]\C(O)=O Amb22363150 [1,0,0,0,1,0|0,0,2]=4 3409 B7R0.6 OC(=O)\[14CH]=[14CH]/C(O)=O Amb22352435 [1,0,0,0,1,0|0,0,2]=4 3410 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [1,0,0,0,1,0|0,1,0]=3 3411 B7R0.6 OC(O)CCC(O)=O Amb25762802 [1,0,0,0,1,0|0,0,2]=4 3412 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [1,0,0,0,1,0|0,0,0]=2 3413 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [1,0,0,0,1,0|0,0,0]=2 3414 B7R0.6 O[13C](=O)\[13CH]=[13CH]\[13C](O)=O Amb22055283 [1,0,0,0,1,0|0,0,2]=4 3415 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [1,0,0,0,1,0|0,0,0]=2 3416 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [1,0,0,0,1,0|0,0,0]=2 3417 B7R0.6 [O-]C(=O)CCC(O)=O Amb22730137 [1,0,0,0,1,0|0,0,1]=3 3418 B7R0.6 [O-]C(=O)CCC(O)=O Amb22733837 [1,0,0,0,1,0|0,0,1]=3 3419 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22230230 [1,0,0,0,1,0|0,0,2]=4 3420 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22330623 [1,0,0,0,1,0|0,0,2]=4 3421 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22360668 [1,0,0,0,1,0|0,0,2]=4 3422 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22731284 [1,0,0,0,1,0|0,0,2]=4 3423 B7R0.6 [O-][N+](=O)CCC(=O)O Amb10843224 [1,0,0,0,1,0|1,0,1]=4 3424 B7R0.2 CC(=CC(O)=O)OC Amb24699194 [0,0,0,0,2,0|1,0,1]=4 3425 B7R0.2 CC(=O)CC(=O)SC Amb24097115 [0,0,0,0,2,0|1,1,0]=4 3426 B7R0.2 CC(=O)CC(=S)OC Amb24096829 [0,0,0,0,2,0|1,1,0]=4 3427 B7R0.2 CC(=O)NC(=O)OC Amb24657097 [0,0,0,0,2,0|2,0,0]=4 3428 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [0,0,0,0,2,0|2,0,0]=4 3429 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [0,0,0,0,2,0|1,0,0]=3 3430 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,0,0,0,2,0|2,0,0]=4 3431 B7R0.2 CNC(=O)CC(N)=O Amb24400836 [0,0,0,0,2,0|2,0,0]=4 3432 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,0,0,0,2,0|0,0,0]=2 3433 B7R0.2 COC(=O)CC(N)=N Amb18831173 [0,0,0,0,2,0|2,0,0]=4 3434 B7R0.2 COC(=O)CC(N)=N Amb19516886 [0,0,0,0,2,0|2,0,0]=4 3435 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,0,0,0,2,0|1,0,0]=3 3436 B7R0.2 COC(=O)CN(=O)=O Amb20621013 [0,0,0,0,2,0|1,0,1]=4 3437 B7R0.2 COC(=O)CS(C)=O Amb20626166 [0,0,0,0,2,0|2,0,0]=4 3438 B7R0.2 COC(=O)NC(=O)Cl Amb24483069 [0,0,0,0,2,0|2,0,0]=4 3439 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [0,0,0,0,2,0|1,0,1]=4 3440 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [0,0,0,0,2,0|2,0,0]=4 3441 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [0,0,0,0,2,0|2,0,0]=4 3442 B7R0.2 NNC(=O)CC(O)=O Amb25073925 [0,0,0,0,2,0|2,0,0]=4 3443 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [0,0,0,0,2,0|2,0,0]=4 3444 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [0,0,0,0,2,0|2,0,0]=4 3445 B7R0.2 [O-][N+](=O)CC(=O)OC Amb1101938 [0,0,0,0,2,0|1,0,1]=4 3446 B11R0.111 COC(=O)CCCCCC(=O)O Amb13887311 [0,0,0,0,0,2|0,0,0]=2 3447 B11R0.111 COC(=O)CCCSCC(=S)N Amb17503398 [0,0,0,0,0,2|1,1,0]=4